G4VD50_SCHMA Loading...

Interferon-related developmental regulator-related

AlphaFold DB , UniProt , Accession G4VD50, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 417 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	41.8	Very low	35.8	Very low	238 Å²	238	184.6 Å²	184.6	100%	1.172	89%	0.887	S	S	*	*				0	104.7	0	-66.7	176.5	88	0	0	108.8
2	P	43.5	Very low	35	Very low	130 Å²	130	182.4 Å²	182.4	84%	0.844	88%	0.882	S	S	*	*	P	Polyproline II helix	trans	-95.1	133.8	-173.5	31	-21.5	0	0	0	112	K4	P2-K4 PolarHBondContact O-N 3.33Å
3	K	41.3	Very low	34.6	Very low	208 Å²	208	178.5 Å²	178.5	90%	0.904	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-64.4	121.7	177.8	-67.2	177.7	176	179.3	0	110.3	K5	K3-K5 PolarHBondContact O-N 3.43Å
4	K	41.9	Very low	34.2	Very low	211 Å²	211	176.1 Å²	176.1	92%	0.917	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-63.3	117.2	173.5	-110.9	175.3	175.9	176.2	0	109.7	P2	P2-K4 PolarHBondContact O-N 3.33Å
5	K	39.3	Very low	34.1	Very low	204 Å²	204	176.3 Å²	176.3	89%	0.887	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-70.9	123.6	167	-80.3	-177.6	173	-178.9	0	109.5	K3	K3-K5 PolarHBondContact O-N 3.43Å
6	V	35.1	Very low	34	Very low	135 Å²	135	170.7 Å²	170.7	82%	0.818	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-72.1	123.9	165.5	177.2	0	0	0	0	107.4
7	K	34.2	Very low	34.3	Very low	196 Å²	196	164.8 Å²	164.8	85%	0.852	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-86.8	116.8	171.9	-97.4	-179.6	171.6	179.4	0	107.8	K9	K7-K9 PolarHBondContact O-N 3.21Å
8	D	30.7	Very low	34.5	Very low	155 Å²	155	159.2 Å²	159.2	83%	0.829	80%	0.8	S	S	*	*			trans	-60.8	115.5	166	-71.8	-41.6	0	0	0	109.7	K10	D8-K10 PolarHBondContact O-N 3.33Å
9	K	30.1	Very low	34.7	Very low	198 Å²	198	154.3 Å²	154.3	86%	0.861	78%	0.775	S	S	*	*			trans	-72.2	112.1	167.6	-91.8	179.7	171	-179.3	0	107.6	K7 I11	K7-K9 PolarHBondContact O-N 3.21Å; K9-I11 PolarHBondContact O-N 2.75Å; K9-I11 VanDerWaalsContact O-N 3.12Å
10	K	28.5	Very low	34.8	Very low	200 Å²	200	154.8 Å²	154.8	87%	0.87	78%	0.775	S	S	*	*			trans	-53.6	113.9	161	-83.9	-179.9	171.9	-178.8	0	108.6	D8 L12	D8-K10 PolarHBondContact O-N 3.33Å; K10-L12 PolarHBondContact O-N 3.28Å
11	I	27.5	Very low	34.9	Very low	156 Å²	156	149.2 Å²	149.2	80%	0.8	75%	0.747	S	S	*	*			trans	-69.3	110.1	167.4	-64.9	167.8	0	0	0	105.9	K9 V13	K9-I11 PolarHBondContact O-N 2.75Å; K9-I11 VanDerWaalsContact O-N 3.12Å; I11-V13 PolarHBondContact O-N 3.49Å
12	L	26.4	Very low	34.5	Very low	158 Å²	158	139 Å²	139	83%	0.827	70%	0.701	S	S	*	*			trans	-65.9	121.9	165	-119.1	94.6	0	0	0	106.3	K10 D14	K10-L12 PolarHBondContact O-N 3.28Å; L12-D14 PolarHBondContact O-N 3.28Å; L12-D14 VanDerWaalsContact O-N 3.07Å
13	V	29.1	Very low	33.9	Very low	132 Å²	132	135.9 Å²	135.9	80%	0.8	68%	0.682	S	S	*	*			trans	-65.3	107.6	167.7	177.2	0	0	0	0	106.4	I11 Q15	I11-V13 PolarHBondContact O-N 3.49Å; V13-Q15 PolarHBondContact O-N 3.12Å
14	D	29.3	Very low	33.4	Very low	144 Å²	144	130.9 Å²	130.9	77%	0.77	67%	0.669	S	S	*	*			trans	-61.7	120.4	175.9	-161.7	9.9	0	0	0	108.2	L12 S16	L12-D14 PolarHBondContact O-N 3.28Å; L12-D14 VanDerWaalsContact O-N 3.07Å; D14-S16 PolarHBondContact O-N 3.16Å
15	Q	33.1	Very low	32.9	Very low	180 Å²	180	123.1 Å²	123.1	84%	0.841	64%	0.639	S	S	*	*			trans	-71.2	100.5	170.7	-76.7	-179.4	-15.1	0	0	106.4	V13 D17	V13-Q15 PolarHBondContact O-N 3.12Å; Q15-D17 PolarHBondContact O-N 3.33Å
16	S	32.8	Very low	32.4	Very low	86 Å²	86	117 Å²	117	60%	0.601	62%	0.622	S	S	*	*			trans	-48.2	121.7	172.8	14.2	0	0	0	0	109.8	D14	D14-S16 PolarHBondContact O-N 3.16Å
17	D	38.9	Very low	32.3	Very low	70 Å²	70	117.2 Å²	117.2	37%	0.374	62%	0.618	S	S	.	*			trans	-56	127.5	-178.9	-155	-12	0	0	0	108.5	Q15 L19 E20	Q15-D17 PolarHBondContact O-N 3.33Å; D17-L19 PolarHBondContact O-N 3.16Å; D17-E20 PolarHBondContact O-N 3.46Å
18	P	38.1	Very low	32.3	Very low	65 Å²	65	113 Å²	113	42%	0.422	60%	0.597	S	S	.	*	H	α-helix	trans	-53.5	-23.1	177.3	-26.8	33.7	0	0	0	113.2	E20 L21 A22	P18-E20 VanDerWaalsContact C-N 3.32Å; P18-E20 PolarHBondContact O-N 2.62Å; P18-L21 PolarHBondContact O-N 3.25Å; P18-A22 PolarHBondContact O-N 2.87Å
19	L	37.2	Very low	32.5	Very low	65 Å²	65	111.1 Å²	111.1	34%	0.34	60%	0.597	S	S	.	*	H	α-helix	trans	-69	-19.3	173.9	-74.2	167.4	0	0	0	114.8	D17 K300	D17-L19 PolarHBondContact O-N 3.16Å; L19-K300 HydrophobicContact CD1-CB 4.15Å; L19-K300 HydrophobicContact CD1-CD 4.46Å; L19-K300 HydrophobicContact CD1-CG 3.85Å
20	E	36.8	Very low	32.7	Very low	164 Å²	164	109.1 Å²	109.1	77%	0.766	60%	0.595	S	S	*	*	H	α-helix	trans	-86.1	-23.2	170.4	-72	-142.2	155.3	0	0	112.7	D17 P18	D17-E20 PolarHBondContact O-N 3.46Å; P18-E20 VanDerWaalsContact C-N 3.32Å; P18-E20 PolarHBondContact O-N 2.62Å
21	L	37.3	Very low	32.9	Very low	38 Å²	38	102.9 Å²	102.9	20%	0.199	59%	0.587	C	S	.	*	H	α-helix	trans	-76.2	-31.4	174.5	-81.7	162.8	0	0	0	112.1	P18 S23	P18-L21 PolarHBondContact O-N 3.25Å; L21-S23 PolarHBondContact O-N 3.2Å
22	A	32.6	Very low	33.2	Very low	24 Å²	24	100.6 Å²	100.6	20%	0.198	59%	0.585	C	S	.	*	S	Bend	trans	-76.5	78.8	160.9	0	0	0	0	0	108.8	P18 V24	P18-A22 PolarHBondContact O-N 2.87Å; A22-V24 PolarHBondContact O-N 3Å
23	S	31.2	Very low	33.5	Very low	64 Å²	64	102.5 Å²	102.5	45%	0.448	59%	0.59	S	S	.	*			trans	-56.7	93.7	155.5	154.7	0	0	0	0	106.4	L21 V25	L21-S23 PolarHBondContact O-N 3.2Å; S23-V25 PolarHBondContact O-N 3.46Å; S23-V25 WeakPolarHBondContact OG-CG2 3.49Å
24	V	30.6	Very low	34	Very low	103 Å²	103	102 Å²	102	62%	0.624	59%	0.587	S	S	*	*			trans	-63.3	85.2	166.7	178.8	0	0	0	0	105.5	A22 S26	A22-V24 PolarHBondContact O-N 3Å; V24-S26 PolarHBondContact O-N 3.06Å
25	V	32.6	Very low	34.1	Very low	49 Å²	49	100.8 Å²	100.8	30%	0.297	59%	0.587	S	S	.	*			trans	-76.3	84.6	157.6	-170.8	0	0	0	0	102.9	S23 L27	S23-V25 PolarHBondContact O-N 3.46Å; S23-V25 WeakPolarHBondContact OG-CG2 3.49Å; V25-L27 PolarHBondContact O-N 3.25Å; V25-L27 VanDerWaalsContact O-N 3.15Å
26	S	28	Very low	33.9	Very low	75 Å²	75	98.7 Å²	98.7	52%	0.524	59%	0.587	S	S	.	*			trans	-45	128	138.2	67	0	0	0	0	103.6	V24 Y28	V24-S26 PolarHBondContact O-N 3.06Å; S26-Y28 PolarHBondContact O-N 3.01Å; S26-Y28 VanDerWaalsContact O-N 3.15Å
27	L	33.3	Very low	34	Very low	140 Å²	140	97.9 Å²	97.9	73%	0.733	59%	0.585	S	S	*	*	S	Bend	trans	-31.2	135.2	164.2	-75.8	147.7	0	0	0	106	V25	V25-L27 PolarHBondContact O-N 3.25Å; V25-L27 VanDerWaalsContact O-N 3.15Å
28	Y	34.5	Very low	33.5	Very low	107 Å²	107	98.7 Å²	98.7	42%	0.42	60%	0.596	S	S	.	*			trans	80.9	79.6	-177.5	-40.4	-104.1	0	0	0	116.1	S26 A394 R398	S26-Y28 PolarHBondContact O-N 3.01Å; S26-Y28 VanDerWaalsContact O-N 3.15Å; Y28-A394 HydrophobicContact CE1-CB 4.08Å; Y28-R398 HydrophobicContact CE1-CB 4.19Å; Y28-R398 VanDerWaalsContact CE2-NE 3.3Å; Y28-R398 VanDerWaalsContact CZ-NE 3.33Å
29	S	34.8	Very low	33.4	Very low	116 Å²	116	98.8 Å²	98.8	81%	0.811	60%	0.599	S	S	*	*			trans	-160	142.5	133	-149.4	0	0	0	0	111.8
30	D	33.2	Very low	33.5	Very low	156 Å²	156	97.7 Å²	97.7	83%	0.834	60%	0.595	S	S	*	*			trans	-98.3	159.9	-164.8	-167.8	13.1	0	0	0	111.7
31	G	33	Very low	33.7	Very low	68 Å²	68	94.7 Å²	94.7	70%	0.701	58%	0.584	S	S	*	*			trans	102.9	80.4	160	0	0	0	0	0	117
32	S	35.2	Very low	33.7	Very low	109 Å²	109	98.2 Å²	98.2	76%	0.762	61%	0.607	S	S	*	*			trans	-148.1	107.8	142.1	-168	0	0	0	0	109.2	T34	S32-T34 PolarHBondContact O-N 3.08Å
33	E	31.9	Very low	34	Very low	198 Å²	198	102.8 Å²	102.8	93%	0.925	62%	0.624	S	S	*	*			trans	-70.5	118.8	166.5	-60.7	-176.2	150.8	0	0	107.7
34	T	38.6	Very low	35.3	Very low	120 Å²	120	104.4 Å²	104.4	74%	0.736	63%	0.628	S	S	*	*			trans	-107.7	139.8	166.5	47.3	0	0	0	0	110	S32	S32-T34 PolarHBondContact O-N 3.08Å
35	P	32.1	Very low	36.7	Very low	119 Å²	119	101.3 Å²	101.3	77%	0.773	62%	0.616	S	S	*	*			trans	-70.4	150.8	-169.1	-9.6	26.6	0	0	0	111.7	A37	P35-A37 PolarHBondContact O-N 2.98Å
36	T	28.5	Very low	38.1	Very low	137 Å²	137	104.1 Å²	104.1	84%	0.84	63%	0.629	S	S	*	*			trans	-44.9	121.1	169.9	42.6	0	0	0	0	112.9
37	A	35.9	Very low	40.5	Very low	68 Å²	68	102.6 Å²	102.6	56%	0.562	62%	0.621	S	S	*	*			trans	-110.8	106.3	169.5	0	0	0	0	0	109.3	P35 V40	P35-A37 PolarHBondContact O-N 2.98Å; A37-V40 HydrophobicContact CB-CG2 3.48Å; A37-V40 VanDerWaalsContact CB-CG2 3.48Å
38	S	28.9	Very low	42.6	Very low	87 Å²	87	98.6 Å²	98.6	61%	0.608	60%	0.6	S	S	*	*			trans	-129.7	63.7	-179.1	60.9	0	0	0	0	110.9
39	S	35.3	Very low	44.9	Very low	68 Å²	68	99.4 Å²	99.4	48%	0.476	61%	0.608	S	S	.	*	S	Bend	trans	-171.7	5.9	166.6	51	0	0	0	0	114.4	D41 E43	S39-D41 PolarHBondContact O-N 2.98Å; S39-E43 VanDerWaalsContact CB-OE2 3.3Å; S39-E43 WeakPolarHBondContact CB-OE2 3.5Å; S39-E43 PolarHBondContact OG-OE2 2.85Å
40	V	40.3	Very low	47.4	Very low	42 Å²	42	96.6 Å²	96.6	26%	0.255	59%	0.588	S	S	.	*	H	α-helix	trans	-71.4	-34.2	-148.7	-168.6	0	0	0	0	115.6	A37 V42 E43 D44	A37-V40 HydrophobicContact CB-CG2 3.48Å; A37-V40 VanDerWaalsContact CB-CG2 3.48Å; V40-V42 PolarHBondContact O-N 3.02Å; V40-E43 PolarHBondContact O-N 3.08Å; V40-D44 HydrophobicContact CG1-CB 4.08Å; V40-D44 VanDerWaalsContact O-CB 3.25Å; V40-D44 WeakPolarHBondContact O-CB 3.3Å; V40-D44 PolarHBondContact O-N 3.37Å
41	D	40.3	Very low	50.2	Low	101 Å²	101	90.9 Å²	90.9	54%	0.54	56%	0.557	S	S	.	*	H	α-helix	trans	-72.7	-26.6	-161.1	-54.5	-53.6	0	0	0	115.2	S39 Q375	S39-D41 PolarHBondContact O-N 2.98Å; D41-Q375 PolarHBondContact OD1-NE2 2.73Å; D41-Q375 PolarHBondContact OD2-NE2 2.79Å
42	V	37.6	Very low	53	Low	111 Å²	111	89.4 Å²	89.4	67%	0.673	53%	0.533	S	S	*	.	H	α-helix	trans	-88.1	-33.6	172.4	-178	0	0	0	0	111	V40 L46	V40-V42 PolarHBondContact O-N 3.02Å; V42-L46 HydrophobicContact CG1-CD1 4.14Å; V42-L46 WeakPolarHBondContact O-CG 3.09Å; V42-L46 PolarHBondContact O-N 3.39Å
43	E	38.4	Very low	55.7	Low	120 Å²	120	89.4 Å²	89.4	56%	0.561	53%	0.525	S	S	*	.	H	α-helix	trans	-69.1	-33.6	177.8	-72.4	-178.3	154.3	0	0	112.1	S39 V40 A47	S39-E43 VanDerWaalsContact CB-OE2 3.3Å; S39-E43 WeakPolarHBondContact CB-OE2 3.5Å; S39-E43 PolarHBondContact OG-OE2 2.85Å; V40-E43 PolarHBondContact O-N 3.08Å; E43-A47 WeakPolarHBondContact O-CB 3.46Å; E43-A47 PolarHBondContact O-N 3.49Å
44	D	58.9	Low	58.7	Low	99 Å²	99	85 Å²	85	53%	0.529	50%	0.503	S	S	.	.	H	α-helix	trans	-74.4	-39.1	-178.8	-148	14.1	0	0	0	111.7	V40 A47 L48	V40-D44 HydrophobicContact CG1-CB 4.08Å; V40-D44 VanDerWaalsContact O-CB 3.25Å; V40-D44 WeakPolarHBondContact O-CB 3.3Å; V40-D44 PolarHBondContact O-N 3.37Å; D44-A47 PolarHBondContact O-N 3.42Å; D44-L48 PolarHBondContact O-N 2.89Å
45	G	59.3	Low	61.5	Low	37 Å²	37	79.3 Å²	79.3	38%	0.381	47%	0.468	S	S	.	.	H	α-helix	trans	-64.3	-47.9	173.5	0	0	0	0	0	112.8	A47 L48 E49	G45-A47 VanDerWaalsContact C-N 3.29Å; G45-A47 PolarHBondContact O-N 3.48Å; G45-L48 PolarHBondContact O-N 3.49Å; G45-E49 PolarHBondContact O-N 2.91Å
46	L	61.8	Low	64.5	Low	108 Å²	108	74.3 Å²	74.3	57%	0.565	44%	0.435	S	S	*	.	H	α-helix	trans	-64.8	-33.8	175.5	-70.2	173.6	0	0	0	112.2	V42 S50	V42-L46 HydrophobicContact CG1-CD1 4.14Å; V42-L46 WeakPolarHBondContact O-CG 3.09Å; V42-L46 PolarHBondContact O-N 3.39Å; L46-S50 WeakPolarHBondContact O-CB 3.37Å; L46-S50 PolarHBondContact O-N 3.47Å; L46-S50 VanDerWaalsContact O-N 3.11Å
47	A	77.7	Confident	67.7	Low	43 Å²	43	71.1 Å²	71.1	36%	0.355	42%	0.418	S	S	.	.	H	α-helix	trans	-65.1	-41.6	173.2	0	0	0	0	0	111.4	E43 D44 G45 S50 L51	E43-A47 WeakPolarHBondContact O-CB 3.46Å; E43-A47 PolarHBondContact O-N 3.49Å; D44-A47 PolarHBondContact O-N 3.42Å; G45-A47 VanDerWaalsContact C-N 3.29Å; G45-A47 PolarHBondContact O-N 3.48Å; A47-S50 PolarHBondContact O-N 3.2Å; A47-L51 WeakPolarHBondContact O-CB 3.48Å; A47-L51 WeakPolarHBondContact O-CG 3.26Å; A47-L51 PolarHBondContact O-N 3.06Å
48	L	79.4	Confident	70.6	Confident	56 Å²	56	68.3 Å²	68.3	29%	0.293	40%	0.395	S	S	.	.	H	α-helix	trans	-66.7	-42	178.6	-164.8	68.8	0	0	0	112.3	D44 G45 L51 L52 F86	D44-L48 PolarHBondContact O-N 2.89Å; G45-L48 PolarHBondContact O-N 3.49Å; L48-L51 WeakPolarHBondContact O-CB 3.43Å; L48-L51 PolarHBondContact O-N 3.41Å; L48-L52 WeakPolarHBondContact O-CG 3.48Å; L48-L52 PolarHBondContact O-N 3.09Å; L48-F86 HydrophobicContact CD1-CD1 3.52Å; L48-F86 HydrophobicContact CD1-CE1 3.57Å; L48-F86 HydrophobicContact CG-CD1 4.02Å; L48-F86 HydrophobicContact CG-CE1 4.32Å
49	E	81.6	Confident	73.9	Confident	124 Å²	124	64.1 Å²	64.1	58%	0.579	37%	0.366	S	S	*	.	H	α-helix	trans	-59.8	-46	173.5	-73.5	-179.9	177.9	0	0	111.5	G45 L51 L52 D53	G45-E49 PolarHBondContact O-N 2.91Å; E49-L51 VanDerWaalsContact C-N 3.26Å; E49-L51 PolarHBondContact O-N 3.25Å; E49-L52 WeakPolarHBondContact O-CB 3.04Å; E49-L52 PolarHBondContact O-N 3.02Å; E49-L52 VanDerWaalsContact O-N 3.13Å; E49-D53 PolarHBondContact O-N 3.25Å
50	S	88.3	Confident	76.7	Confident	58 Å²	58	65.2 Å²	65.2	41%	0.406	37%	0.367	S	S	.	.	H	α-helix	trans	-63.7	-31.8	175.8	-176.3	0	0	0	0	113	L46 A47 K54	L46-S50 WeakPolarHBondContact O-CB 3.37Å; L46-S50 PolarHBondContact O-N 3.47Å; L46-S50 VanDerWaalsContact O-N 3.11Å; A47-S50 PolarHBondContact O-N 3.2Å; S50-K54 WeakPolarHBondContact O-CG 3.44Å; S50-K54 PolarHBondContact O-N 3.12Å
51	L	91.6	Very high	79.4	Confident	35 Å²	35	67 Å²	67	18%	0.183	37%	0.374	C	S	.	.	H	α-helix	trans	-71	-40.6	173.3	-72.5	168.6	0	0	0	111.2	A47 L48 E49 D53 K54 V55 F80 F86	A47-L51 WeakPolarHBondContact O-CB 3.48Å; A47-L51 WeakPolarHBondContact O-CG 3.26Å; A47-L51 PolarHBondContact O-N 3.06Å; L48-L51 WeakPolarHBondContact O-CB 3.43Å; L48-L51 PolarHBondContact O-N 3.41Å; E49-L51 VanDerWaalsContact C-N 3.26Å; E49-L51 PolarHBondContact O-N 3.25Å; L51-D53 VanDerWaalsContact C-N 3.34Å; L51-D53 PolarHBondContact O-N 3.42Å; L51-K54 WeakPolarHBondContact O-CB 3.23Å; L51-K54 PolarHBondContact O-N 2.59Å; L51-K54 VanDerWaalsContact O-N 3.12Å; L51-V55 WeakPolarHBondContact O-CG2 3.3Å; L51-V55 PolarHBondContact O-N 3.33Å; L51-F80 HydrophobicContact CD2-CD1 4.36Å; L51-F80 HydrophobicContact CD2-CE1 3.91Å; L51-F86 HydrophobicContact CB-CE1 3.94Å; L51-F86 HydrophobicContact CB-CZ 4.27Å
52	L	91.2	Very high	82	Confident	38 Å²	38	62.3 Å²	62.3	20%	0.199	35%	0.349	C	S	.	.	H	α-helix	trans	-60.3	-41	174.7	-78.9	172.9	0	0	0	112	L48 E49 K54 V55 C56 F86 L88	L48-L52 WeakPolarHBondContact O-CG 3.48Å; L48-L52 PolarHBondContact O-N 3.09Å; E49-L52 WeakPolarHBondContact O-CB 3.04Å; E49-L52 PolarHBondContact O-N 3.02Å; E49-L52 VanDerWaalsContact O-N 3.13Å; L52-K54 VanDerWaalsContact C-N 3.26Å; L52-K54 PolarHBondContact O-N 3.16Å; L52-V55 WeakPolarHBondContact O-CA 2.99Å; L52-V55 WeakPolarHBondContact O-CB 3.19Å; L52-V55 PolarHBondContact O-N 3.12Å; L52-C56 PolarHBondContact O-N 3.29Å; L52-C56 PolarHBondContact O-SG 3.3Å; L52-F86 HydrophobicContact CD1-CD1 4.31Å; L52-F86 HydrophobicContact CD2-CB 3.98Å; L52-F86 HydrophobicContact CD2-CD1 3.28Å; L52-F86 HydrophobicContact CD2-CE1 3.84Å; L52-F86 HydrophobicContact CD2-CG 3.73Å; L52-F86 HydrophobicContact CG-CD1 3.54Å; L52-F86 HydrophobicContact CG-CE1 3.91Å; L52-F86 HydrophobicContact CG-CG 4.44Å; L52-L88 HydrophobicContact CD2-CD2 4.04Å
53	D	92.7	Very high	84.5	Confident	108 Å²	108	63 Å²	63	58%	0.578	35%	0.345	S	S	*	.	H	α-helix	trans	-59.6	-37.4	174.4	-74.8	-23	0	0	0	112.4	E49 L51 S57	E49-D53 PolarHBondContact O-N 3.25Å; L51-D53 VanDerWaalsContact C-N 3.34Å; L51-D53 PolarHBondContact O-N 3.42Å; D53-S57 WeakPolarHBondContact O-CB 3.43Å; D53-S57 PolarHBondContact O-N 3.2Å; D53-S57 PolarHBondContact O-OG 3.41Å
54	K	95.5	Very high	86.9	Confident	107 Å²	107	61.3 Å²	61.3	47%	0.465	34%	0.337	S	S	.	.	H	α-helix	trans	-70.5	-35.2	174.8	-66	170.5	-170.7	166.5	0	111.9	S50 L51 L52 A58 F80	S50-K54 WeakPolarHBondContact O-CG 3.44Å; S50-K54 PolarHBondContact O-N 3.12Å; L51-K54 WeakPolarHBondContact O-CB 3.23Å; L51-K54 PolarHBondContact O-N 2.59Å; L51-K54 VanDerWaalsContact O-N 3.12Å; L52-K54 VanDerWaalsContact C-N 3.26Å; L52-K54 PolarHBondContact O-N 3.16Å; K54-A58 VanDerWaalsContact O-CB 3.32Å; K54-A58 WeakPolarHBondContact O-CB 3.47Å; K54-A58 PolarHBondContact O-N 3.16Å; K54-F80 HydrophobicContact CB-CE2 4.22Å; K54-F80 HydrophobicContact CB-CZ 3.85Å; K54-F80 HydrophobicContact CD-CZ 4.42Å
55	V	95.9	Very high	88.4	Confident	0 Å²	0	66 Å²	66	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-62.2	-52.3	172.6	170.8	0	0	0	0	109.5	L51 L52 S57 A58 I59 L77 F80 F81 F86 W92	L51-V55 WeakPolarHBondContact O-CG2 3.3Å; L51-V55 PolarHBondContact O-N 3.33Å; L52-V55 WeakPolarHBondContact O-CA 2.99Å; L52-V55 WeakPolarHBondContact O-CB 3.19Å; L52-V55 PolarHBondContact O-N 3.12Å; V55-S57 VanDerWaalsContact C-N 3.35Å; V55-S57 PolarHBondContact O-N 3.29Å; V55-A58 PolarHBondContact O-N 2.97Å; V55-I59 HydrophobicContact CG1-CD1 4.14Å; V55-I59 WeakPolarHBondContact O-CG1 3.43Å; V55-I59 PolarHBondContact O-N 3.29Å; V55-L77 HydrophobicContact CB-CD2 4.43Å; V55-L77 HydrophobicContact CG1-CD2 3.8Å; V55-F80 HydrophobicContact CG2-CB 3.83Å; V55-F80 HydrophobicContact CG2-CD1 4.49Å; V55-F80 HydrophobicContact CG2-CD2 3.71Å; V55-F80 HydrophobicContact CG2-CE2 4.4Å; V55-F80 HydrophobicContact CG2-CG 3.79Å; V55-F81 HydrophobicContact CG1-CE1 4.01Å; V55-F81 HydrophobicContact CG1-CZ 3.77Å; V55-F86 HydrophobicContact CG2-CE1 4.49Å; V55-F86 HydrophobicContact CG2-CE2 4.15Å; V55-F86 HydrophobicContact CG2-CZ 3.87Å; V55-W92 HydrophobicContact CG1-CH2 3.76Å; V55-W92 HydrophobicContact CG1-CZ2 4.09Å
56	C	95.4	Very high	89.9	Confident	14 Å²	14	72.3 Å²	72.3	10%	0.095	37%	0.365	C	S	.	.	H	α-helix	trans	-54.4	-49.6	176.4	-65	0	0	0	0	111.6	L52 A58 I59 D60 Y94	L52-C56 PolarHBondContact O-N 3.29Å; L52-C56 PolarHBondContact O-SG 3.3Å; C56-A58 VanDerWaalsContact C-N 3.27Å; C56-A58 PolarHBondContact O-N 3.31Å; C56-I59 WeakPolarHBondContact O-CB 3.31Å; C56-I59 PolarHBondContact O-N 2.8Å; C56-D60 PolarHBondContact O-N 3.44Å; C56-Y94 HydrophobicContact CB-CD1 4.34Å; C56-Y94 HydrophobicContact CB-CD2 4.2Å; C56-Y94 HydrophobicContact CB-CE1 3.91Å; C56-Y94 HydrophobicContact CB-CE2 3.78Å; C56-Y94 HydrophobicContact CB-CG 4.48Å; C56-Y94 VanDerWaalsContact SG-CD2 3.58Å; C56-Y94 VanDerWaalsContact SG-CE2 3.57Å
57	S	95.9	Very high	91.3	Very high	69 Å²	69	69.6 Å²	69.6	48%	0.483	35%	0.353	S	S	.	.	H	α-helix	trans	-60.4	-35.4	177.3	-58.2	0	0	0	0	112.8	D53 V55 L61	D53-S57 WeakPolarHBondContact O-CB 3.43Å; D53-S57 PolarHBondContact O-N 3.2Å; D53-S57 PolarHBondContact O-OG 3.41Å; V55-S57 VanDerWaalsContact C-N 3.35Å; V55-S57 PolarHBondContact O-N 3.29Å; S57-L61 WeakPolarHBondContact O-CG 3.39Å; S57-L61 PolarHBondContact O-N 3.29Å
58	A	97.3	Very high	92.1	Very high	9 Å²	9	72.2 Å²	72.2	7%	0.074	36%	0.358	C	S	.	.	H	α-helix	trans	-73.4	-31	176.7	0	0	0	0	0	112.2	K54 V55 C56 L61 M62 A73 L77	K54-A58 VanDerWaalsContact O-CB 3.32Å; K54-A58 WeakPolarHBondContact O-CB 3.47Å; K54-A58 PolarHBondContact O-N 3.16Å; V55-A58 PolarHBondContact O-N 2.97Å; C56-A58 VanDerWaalsContact C-N 3.27Å; C56-A58 PolarHBondContact O-N 3.31Å; A58-L61 PolarHBondContact O-N 3.05Å; A58-M62 PolarHBondContact O-N 3.46Å; A58-A73 WeakPolarHBondContact O-CB 3.47Å; A58-L77 HydrophobicContact CB-CD1 4.39Å; A58-L77 HydrophobicContact CB-CD2 3.78Å; A58-L77 HydrophobicContact CB-CG 3.82Å
59	I	97.1	Very high	92.9	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-63.4	-45.5	173.4	-67.1	169.9	0	0	0	110.3	V55 C56 L61 M62 L77 W92 Y94 T97 L98	V55-I59 HydrophobicContact CG1-CD1 4.14Å; V55-I59 WeakPolarHBondContact O-CG1 3.43Å; V55-I59 PolarHBondContact O-N 3.29Å; C56-I59 WeakPolarHBondContact O-CB 3.31Å; C56-I59 PolarHBondContact O-N 2.8Å; I59-L61 PolarHBondContact O-N 3.29Å; I59-M62 VanDerWaalsContact O-CB 3.23Å; I59-M62 WeakPolarHBondContact O-CB 3.29Å; I59-M62 WeakPolarHBondContact O-CG 3.24Å; I59-M62 PolarHBondContact O-N 3.02Å; I59-L77 HydrophobicContact CG1-CD1 3.99Å; I59-L77 HydrophobicContact CG1-CD2 3.81Å; I59-W92 HydrophobicContact CD1-CH2 3.38Å; I59-W92 HydrophobicContact CD1-CZ2 4.21Å; I59-W92 HydrophobicContact CD1-CZ3 3.98Å; I59-Y94 HydrophobicContact CB-CD1 4.03Å; I59-Y94 HydrophobicContact CD1-CD1 4.13Å; I59-Y94 HydrophobicContact CD1-CG 4.33Å; I59-Y94 HydrophobicContact CG2-CD1 3.92Å; I59-T97 HydrophobicContact CG2-CG2 3.94Å; I59-L98 HydrophobicContact CD1-CB 4.13Å; I59-L98 HydrophobicContact CD1-CD2 4.19Å; I59-L98 HydrophobicContact CG1-CB 4.48Å; I59-L98 HydrophobicContact CG1-CD1 4.32Å; I59-L98 HydrophobicContact CG2-CB 4.28Å
60	D	95.7	Very high	93.5	Very high	91 Å²	91	67.3 Å²	67.3	49%	0.487	34%	0.335	S	S	.	.	H	α-helix	trans	-58.3	-37.3	177.3	-66.6	-27	0	0	0	112.2	C56 M62 E63	C56-D60 PolarHBondContact O-N 3.44Å; D60-M62 PolarHBondContact O-N 3.18Å; D60-E63 PolarHBondContact O-N 3.43Å
61	L	96.2	Very high	93.9	Very high	78 Å²	78	64.7 Å²	64.7	41%	0.408	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-72.3	-8.5	178.1	-67.5	173.9	0	0	0	113.9	S57 A58 I59 E63 E64 T69 A73	S57-L61 WeakPolarHBondContact O-CG 3.39Å; S57-L61 PolarHBondContact O-N 3.29Å; A58-L61 PolarHBondContact O-N 3.05Å; I59-L61 PolarHBondContact O-N 3.29Å; L61-E63 VanDerWaalsContact C-N 3.28Å; L61-E63 PolarHBondContact O-N 3.02Å; L61-E64 VanDerWaalsContact O-CB 3.31Å; L61-E64 WeakPolarHBondContact O-CB 3.44Å; L61-E64 PolarHBondContact O-N 3.35Å; L61-T69 HydrophobicContact CD2-CG2 4.08Å; L61-A73 HydrophobicContact CB-CB 3.65Å
62	M	95.2	Very high	94.2	Very high	3 Å²	3	66.1 Å²	66.1	2%	0.015	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-68.7	-27.5	174.2	-67.8	-176.6	60.5	0	0	112.5	A58 I59 D60 E64 R70 I74 L77 L98 I102 I105 L120	A58-M62 PolarHBondContact O-N 3.46Å; I59-M62 VanDerWaalsContact O-CB 3.23Å; I59-M62 WeakPolarHBondContact O-CB 3.29Å; I59-M62 WeakPolarHBondContact O-CG 3.24Å; I59-M62 PolarHBondContact O-N 3.02Å; D60-M62 PolarHBondContact O-N 3.18Å; M62-E64 VanDerWaalsContact C-N 3.31Å; M62-R70 WeakPolarHBondContact O-CD 3.18Å; M62-R70 WeakPolarHBondContact O-CG 3.38Å; M62-I74 HydrophobicContact CE-CG1 4.14Å; M62-I74 HydrophobicContact CG-CG1 4.26Å; M62-L77 HydrophobicContact CG-CD1 3.86Å; M62-L77 HydrophobicContact SD-CD1 3.36Å; M62-L77 WeakPolarHBondContact SD-CD1 3.36Å; M62-L98 HydrophobicContact CE-CD1 4.13Å; M62-L98 HydrophobicContact SD-CD1 3.57Å; M62-L98 VanDerWaalsContact SD-CD1 3.57Å; M62-I102 HydrophobicContact CE-CG1 4Å; M62-I105 HydrophobicContact CE-CD1 3.55Å; M62-L120 HydrophobicContact CE-CD2 3.77Å; M62-L120 HydrophobicContact SD-CD2 3.9Å
63	E	89	Confident	94.5	Very high	126 Å²	126	64.5 Å²	64.5	59%	0.589	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-88.1	-1	179.3	-59.4	-159	146.4	0	0	113.1	D60 L61	D60-E63 PolarHBondContact O-N 3.43Å; L61-E63 VanDerWaalsContact C-N 3.28Å; L61-E63 PolarHBondContact O-N 3.02Å
64	E	90.2	Very high	94.7	Very high	84 Å²	84	59.4 Å²	59.4	39%	0.393	29%	0.29	S	S	.	.			trans	-62	139	-178.2	-175.4	48	-128.3	0	0	111.9	L61 M62 R66 T69 R70	L61-E64 VanDerWaalsContact O-CB 3.31Å; L61-E64 WeakPolarHBondContact O-CB 3.44Å; L61-E64 PolarHBondContact O-N 3.35Å; M62-E64 VanDerWaalsContact C-N 3.31Å; E64-R66 VanDerWaalsContact C-N 3.3Å; E64-R66 HydrophobicContact CG-CB 4.31Å; E64-R66 PolarHBondContact O-N 2.92Å; E64-T69 HydrophobicContact CB-CG2 4.31Å; E64-T69 HydrophobicContact CG-CG2 3.93Å; E64-R70 PolarHBondContact O-NH1 3.27Å
65	K	89	Confident	94.8	Very high	197 Å²	197	59.3 Å²	59.3	86%	0.857	29%	0.286	S	S	*	.	S	Bend	trans	-65.6	-36.1	-176.7	-67.3	180	-178.5	175.2	0	111.4	T67 R70	K65-T67 PolarHBondContact O-N 3.34Å; K65-R70 PolarHBondContact O-NH1 2.79Å
66	R	92.1	Very high	94.9	Very high	171 Å²	171	61.8 Å²	61.8	65%	0.645	30%	0.304	S	S	*	.	S	Bend	trans	-70.6	116.6	-179.9	-174.4	172.8	-179.1	149.7	-0.1	110.9	E64 E68 T69 R70	E64-R66 VanDerWaalsContact C-N 3.3Å; E64-R66 HydrophobicContact CG-CB 4.31Å; E64-R66 PolarHBondContact O-N 2.92Å; R66-E68 VanDerWaalsContact C-N 3.33Å; R66-E68 PolarHBondContact O-N 3.21Å; R66-T69 WeakPolarHBondContact CD-OG1 3.38Å; R66-T69 PolarHBondContact O-N 2.91Å; R66-T69 VanDerWaalsContact O-N 3.16Å; R66-R70 PolarHBondContact O-N 3.48Å; R66-R70 VanDerWaalsContact O-N 3.12Å
67	T	91.2	Very high	95	Very high	51 Å²	51	61.1 Å²	61.1	31%	0.313	30%	0.299	S	S	.	.	H	α-helix	trans	-56.4	-42.9	-177.4	-56.4	0	0	0	0	113.1	K65 T69 R70 I71	K65-T67 PolarHBondContact O-N 3.34Å; T67-T69 PolarHBondContact O-N 2.72Å; T67-R70 PolarHBondContact O-N 2.93Å; T67-R70 PolarHBondContact OG1-NH2 3.44Å; T67-I71 HydrophobicContact CG2-CD1 3.7Å; T67-I71 HydrophobicContact CG2-CG1 4.27Å; T67-I71 WeakPolarHBondContact O-CB 3.47Å; T67-I71 VanDerWaalsContact O-CG1 3.3Å; T67-I71 WeakPolarHBondContact O-CG1 3.48Å; T67-I71 PolarHBondContact O-N 3.14Å
68	E	94.4	Very high	95.2	Very high	98 Å²	98	58.2 Å²	58.2	46%	0.458	28%	0.278	S	S	.	.	H	α-helix	trans	-64.2	-40.5	180	-172.3	60.6	-155.8	0	0	112.5	R66 I71 N72	R66-E68 VanDerWaalsContact C-N 3.33Å; R66-E68 PolarHBondContact O-N 3.21Å; E68-I71 PolarHBondContact O-N 3.35Å; E68-N72 WeakPolarHBondContact O-CB 3.44Å; E68-N72 VanDerWaalsContact O-CG 3.26Å; E68-N72 PolarHBondContact O-N 3.05Å; E68-N72 PolarHBondContact O-ND2 2.85Å; E68-N72 VanDerWaalsContact O-ND2 3.09Å; E68-N72 PolarHBondContact OE1-ND2 3.4Å
69	T	95.4	Very high	95.2	Very high	47 Å²	47	62.3 Å²	62.3	29%	0.288	30%	0.296	S	S	.	.	H	α-helix	trans	-64	-48.3	177.7	-52.4	0	0	0	0	110.4	L61 E64 R66 T67 I71 N72 A73	L61-T69 HydrophobicContact CD2-CG2 4.08Å; E64-T69 HydrophobicContact CB-CG2 4.31Å; E64-T69 HydrophobicContact CG-CG2 3.93Å; R66-T69 WeakPolarHBondContact CD-OG1 3.38Å; R66-T69 PolarHBondContact O-N 2.91Å; R66-T69 VanDerWaalsContact O-N 3.16Å; T67-T69 PolarHBondContact O-N 2.72Å; T69-I71 PolarHBondContact O-N 3.46Å; T69-N72 PolarHBondContact O-N 3.19Å; T69-A73 WeakPolarHBondContact O-CB 3.27Å; T69-A73 PolarHBondContact O-N 3.29Å
70	R	95	Very high	95.1	Very high	29 Å²	29	64.2 Å²	64.2	11%	0.109	30%	0.304	C	S	.	.	H	α-helix	trans	-59.2	-46.4	176.7	177.9	173.4	65.9	-106.5	0.8	112.4	M62 E64 K65 R66 T67 N72 A73 I74 D113	M62-R70 WeakPolarHBondContact O-CD 3.18Å; M62-R70 WeakPolarHBondContact O-CG 3.38Å; E64-R70 PolarHBondContact O-NH1 3.27Å; K65-R70 PolarHBondContact O-NH1 2.79Å; R66-R70 PolarHBondContact O-N 3.48Å; R66-R70 VanDerWaalsContact O-N 3.12Å; T67-R70 PolarHBondContact O-N 2.93Å; T67-R70 PolarHBondContact OG1-NH2 3.44Å; R70-N72 VanDerWaalsContact C-N 3.32Å; R70-N72 PolarHBondContact O-N 3.1Å; R70-A73 WeakPolarHBondContact O-CB 3.49Å; R70-A73 PolarHBondContact O-N 3Å; R70-I74 HydrophobicContact CG-CD1 3.97Å; R70-I74 VanDerWaalsContact O-CG1 3.26Å; R70-I74 WeakPolarHBondContact O-CG1 3.27Å; R70-I74 PolarHBondContact O-N 3.42Å; R70-D113 IonicContact CZ-OD2 3.35Å; R70-D113 VanDerWaalsContact CZ-OD2 3.32Å; R70-D113 IonicContact NE-OD2 3.44Å; R70-D113 PolarHBondContact NE-OD2 3Å; R70-D113 IonicContact NH2-OD2 2.75Å; R70-D113 PolarHBondContact NH2-OD2 3.17Å
71	I	95.8	Very high	95.2	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-60.6	-42.5	177.7	-74.5	174	0	0	0	111.3	T67 E68 T69 I74 R75 Q112 L116	T67-I71 HydrophobicContact CG2-CD1 3.7Å; T67-I71 HydrophobicContact CG2-CG1 4.27Å; T67-I71 WeakPolarHBondContact O-CB 3.47Å; T67-I71 VanDerWaalsContact O-CG1 3.3Å; T67-I71 WeakPolarHBondContact O-CG1 3.48Å; T67-I71 PolarHBondContact O-N 3.14Å; E68-I71 PolarHBondContact O-N 3.35Å; T69-I71 PolarHBondContact O-N 3.46Å; I71-I74 PolarHBondContact O-N 3.26Å; I71-R75 VanDerWaalsContact CG2-NH1 3.33Å; I71-R75 WeakPolarHBondContact O-CG 3.39Å; I71-R75 PolarHBondContact O-N 3.18Å; I71-Q112 HydrophobicContact CD1-CG 4.41Å; I71-L116 HydrophobicContact CG2-CD1 3.83Å
72	N	97.3	Very high	95.2	Very high	64 Å²	64	59.5 Å²	59.5	34%	0.342	27%	0.274	S	S	.	.	H	α-helix	trans	-69.5	-36.4	179.6	-69.8	-29	0	0	0	111.8	E68 T69 R70 R75 S76	E68-N72 WeakPolarHBondContact O-CB 3.44Å; E68-N72 VanDerWaalsContact O-CG 3.26Å; E68-N72 PolarHBondContact O-N 3.05Å; E68-N72 PolarHBondContact O-ND2 2.85Å; E68-N72 VanDerWaalsContact O-ND2 3.09Å; E68-N72 PolarHBondContact OE1-ND2 3.4Å; T69-N72 PolarHBondContact O-N 3.19Å; R70-N72 VanDerWaalsContact C-N 3.32Å; R70-N72 PolarHBondContact O-N 3.1Å; N72-R75 PolarHBondContact O-N 3.08Å; N72-R75 PolarHBondContact OD1-NH1 3.01Å; N72-S76 PolarHBondContact O-N 3.33Å; N72-S76 PolarHBondContact O-OG 3.43Å; N72-S76 VanDerWaalsContact O-OG 3.04Å
73	A	97.7	Very high	95.1	Very high	5 Å²	5	60.7 Å²	60.7	4%	0.041	28%	0.283	C	S	.	.	H	α-helix	trans	-59.1	-49.5	171.2	0	0	0	0	0	112	A58 L61 T69 R70 R75 S76 L77	A58-A73 WeakPolarHBondContact O-CB 3.47Å; L61-A73 HydrophobicContact CB-CB 3.65Å; T69-A73 WeakPolarHBondContact O-CB 3.27Å; T69-A73 PolarHBondContact O-N 3.29Å; R70-A73 WeakPolarHBondContact O-CB 3.49Å; R70-A73 PolarHBondContact O-N 3Å; A73-R75 VanDerWaalsContact C-N 3.34Å; A73-R75 PolarHBondContact O-N 3.38Å; A73-S76 PolarHBondContact O-N 3.48Å; A73-L77 WeakPolarHBondContact O-CG 3.3Å; A73-L77 PolarHBondContact O-N 2.96Å
74	I	98	Very high	95.2	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.6	-43.5	177.7	-62.1	162	0	0	0	111.1	M62 R70 I71 L77 I78 I105 L116 L120	M62-I74 HydrophobicContact CE-CG1 4.14Å; M62-I74 HydrophobicContact CG-CG1 4.26Å; R70-I74 HydrophobicContact CG-CD1 3.97Å; R70-I74 VanDerWaalsContact O-CG1 3.26Å; R70-I74 WeakPolarHBondContact O-CG1 3.27Å; R70-I74 PolarHBondContact O-N 3.42Å; I71-I74 PolarHBondContact O-N 3.26Å; I74-L77 PolarHBondContact O-N 3.24Å; I74-I78 HydrophobicContact CG2-CD1 4.03Å; I74-I78 VanDerWaalsContact O-CG1 3.31Å; I74-I78 WeakPolarHBondContact O-CG1 3.37Å; I74-I78 PolarHBondContact O-N 3.29Å; I74-I105 HydrophobicContact CD1-CD1 3.74Å; I74-I105 HydrophobicContact CG1-CD1 4.37Å; I74-L116 HydrophobicContact CG2-CB 3.66Å; I74-L120 HydrophobicContact CG2-CB 4.18Å; I74-L120 HydrophobicContact CG2-CD2 4.02Å
75	R	97.9	Very high	95.2	Very high	105 Å²	105	53.4 Å²	53.4	40%	0.396	25%	0.249	S	C	.	.	H	α-helix	trans	-62.8	-42.9	177.2	-75.1	175.4	179.8	144.2	-0	112.6	I71 N72 A73 L77 I78 E79 L116	I71-R75 VanDerWaalsContact CG2-NH1 3.33Å; I71-R75 WeakPolarHBondContact O-CG 3.39Å; I71-R75 PolarHBondContact O-N 3.18Å; N72-R75 PolarHBondContact O-N 3.08Å; N72-R75 PolarHBondContact OD1-NH1 3.01Å; A73-R75 VanDerWaalsContact C-N 3.34Å; A73-R75 PolarHBondContact O-N 3.38Å; R75-L77 VanDerWaalsContact C-N 3.34Å; R75-I78 PolarHBondContact O-N 3.42Å; R75-E79 PolarHBondContact O-N 3.34Å; R75-L116 HydrophobicContact CG-CD1 4.27Å; R75-L116 HydrophobicContact CG-CD2 4.31Å
76	S	97.8	Very high	95.2	Very high	53 Å²	53	44.5 Å²	44.5	37%	0.371	21%	0.21	S	C	.	.	H	α-helix	trans	-61.5	-43.9	176.3	-63.4	0	0	0	0	111.2	N72 A73 I78 E79 F80	N72-S76 PolarHBondContact O-N 3.33Å; N72-S76 PolarHBondContact O-OG 3.43Å; N72-S76 VanDerWaalsContact O-OG 3.04Å; A73-S76 PolarHBondContact O-N 3.48Å; S76-I78 PolarHBondContact O-N 3.34Å; S76-E79 PolarHBondContact O-N 3.07Å; S76-F80 WeakPolarHBondContact O-CD2 3.22Å; S76-F80 WeakPolarHBondContact O-CG 3.47Å; S76-F80 PolarHBondContact O-N 3.39Å
77	L	98.1	Very high	94.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-44	176	-69.5	168.6	0	0	0	112.3	V55 A58 I59 M62 A73 I74 R75 E79 F80 F81 L98 L120	V55-L77 HydrophobicContact CB-CD2 4.43Å; V55-L77 HydrophobicContact CG1-CD2 3.8Å; A58-L77 HydrophobicContact CB-CD1 4.39Å; A58-L77 HydrophobicContact CB-CD2 3.78Å; A58-L77 HydrophobicContact CB-CG 3.82Å; I59-L77 HydrophobicContact CG1-CD1 3.99Å; I59-L77 HydrophobicContact CG1-CD2 3.81Å; M62-L77 HydrophobicContact CG-CD1 3.86Å; M62-L77 HydrophobicContact SD-CD1 3.36Å; M62-L77 WeakPolarHBondContact SD-CD1 3.36Å; A73-L77 WeakPolarHBondContact O-CG 3.3Å; A73-L77 PolarHBondContact O-N 2.96Å; I74-L77 PolarHBondContact O-N 3.24Å; R75-L77 VanDerWaalsContact C-N 3.34Å; L77-E79 VanDerWaalsContact C-N 3.3Å; L77-E79 PolarHBondContact O-N 3Å; L77-F80 PolarHBondContact O-N 2.97Å; L77-F81 HydrophobicContact CB-CE2 4.36Å; L77-F81 HydrophobicContact CD2-CE2 4.34Å; L77-F81 WeakPolarHBondContact O-CD2 3.49Å; L77-F81 WeakPolarHBondContact O-CG 3.36Å; L77-F81 PolarHBondContact O-N 3.22Å; L77-L98 HydrophobicContact CD1-CD1 4.46Å; L77-L120 HydrophobicContact CB-CD1 3.58Å; L77-L120 HydrophobicContact CB-CD2 4.15Å; L77-L120 HydrophobicContact CD1-CD2 3.93Å
78	I	98.1	Very high	94.2	Very high	7 Å²	7	39 Å²	39	4%	0.036	20%	0.197	C	C	.	.	H	α-helix	trans	-56.9	-48	173.9	-68.2	163.6	0	0	0	109.9	I74 R75 S76 F80 F81 R82 L116 D119 L120 V123	I74-I78 HydrophobicContact CG2-CD1 4.03Å; I74-I78 VanDerWaalsContact O-CG1 3.31Å; I74-I78 WeakPolarHBondContact O-CG1 3.37Å; I74-I78 PolarHBondContact O-N 3.29Å; R75-I78 PolarHBondContact O-N 3.42Å; S76-I78 PolarHBondContact O-N 3.34Å; I78-F80 PolarHBondContact O-N 3.4Å; I78-F81 PolarHBondContact O-N 3.04Å; I78-R82 HydrophobicContact CG2-CG 4.21Å; I78-R82 WeakPolarHBondContact O-CB 3.23Å; I78-R82 WeakPolarHBondContact O-CG 3.46Å; I78-R82 PolarHBondContact O-N 2.96Å; I78-L116 HydrophobicContact CD1-CB 4.47Å; I78-L116 HydrophobicContact CD1-CD2 4.05Å; I78-D119 HydrophobicContact CD1-CB 3.92Å; I78-L120 HydrophobicContact CD1-CB 4.38Å; I78-L120 HydrophobicContact CG1-CB 3.85Å; I78-L120 HydrophobicContact CG1-CD1 4.23Å; I78-V123 HydrophobicContact CG1-CG2 4.48Å
79	E	97.3	Very high	93.4	Very high	96 Å²	96	38.1 Å²	38.1	45%	0.449	20%	0.196	S	C	.	.	H	α-helix	trans	-65	-40.4	-178.2	-170.5	57.9	-154.7	0	0	112.7	R75 S76 L77 R82 S83	R75-E79 PolarHBondContact O-N 3.34Å; S76-E79 PolarHBondContact O-N 3.07Å; L77-E79 VanDerWaalsContact C-N 3.3Å; L77-E79 PolarHBondContact O-N 3Å; E79-R82 PolarHBondContact O-N 3.22Å; E79-S83 VanDerWaalsContact O-CB 3.29Å; E79-S83 WeakPolarHBondContact O-CB 3.38Å; E79-S83 PolarHBondContact O-N 2.84Å; E79-S83 PolarHBondContact O-OG 3.07Å; E79-S83 VanDerWaalsContact O-OG 3.12Å; E79-S83 PolarHBondContact OE1-OG 3.01Å
80	F	96.5	Very high	92.2	Very high	40 Å²	40	37.4 Å²	37.4	18%	0.175	20%	0.198	C	C	.	.	H	α-helix	trans	-60	-51.3	174.9	-71.6	-51.7	0	0	0	111.4	L51 K54 V55 S76 L77 I78 R82 S83 H84 F86	L51-F80 HydrophobicContact CD2-CD1 4.36Å; L51-F80 HydrophobicContact CD2-CE1 3.91Å; K54-F80 HydrophobicContact CB-CE2 4.22Å; K54-F80 HydrophobicContact CB-CZ 3.85Å; K54-F80 HydrophobicContact CD-CZ 4.42Å; V55-F80 HydrophobicContact CG2-CB 3.83Å; V55-F80 HydrophobicContact CG2-CD1 4.49Å; V55-F80 HydrophobicContact CG2-CD2 3.71Å; V55-F80 HydrophobicContact CG2-CE2 4.4Å; V55-F80 HydrophobicContact CG2-CG 3.79Å; S76-F80 WeakPolarHBondContact O-CD2 3.22Å; S76-F80 WeakPolarHBondContact O-CG 3.47Å; S76-F80 PolarHBondContact O-N 3.39Å; L77-F80 PolarHBondContact O-N 2.97Å; I78-F80 PolarHBondContact O-N 3.4Å; F80-R82 VanDerWaalsContact C-N 3.27Å; F80-R82 PolarHBondContact O-N 3.03Å; F80-S83 PolarHBondContact O-N 3.19Å; F80-H84 PolarHBondContact O-N 2.7Å; F80-F86 HydrophobicContact CB-CE2 4.14Å; F80-F86 HydrophobicContact CB-CZ 4.31Å
81	F	96.3	Very high	91.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-74.7	-13.1	-179	-62.2	-40.5	0	0	0	114.3	V55 L77 I78 F86 L88 L98 L120 V123 F124 Q127 H354	V55-F81 HydrophobicContact CG1-CE1 4.01Å; V55-F81 HydrophobicContact CG1-CZ 3.77Å; L77-F81 HydrophobicContact CB-CE2 4.36Å; L77-F81 HydrophobicContact CD2-CE2 4.34Å; L77-F81 WeakPolarHBondContact O-CD2 3.49Å; L77-F81 WeakPolarHBondContact O-CG 3.36Å; L77-F81 PolarHBondContact O-N 3.22Å; I78-F81 PolarHBondContact O-N 3.04Å; F81-F86 AromaticContact CD1-CD2 3.82Å; F81-F86 HydrophobicContact CD1-CD2 3.82Å; F81-F86 AromaticContact CD1-CE2 3.93Å; F81-F86 HydrophobicContact CD1-CE2 3.93Å; F81-F86 HydrophobicContact CE1-CD2 4Å; F81-F86 HydrophobicContact CE1-CE2 4.22Å; F81-L88 HydrophobicContact CE1-CD1 4.22Å; F81-L98 HydrophobicContact CE2-CD2 4.05Å; F81-L98 HydrophobicContact CZ-CD2 4.27Å; F81-L120 HydrophobicContact CD2-CD1 3.69Å; F81-L120 HydrophobicContact CE2-CD1 3.86Å; F81-V123 HydrophobicContact CB-CB 4.06Å; F81-V123 HydrophobicContact CB-CG2 3.76Å; F81-V123 HydrophobicContact CD2-CG2 4.3Å; F81-F124 HydrophobicContact CD2-CB 4.15Å; F81-F124 HydrophobicContact CD2-CD2 4.21Å; F81-F124 HydrophobicContact CE1-CD2 4.15Å; F81-F124 HydrophobicContact CE2-CB 4.2Å; F81-F124 AromaticContact CE2-CD2 3.67Å; F81-F124 HydrophobicContact CE2-CD2 3.67Å; F81-F124 HydrophobicContact CE2-CG 4.26Å; F81-F124 AromaticContact CZ-CD2 3.64Å; F81-F124 HydrophobicContact CZ-CD2 3.64Å; F81-F124 HydrophobicContact CZ-CE2 4.09Å; F81-Q127 HydrophobicContact CB-CG 3.96Å; F81-Q127 HydrophobicContact CD1-CG 3.62Å; F81-Q127 HydrophobicContact CE1-CG 4.32Å; F81-Q127 HydrophobicContact CG-CG 3.92Å; F81-Q127 PolarHBondContact O-NE2 3.36Å; F81-H354 PolarHBondContact O-NE2 2.82Å
82	R	96.5	Very high	91.2	Very high	69 Å²	69	42 Å²	42	26%	0.26	23%	0.23	S	C	.	.	H	α-helix	trans	-79.7	-44.4	167.4	-77.5	-178	167.8	159.2	0.3	111.4	I78 E79 F80 V123 V346 G350 H354	I78-R82 HydrophobicContact CG2-CG 4.21Å; I78-R82 WeakPolarHBondContact O-CB 3.23Å; I78-R82 WeakPolarHBondContact O-CG 3.46Å; I78-R82 PolarHBondContact O-N 2.96Å; E79-R82 PolarHBondContact O-N 3.22Å; F80-R82 VanDerWaalsContact C-N 3.27Å; F80-R82 PolarHBondContact O-N 3.03Å; R82-V123 HydrophobicContact CG-CG1 3.87Å; R82-V346 PolarHBondContact NE-O 3.5Å; R82-V346 PolarHBondContact NH2-O 3.04Å; R82-G350 CarbonylContact O-C 3.56Å; R82-G350 WeakPolarHBondContact O-CA 3.26Å; R82-H354 PolarHBondContact O-CD2 3.39Å; R82-H354 PolarHBondContact O-NE2 3.28Å
83	S	93.5	Very high	90.8	Very high	28 Å²	28	44.9 Å²	44.9	20%	0.196	25%	0.245	C	C	.	.	H	α-helix	trans	-80.5	-27.3	-170.2	-69.8	0	0	0	0	113.6	E79 F80 H353	E79-S83 VanDerWaalsContact O-CB 3.29Å; E79-S83 WeakPolarHBondContact O-CB 3.38Å; E79-S83 PolarHBondContact O-N 2.84Å; E79-S83 PolarHBondContact O-OG 3.07Å; E79-S83 VanDerWaalsContact O-OG 3.12Å; E79-S83 PolarHBondContact OE1-OG 3.01Å; F80-S83 PolarHBondContact O-N 3.19Å; S83-H353 WeakPolarHBondContact O-CB 3.26Å; S83-H353 PolarHBondContact O-CD2 2.79Å
84	H	91.6	Very high	90.6	Very high	46 Å²	46	47.2 Å²	47.2	21%	0.213	25%	0.253	C	S	.	.			trans	-135.9	146.9	-171.9	-57.6	-70.7	0	0	0	111.7	F80 F86 Q127 H353 H354	F80-H84 PolarHBondContact O-N 2.7Å; H84-F86 HydrophobicContact CB-CD2 4.28Å; H84-F86 HydrophobicContact CB-CE1 4.4Å; H84-F86 HydrophobicContact CB-CE2 3.81Å; H84-F86 HydrophobicContact CB-CZ 3.89Å; H84-Q127 PolarHBondContact O-NE2 2.66Å; H84-Q127 PolarHBondContact O-OE1 3.11Å; H84-H353 AromaticContact ND1-CD2 3.75Å; H84-H353 AromaticContact ND1-NE2 3.4Å; H84-H353 PolarHBondContact ND1-NE2 2.92Å; H84-H354 PolarHBondContact O-NE2 2.91Å
85	H	89.7	Confident	90.4	Very high	12 Å²	12	47.7 Å²	47.7	6%	0.056	26%	0.256	C	S	.	.			trans	-103.1	110.7	166.8	178.1	-112.1	0	0	0	109.1	C87 E357 N358	H85-C87 VanDerWaalsContact C-N 3.31Å; H85-C87 VanDerWaalsContact CE1-SG 3.51Å; H85-C87 PolarHBondContact ND1-SG 3.18Å; H85-C87 VanDerWaalsContact ND1-SG 3.42Å; H85-C87 PolarHBondContact O-N 3.03Å; H85-E357 HydrophobicContact CB-CB 4.3Å; H85-N358 HydrophobicContact CB-CB 4.38Å; H85-N358 PolarHBondContact CD2-ND2 3.14Å; H85-N358 VanDerWaalsContact CD2-ND2 3.28Å
86	F	88.3	Confident	90.2	Very high	9 Å²	9	47.5 Å²	47.5	4%	0.039	26%	0.26	C	S	.	.			trans	-86.7	2.7	-171.9	-71.3	-80.1	0	0	0	114.3	L48 L51 L52 V55 F80 F81 H84 L88	L48-F86 HydrophobicContact CD1-CD1 3.52Å; L48-F86 HydrophobicContact CD1-CE1 3.57Å; L48-F86 HydrophobicContact CG-CD1 4.02Å; L48-F86 HydrophobicContact CG-CE1 4.32Å; L51-F86 HydrophobicContact CB-CE1 3.94Å; L51-F86 HydrophobicContact CB-CZ 4.27Å; L52-F86 HydrophobicContact CD1-CD1 4.31Å; L52-F86 HydrophobicContact CD2-CB 3.98Å; L52-F86 HydrophobicContact CD2-CD1 3.28Å; L52-F86 HydrophobicContact CD2-CE1 3.84Å; L52-F86 HydrophobicContact CD2-CG 3.73Å; L52-F86 HydrophobicContact CG-CD1 3.54Å; L52-F86 HydrophobicContact CG-CE1 3.91Å; L52-F86 HydrophobicContact CG-CG 4.44Å; V55-F86 HydrophobicContact CG2-CE1 4.49Å; V55-F86 HydrophobicContact CG2-CE2 4.15Å; V55-F86 HydrophobicContact CG2-CZ 3.87Å; F80-F86 HydrophobicContact CB-CE2 4.14Å; F80-F86 HydrophobicContact CB-CZ 4.31Å; F81-F86 AromaticContact CD1-CD2 3.82Å; F81-F86 HydrophobicContact CD1-CD2 3.82Å; F81-F86 AromaticContact CD1-CE2 3.93Å; F81-F86 HydrophobicContact CD1-CE2 3.93Å; F81-F86 HydrophobicContact CE1-CD2 4Å; F81-F86 HydrophobicContact CE1-CE2 4.22Å; H84-F86 HydrophobicContact CB-CD2 4.28Å; H84-F86 HydrophobicContact CB-CE1 4.4Å; H84-F86 HydrophobicContact CB-CE2 3.81Å; H84-F86 HydrophobicContact CB-CZ 3.89Å; F86-L88 HydrophobicContact CB-CD1 4.06Å; F86-L88 HydrophobicContact CB-CD2 3.95Å; F86-L88 HydrophobicContact CB-CG 3.66Å; F86-L88 PolarHBondContact O-N 2.99Å
87	C	80	Confident	90.1	Very high	91 Å²	91	47.7 Å²	47.7	62%	0.615	26%	0.259	S	S	*	.			trans	52	38.4	-177.9	-60.9	0	0	0	0	113	H85	H85-C87 VanDerWaalsContact C-N 3.31Å; H85-C87 VanDerWaalsContact CE1-SG 3.51Å; H85-C87 PolarHBondContact ND1-SG 3.18Å; H85-C87 VanDerWaalsContact ND1-SG 3.42Å; H85-C87 PolarHBondContact O-N 3.03Å
88	L	83.3	Confident	90	Very high	15 Å²	15	47.7 Å²	47.7	8%	0.079	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-73.5	146.3	-177.8	-58.2	174.1	0	0	0	110.3	L52 F81 F86 W92 F124	L52-L88 HydrophobicContact CD2-CD2 4.04Å; F81-L88 HydrophobicContact CE1-CD1 4.22Å; F86-L88 HydrophobicContact CB-CD1 4.06Å; F86-L88 HydrophobicContact CB-CD2 3.95Å; F86-L88 HydrophobicContact CB-CG 3.66Å; F86-L88 PolarHBondContact O-N 2.99Å; L88-W92 HydrophobicContact CD1-CD2 4.12Å; L88-W92 HydrophobicContact CD1-CE3 3.8Å; L88-W92 HydrophobicContact CD1-CH2 4.19Å; L88-W92 HydrophobicContact CD1-CZ3 3.84Å; L88-W92 HydrophobicContact CD2-CB 4.44Å; L88-W92 HydrophobicContact CD2-CD2 3.95Å; L88-W92 HydrophobicContact CD2-CE3 4.46Å; L88-W92 HydrophobicContact CD2-CG 3.94Å; L88-F124 HydrophobicContact CD1-CE2 4.06Å
89	D	77.3	Confident	89.9	Confident	80 Å²	80	47.4 Å²	47.4	43%	0.428	26%	0.257	S	S	.	.			trans	-121.8	175.6	170.7	67.8	27.3	0	0	0	111.2	S91 W92	D89-S91 PolarHBondContact O-N 3.3Å; D89-S91 WeakPolarHBondContact OD1-CA 3.38Å; D89-S91 VanDerWaalsContact OD1-CB 3.24Å; D89-S91 WeakPolarHBondContact OD1-CB 3.38Å; D89-S91 PolarHBondContact OD1-N 2.9Å; D89-S91 PolarHBondContact OD1-OG 2.68Å; D89-W92 WeakPolarHBondContact O-CB 3.45Å; D89-W92 PolarHBondContact O-N 2.95Å
90	G	71	Confident	89.8	Confident	32 Å²	32	44.7 Å²	44.7	33%	0.33	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-16.4	179.4	0	0	0	0	0	114.4	W92	G90-W92 VanDerWaalsContact C-N 3.35Å
91	S	80.9	Confident	89.8	Confident	98 Å²	98	43 Å²	43	69%	0.685	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-8.1	178.2	81.5	0	0	0	0	113.5	D89 N93	D89-S91 PolarHBondContact O-N 3.3Å; D89-S91 WeakPolarHBondContact OD1-CA 3.38Å; D89-S91 VanDerWaalsContact OD1-CB 3.24Å; D89-S91 WeakPolarHBondContact OD1-CB 3.38Å; D89-S91 PolarHBondContact OD1-N 2.9Å; D89-S91 PolarHBondContact OD1-OG 2.68Å; S91-N93 PolarHBondContact O-N 2.79Å; S91-N93 VanDerWaalsContact O-N 3.14Å
92	W	88.3	Confident	89.9	Confident	33 Å²	33	43 Å²	43	13%	0.125	24%	0.24	C	C	.	.			trans	-61.3	118.8	175.3	-175.9	54.9	0	0	0	110.6	V55 I59 L88 D89 G90 Y94 T95 L98 F124	V55-W92 HydrophobicContact CG1-CH2 3.76Å; V55-W92 HydrophobicContact CG1-CZ2 4.09Å; I59-W92 HydrophobicContact CD1-CH2 3.38Å; I59-W92 HydrophobicContact CD1-CZ2 4.21Å; I59-W92 HydrophobicContact CD1-CZ3 3.98Å; L88-W92 HydrophobicContact CD1-CD2 4.12Å; L88-W92 HydrophobicContact CD1-CE3 3.8Å; L88-W92 HydrophobicContact CD1-CH2 4.19Å; L88-W92 HydrophobicContact CD1-CZ3 3.84Å; L88-W92 HydrophobicContact CD2-CB 4.44Å; L88-W92 HydrophobicContact CD2-CD2 3.95Å; L88-W92 HydrophobicContact CD2-CE3 4.46Å; L88-W92 HydrophobicContact CD2-CG 3.94Å; D89-W92 WeakPolarHBondContact O-CB 3.45Å; D89-W92 PolarHBondContact O-N 2.95Å; G90-W92 VanDerWaalsContact C-N 3.35Å; W92-Y94 HydrophobicContact CZ2-CG 4.32Å; W92-Y94 PolarHBondContact O-N 3.39Å; W92-T95 VanDerWaalsContact O-CB 3.29Å; W92-T95 WeakPolarHBondContact O-CB 3.43Å; W92-T95 PolarHBondContact O-N 3.28Å; W92-T95 PolarHBondContact O-OG1 2.75Å; W92-L98 HydrophobicContact CZ3-CD2 4.5Å; W92-F124 HydrophobicContact CE3-CE2 4.32Å; W92-F124 HydrophobicContact CE3-CZ 4.34Å; W92-F124 AromaticContact CZ3-CE2 3.87Å; W92-F124 HydrophobicContact CZ3-CE2 3.87Å; W92-F124 HydrophobicContact CZ3-CZ 4.14Å
93	N	89.6	Confident	89.9	Confident	123 Å²	123	41.2 Å²	41.2	66%	0.658	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.4	-168.8	60.5	-33.9	0	0	0	115.1	S91	S91-N93 PolarHBondContact O-N 2.79Å; S91-N93 VanDerWaalsContact O-N 3.14Å
94	Y	93.2	Very high	90.1	Very high	54 Å²	54	42.4 Å²	42.4	21%	0.212	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-7.4	177	-80.8	-98.7	0	0	0	114.1	C56 I59 W92 E96 T97 L98	C56-Y94 HydrophobicContact CB-CD1 4.34Å; C56-Y94 HydrophobicContact CB-CD2 4.2Å; C56-Y94 HydrophobicContact CB-CE1 3.91Å; C56-Y94 HydrophobicContact CB-CE2 3.78Å; C56-Y94 HydrophobicContact CB-CG 4.48Å; C56-Y94 VanDerWaalsContact SG-CD2 3.58Å; C56-Y94 VanDerWaalsContact SG-CE2 3.57Å; I59-Y94 HydrophobicContact CB-CD1 4.03Å; I59-Y94 HydrophobicContact CD1-CD1 4.13Å; I59-Y94 HydrophobicContact CD1-CG 4.33Å; I59-Y94 HydrophobicContact CG2-CD1 3.92Å; W92-Y94 HydrophobicContact CZ2-CG 4.32Å; W92-Y94 PolarHBondContact O-N 3.39Å; Y94-E96 PolarHBondContact O-N 2.86Å; Y94-T97 PolarHBondContact O-N 3.08Å; Y94-L98 WeakPolarHBondContact O-CB 3.36Å; Y94-L98 PolarHBondContact O-N 3.37Å
95	T	93.3	Very high	90.3	Very high	10 Å²	10	40.5 Å²	40.5	6%	0.061	23%	0.231	C	C	.	.	H	α-helix	trans	-55.9	-54.3	-175.6	-63.2	0	0	0	0	112	W92 T97 L98 I99 F124 I128 W136	W92-T95 VanDerWaalsContact O-CB 3.29Å; W92-T95 WeakPolarHBondContact O-CB 3.43Å; W92-T95 PolarHBondContact O-N 3.28Å; W92-T95 PolarHBondContact O-OG1 2.75Å; T95-T97 VanDerWaalsContact C-N 3.34Å; T95-T97 PolarHBondContact O-N 2.91Å; T95-L98 PolarHBondContact O-N 3.2Å; T95-I99 VanDerWaalsContact O-CG1 3.27Å; T95-I99 WeakPolarHBondContact O-CG1 2.87Å; T95-I99 PolarHBondContact O-N 3.02Å; T95-F124 HydrophobicContact CG2-CE1 4.4Å; T95-F124 HydrophobicContact CG2-CZ 4.29Å; T95-I128 HydrophobicContact CG2-CD1 4.1Å; T95-W136 HydrophobicContact CG2-CH2 4.22Å; T95-W136 HydrophobicContact CG2-CZ2 3.5Å
96	E	93.3	Very high	90.7	Very high	102 Å²	102	40.3 Å²	40.3	48%	0.477	23%	0.23	S	C	.	.	H	α-helix	trans	-66.9	-35.9	-178.2	-177.2	53.9	-146.6	0	0	112.4	Y94 I99 T100 R139	Y94-E96 PolarHBondContact O-N 2.86Å; E96-I99 PolarHBondContact O-N 3.48Å; E96-T100 VanDerWaalsContact O-CB 3.22Å; E96-T100 WeakPolarHBondContact O-CB 3.49Å; E96-T100 PolarHBondContact O-N 2.92Å; E96-T100 PolarHBondContact O-OG1 3.34Å; E96-T100 VanDerWaalsContact O-OG1 3.08Å; E96-T100 PolarHBondContact OE1-OG1 2.92Å; E96-R139 IonicContact OE1-CZ 3.74Å; E96-R139 IonicContact OE1-NH1 2.79Å; E96-R139 PolarHBondContact OE1-NH1 3.33Å; E96-R139 IonicContact OE1-NH2 3.53Å; E96-R139 PolarHBondContact OE1-NH2 3.07Å; E96-R139 IonicContact OE2-NH1 2.68Å; E96-R139 PolarHBondContact OE2-NH1 2.86Å
97	T	95.5	Very high	90.9	Very high	57 Å²	57	45.8 Å²	45.8	35%	0.35	25%	0.253	S	S	.	.	H	α-helix	trans	-61.4	-46.1	175.1	-55	0	0	0	0	111.1	I59 Y94 T95 S101	I59-T97 HydrophobicContact CG2-CG2 3.94Å; Y94-T97 PolarHBondContact O-N 3.08Å; T95-T97 VanDerWaalsContact C-N 3.34Å; T95-T97 PolarHBondContact O-N 2.91Å; T97-S101 VanDerWaalsContact O-CB 3.27Å; T97-S101 WeakPolarHBondContact O-CB 3.45Å; T97-S101 PolarHBondContact O-N 3.46Å; T97-S101 PolarHBondContact O-OG 2.98Å
98	L	96.2	Very high	91.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.2	-49.6	177.2	173.8	55.3	0	0	0	111.3	I59 M62 L77 F81 W92 Y94 T95 T100 S101 I102 L120 F124	I59-L98 HydrophobicContact CD1-CB 4.13Å; I59-L98 HydrophobicContact CD1-CD2 4.19Å; I59-L98 HydrophobicContact CG1-CB 4.48Å; I59-L98 HydrophobicContact CG1-CD1 4.32Å; I59-L98 HydrophobicContact CG2-CB 4.28Å; M62-L98 HydrophobicContact CE-CD1 4.13Å; M62-L98 HydrophobicContact SD-CD1 3.57Å; M62-L98 VanDerWaalsContact SD-CD1 3.57Å; L77-L98 HydrophobicContact CD1-CD1 4.46Å; F81-L98 HydrophobicContact CE2-CD2 4.05Å; F81-L98 HydrophobicContact CZ-CD2 4.27Å; W92-L98 HydrophobicContact CZ3-CD2 4.5Å; Y94-L98 WeakPolarHBondContact O-CB 3.36Å; Y94-L98 PolarHBondContact O-N 3.37Å; T95-L98 PolarHBondContact O-N 3.2Å; L98-T100 PolarHBondContact O-N 3.41Å; L98-S101 WeakPolarHBondContact O-CB 3.4Å; L98-S101 PolarHBondContact O-N 2.86Å; L98-I102 HydrophobicContact CD1-CD1 3.86Å; L98-I102 HydrophobicContact CD1-CG1 4.14Å; L98-I102 HydrophobicContact CG-CD1 4.06Å; L98-I102 WeakPolarHBondContact O-CG1 3.4Å; L98-I102 PolarHBondContact O-N 3.3Å; L98-L120 HydrophobicContact CD1-CD2 3.91Å; L98-L120 HydrophobicContact CD1-CG 4.45Å; L98-F124 HydrophobicContact CD2-CB 4.46Å; L98-F124 HydrophobicContact CD2-CD1 3.71Å; L98-F124 HydrophobicContact CD2-CD2 3.64Å; L98-F124 HydrophobicContact CD2-CE1 3.75Å; L98-F124 HydrophobicContact CD2-CE2 3.7Å; L98-F124 HydrophobicContact CD2-CG 3.66Å; L98-F124 HydrophobicContact CD2-CZ 3.75Å; L98-F124 HydrophobicContact CG-CD1 4.39Å; L98-F124 HydrophobicContact CG-CE1 4.4Å
99	I	95.6	Very high	91.9	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-44.6	-179.7	-66.3	-62.9	0	0	0	111.1	T95 E96 S101 I102 E103 L121 F124 W136 F140	T95-I99 VanDerWaalsContact O-CG1 3.27Å; T95-I99 WeakPolarHBondContact O-CG1 2.87Å; T95-I99 PolarHBondContact O-N 3.02Å; E96-I99 PolarHBondContact O-N 3.48Å; I99-S101 PolarHBondContact O-N 3.47Å; I99-I102 PolarHBondContact O-N 2.9Å; I99-E103 PolarHBondContact O-N 3.04Å; I99-L121 HydrophobicContact CD1-CD1 4.18Å; I99-F124 HydrophobicContact CD1-CD1 4.01Å; I99-F124 HydrophobicContact CD1-CE1 3.91Å; I99-F124 HydrophobicContact CG1-CE1 4.27Å; I99-W136 HydrophobicContact CD1-CD2 3.78Å; I99-W136 HydrophobicContact CD1-CE3 4Å; I99-W136 HydrophobicContact CD1-CG 4.21Å; I99-W136 HydrophobicContact CD1-CH2 4.29Å; I99-W136 HydrophobicContact CD1-CZ2 4.15Å; I99-W136 HydrophobicContact CD1-CZ3 4.23Å; I99-W136 HydrophobicContact CG1-CD2 4.32Å; I99-W136 HydrophobicContact CG1-CZ2 4.15Å; I99-F140 HydrophobicContact CD1-CE2 4.2Å; I99-F140 HydrophobicContact CG2-CE2 3.82Å; I99-F140 HydrophobicContact CG2-CZ 3.81Å
100	T	96.2	Very high	92.6	Very high	40 Å²	40	52.7 Å²	52.7	25%	0.245	27%	0.273	C	S	.	.	H	α-helix	trans	-64.1	-38.8	175.6	-69.6	0	0	0	0	112.2	E96 L98 E103 N104 R139	E96-T100 VanDerWaalsContact O-CB 3.22Å; E96-T100 WeakPolarHBondContact O-CB 3.49Å; E96-T100 PolarHBondContact O-N 2.92Å; E96-T100 PolarHBondContact O-OG1 3.34Å; E96-T100 VanDerWaalsContact O-OG1 3.08Å; E96-T100 PolarHBondContact OE1-OG1 2.92Å; L98-T100 PolarHBondContact O-N 3.41Å; T100-E103 PolarHBondContact O-N 2.97Å; T100-N104 WeakPolarHBondContact O-CB 3.44Å; T100-N104 PolarHBondContact O-N 2.86Å; T100-N104 PolarHBondContact O-ND2 3.41Å; T100-R139 PolarHBondContact OG1-NH2 2.92Å
101	S	96.9	Very high	93.7	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-44.6	175.7	-65.6	0	0	0	0	111.8	T97 L98 I99 N104 I105	T97-S101 VanDerWaalsContact O-CB 3.27Å; T97-S101 WeakPolarHBondContact O-CB 3.45Å; T97-S101 PolarHBondContact O-N 3.46Å; T97-S101 PolarHBondContact O-OG 2.98Å; L98-S101 WeakPolarHBondContact O-CB 3.4Å; L98-S101 PolarHBondContact O-N 2.86Å; I99-S101 PolarHBondContact O-N 3.47Å; S101-N104 PolarHBondContact O-N 3.39Å; S101-I105 WeakPolarHBondContact O-CD1 3.4Å; S101-I105 VanDerWaalsContact O-CG1 3.3Å; S101-I105 WeakPolarHBondContact O-CG1 3.34Å; S101-I105 PolarHBondContact O-N 3.46Å
102	I	97.8	Very high	94.4	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58.6	-48.1	174.2	-70.2	168.9	0	0	0	110.4	M62 L98 I99 N104 I105 F106 A117 L120 L121 F140	M62-I102 HydrophobicContact CE-CG1 4Å; L98-I102 HydrophobicContact CD1-CD1 3.86Å; L98-I102 HydrophobicContact CD1-CG1 4.14Å; L98-I102 HydrophobicContact CG-CD1 4.06Å; L98-I102 WeakPolarHBondContact O-CG1 3.4Å; L98-I102 PolarHBondContact O-N 3.3Å; I99-I102 PolarHBondContact O-N 2.9Å; I102-N104 PolarHBondContact O-N 3.42Å; I102-I105 PolarHBondContact O-N 3.28Å; I102-F106 HydrophobicContact CG2-CD2 4.07Å; I102-F106 HydrophobicContact CG2-CE1 4.22Å; I102-F106 HydrophobicContact CG2-CE2 3.38Å; I102-F106 HydrophobicContact CG2-CZ 3.46Å; I102-F106 VanDerWaalsContact CG2-CZ 3.46Å; I102-F106 WeakPolarHBondContact O-CG 3.22Å; I102-F106 PolarHBondContact O-N 2.85Å; I102-A117 HydrophobicContact CG2-CB 4.41Å; I102-L120 HydrophobicContact CD1-CD2 4.34Å; I102-L120 HydrophobicContact CD1-CG 4.14Å; I102-L120 HydrophobicContact CG1-CD2 4.31Å; I102-L121 HydrophobicContact CD1-CB 4.28Å; I102-L121 HydrophobicContact CD1-CD1 4.4Å; I102-L121 HydrophobicContact CG2-CB 4.25Å; I102-L121 HydrophobicContact CG2-CD2 4.42Å; I102-F140 HydrophobicContact CB-CZ 4.29Å; I102-F140 HydrophobicContact CG2-CE1 3.89Å; I102-F140 HydrophobicContact CG2-CZ 3.85Å
103	E	97.3	Very high	94.7	Very high	32 Å²	32	52.6 Å²	52.6	15%	0.15	26%	0.259	C	S	.	.	H	α-helix	trans	-60.2	-43.6	178.7	-170.1	-175	175	0	0	112.5	I99 T100 I105 F106 K107 R139 F140 I143	I99-E103 PolarHBondContact O-N 3.04Å; T100-E103 PolarHBondContact O-N 2.97Å; E103-I105 VanDerWaalsContact C-N 3.32Å; E103-I105 PolarHBondContact O-N 3.15Å; E103-F106 PolarHBondContact O-N 3.39Å; E103-K107 HydrophobicContact CG-CD 4.45Å; E103-K107 WeakPolarHBondContact O-CG 3.19Å; E103-K107 PolarHBondContact O-N 3.25Å; E103-K107 VanDerWaalsContact O-N 3.16Å; E103-K107 VanDerWaalsContact OE1-CE 3.27Å; E103-K107 WeakPolarHBondContact OE1-CE 3.21Å; E103-K107 IonicContact OE1-NZ 3.32Å; E103-K107 PolarHBondContact OE1-NZ 2.67Å; E103-R139 IonicContact OE2-CZ 2.84Å; E103-R139 IonicContact OE2-NE 3.14Å; E103-R139 PolarHBondContact OE2-NE 2.85Å; E103-R139 IonicContact OE2-NH2 3.73Å; E103-R139 PolarHBondContact OE2-NH2 3.17Å; E103-F140 HydrophobicContact CB-CE1 3.88Å; E103-F140 HydrophobicContact CB-CZ 4.38Å; E103-F140 HydrophobicContact CG-CE1 4.35Å; E103-I143 HydrophobicContact CG-CD1 3.72Å
104	N	96.4	Very high	95.1	Very high	54 Å²	54	48.1 Å²	48.1	29%	0.289	23%	0.234	S	C	.	.	H	α-helix	trans	-61.1	-40.8	176	-84.3	-42.8	0	0	0	112	T100 S101 I102 K107 K108	T100-N104 WeakPolarHBondContact O-CB 3.44Å; T100-N104 PolarHBondContact O-N 2.86Å; T100-N104 PolarHBondContact O-ND2 3.41Å; S101-N104 PolarHBondContact O-N 3.39Å; I102-N104 PolarHBondContact O-N 3.42Å; N104-K107 PolarHBondContact O-N 3.31Å; N104-K108 WeakPolarHBondContact O-CB 3.33Å; N104-K108 PolarHBondContact O-N 2.96Å; N104-K108 PolarHBondContact OD1-NZ 3.01Å
105	I	96.7	Very high	95.3	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.026	22%	0.224	C	C	.	.	H	α-helix	trans	-63.4	-44.2	176.9	-69.6	161.4	0	0	0	110.7	M62 I74 S101 I102 E103 K107 K108 S109 D113 Q114 A117	M62-I105 HydrophobicContact CE-CD1 3.55Å; I74-I105 HydrophobicContact CD1-CD1 3.74Å; I74-I105 HydrophobicContact CG1-CD1 4.37Å; S101-I105 WeakPolarHBondContact O-CD1 3.4Å; S101-I105 VanDerWaalsContact O-CG1 3.3Å; S101-I105 WeakPolarHBondContact O-CG1 3.34Å; S101-I105 PolarHBondContact O-N 3.46Å; I102-I105 PolarHBondContact O-N 3.28Å; E103-I105 VanDerWaalsContact C-N 3.32Å; E103-I105 PolarHBondContact O-N 3.15Å; I105-K107 VanDerWaalsContact C-N 3.26Å; I105-K107 PolarHBondContact O-N 3.46Å; I105-K108 PolarHBondContact O-N 3.37Å; I105-S109 VanDerWaalsContact O-CB 3.26Å; I105-S109 WeakPolarHBondContact O-CB 3.39Å; I105-S109 PolarHBondContact O-N 3.3Å; I105-D113 HydrophobicContact CG2-CB 3.9Å; I105-Q114 WeakPolarHBondContact O-CG 3.32Å; I105-A117 HydrophobicContact CB-CB 4.08Å; I105-A117 HydrophobicContact CD1-CB 4.31Å; I105-A117 HydrophobicContact CG2-CB 3.6Å
106	F	97	Very high	95.5	Very high	8 Å²	8	45.9 Å²	45.9	4%	0.035	23%	0.225	C	C	.	.	H	α-helix	trans	-57.7	-39.6	176.2	-65.8	-27.6	0	0	0	112.6	I102 E103 Q114 A117 A118 L121 F140 I143 L144 F157	I102-F106 HydrophobicContact CG2-CD2 4.07Å; I102-F106 HydrophobicContact CG2-CE1 4.22Å; I102-F106 HydrophobicContact CG2-CE2 3.38Å; I102-F106 HydrophobicContact CG2-CZ 3.46Å; I102-F106 VanDerWaalsContact CG2-CZ 3.46Å; I102-F106 WeakPolarHBondContact O-CG 3.22Å; I102-F106 PolarHBondContact O-N 2.85Å; E103-F106 PolarHBondContact O-N 3.39Å; F106-Q114 WeakPolarHBondContact CE1-O 3.25Å; F106-Q114 PolarHBondContact O-NE2 3.28Å; F106-A117 HydrophobicContact CD1-CB 4.16Å; F106-A117 HydrophobicContact CE1-CB 3.64Å; F106-A117 HydrophobicContact CZ-CB 4.32Å; F106-A118 HydrophobicContact CE1-CB 3.92Å; F106-A118 HydrophobicContact CZ-CB 4.06Å; F106-L121 HydrophobicContact CE2-CD2 3.99Å; F106-L121 HydrophobicContact CZ-CD2 4.12Å; F106-F140 AromaticContact CD2-CD1 3.78Å; F106-F140 HydrophobicContact CD2-CD1 3.78Å; F106-F140 AromaticContact CD2-CE1 3.77Å; F106-F140 HydrophobicContact CD2-CE1 3.77Å; F106-F140 AromaticContact CE2-CD1 3.58Å; F106-F140 HydrophobicContact CE2-CD1 3.58Å; F106-F140 AromaticContact CE2-CE1 3.6Å; F106-F140 HydrophobicContact CE2-CE1 3.6Å; F106-F140 HydrophobicContact CE2-CG 4.49Å; F106-I143 HydrophobicContact CB-CG2 3.86Å; F106-I143 HydrophobicContact CD2-CG2 4.21Å; F106-I143 HydrophobicContact CG-CG2 4.39Å; F106-L144 HydrophobicContact CD1-CD2 4.46Å; F106-L144 HydrophobicContact CD2-CD2 4.02Å; F106-L144 HydrophobicContact CE1-CD2 4.3Å; F106-L144 HydrophobicContact CE2-CD1 4.34Å; F106-L144 HydrophobicContact CE2-CD2 3.84Å; F106-L144 HydrophobicContact CE2-CG 4.38Å; F106-L144 HydrophobicContact CG-CD2 4.33Å; F106-L144 HydrophobicContact CZ-CD2 4.01Å; F106-F157 AromaticContact CD1-CE2 3.88Å; F106-F157 HydrophobicContact CD1-CE2 3.88Å; F106-F157 AromaticContact CD1-CZ 3.92Å; F106-F157 HydrophobicContact CD1-CZ 3.92Å; F106-F157 AromaticContact CE1-CE2 3.99Å; F106-F157 HydrophobicContact CE1-CE2 3.99Å; F106-F157 HydrophobicContact CE1-CZ 4.47Å
107	K	94	Very high	95.8	Very high	124 Å²	124	41 Å²	41	54%	0.539	20%	0.203	S	C	.	.	H	α-helix	trans	-79.6	-34.3	-176.8	-67.7	177.4	-175.2	175.4	0	114.1	E103 N104 I105	E103-K107 HydrophobicContact CG-CD 4.45Å; E103-K107 WeakPolarHBondContact O-CG 3.19Å; E103-K107 PolarHBondContact O-N 3.25Å; E103-K107 VanDerWaalsContact O-N 3.16Å; E103-K107 VanDerWaalsContact OE1-CE 3.27Å; E103-K107 WeakPolarHBondContact OE1-CE 3.21Å; E103-K107 IonicContact OE1-NZ 3.32Å; E103-K107 PolarHBondContact OE1-NZ 2.67Å; N104-K107 PolarHBondContact O-N 3.31Å; I105-K107 VanDerWaalsContact C-N 3.26Å; I105-K107 PolarHBondContact O-N 3.46Å
108	K	90.9	Very high	95.9	Very high	162 Å²	162	38.3 Å²	38.3	70%	0.704	19%	0.186	S	C	*	.	H	α-helix	trans	-124.1	-12.8	-161.6	-60.2	172.2	-174.6	160.2	0	115.4	N104 I105	N104-K108 WeakPolarHBondContact O-CB 3.33Å; N104-K108 PolarHBondContact O-N 2.96Å; N104-K108 PolarHBondContact OD1-NZ 3.01Å; I105-K108 PolarHBondContact O-N 3.37Å
109	S	91.9	Very high	96	Very high	30 Å²	30	40.1 Å²	40.1	21%	0.21	20%	0.195	C	C	.	.	S	Bend	trans	-99.9	174.8	-171.4	-61.9	0	0	0	0	113.6	I105 Q114	I105-S109 VanDerWaalsContact O-CB 3.26Å; I105-S109 WeakPolarHBondContact O-CB 3.39Å; I105-S109 PolarHBondContact O-N 3.3Å; S109-Q114 PolarHBondContact O-NE2 3.44Å
110	K	93.5	Very high	96.2	Very high	140 Å²	140	40.1 Å²	40.1	61%	0.609	20%	0.195	S	C	*	.			trans	-74.8	159.8	178.4	-66.2	-179	-178.6	178.1	0	111.4	Q112 D113 Q114	K110-Q112 PolarHBondContact O-N 2.86Å; K110-Q112 VanDerWaalsContact O-N 3.08Å; K110-D113 PolarHBondContact O-N 3.22Å; K110-D113 VanDerWaalsContact O-N 3.08Å; K110-Q114 WeakPolarHBondContact O-CG 3.29Å; K110-Q114 PolarHBondContact O-N 3.48Å
111	P	93.6	Very high	96.2	Very high	55 Å²	55	38.2 Å²	38.2	36%	0.357	18%	0.184	S	C	.	.	H	α-helix	trans	-53.8	-32.7	-179	-30.7	36.8	0	0	0	116.2	Q114 A115 N154	P111-Q114 VanDerWaalsContact CA-OE1 3.3Å; P111-A115 WeakPolarHBondContact O-CB 3.46Å; P111-A115 PolarHBondContact O-N 3.46Å; P111-N154 HydrophobicContact CB-CB 3.57Å; P111-N154 HydrophobicContact CG-CB 4.13Å
112	Q	94.9	Very high	96.3	Very high	105 Å²	105	38.2 Å²	38.2	49%	0.491	18%	0.184	S	C	.	.	H	α-helix	trans	-66.2	-49	177.3	-178.3	176.6	11.8	0	0	111.9	I71 K110 Q114 A115 L116	I71-Q112 HydrophobicContact CD1-CG 4.41Å; K110-Q112 PolarHBondContact O-N 2.86Å; K110-Q112 VanDerWaalsContact O-N 3.08Å; Q112-Q114 VanDerWaalsContact C-N 3.31Å; Q112-A115 PolarHBondContact O-N 2.9Å; Q112-L116 HydrophobicContact CG-CD1 4.47Å; Q112-L116 WeakPolarHBondContact O-CG 3.33Å; Q112-L116 PolarHBondContact O-N 2.95Å; Q112-L116 VanDerWaalsContact O-N 3.14Å
113	D	95.1	Very high	96.3	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-61.7	-42.2	176.5	-55.5	39.1	0	0	0	110.3	R70 I105 K110 L116 A117	R70-D113 IonicContact CZ-OD2 3.35Å; R70-D113 VanDerWaalsContact CZ-OD2 3.32Å; R70-D113 IonicContact NE-OD2 3.44Å; R70-D113 PolarHBondContact NE-OD2 3Å; R70-D113 IonicContact NH2-OD2 2.75Å; R70-D113 PolarHBondContact NH2-OD2 3.17Å; I105-D113 HydrophobicContact CG2-CB 3.9Å; K110-D113 PolarHBondContact O-N 3.22Å; K110-D113 VanDerWaalsContact O-N 3.08Å; D113-L116 PolarHBondContact O-N 3.49Å; D113-A117 WeakPolarHBondContact O-CB 3.39Å; D113-A117 PolarHBondContact O-N 3.35Å
114	Q	97.4	Very high	96.2	Very high	29 Å²	29	36.7 Å²	36.7	14%	0.136	18%	0.177	C	C	.	.	H	α-helix	trans	-61.9	-46.1	178.6	-69.9	174.6	-44.1	0	0	112.2	I105 F106 S109 K110 P111 Q112 A117 A118 F157	I105-Q114 WeakPolarHBondContact O-CG 3.32Å; F106-Q114 WeakPolarHBondContact CE1-O 3.25Å; F106-Q114 PolarHBondContact O-NE2 3.28Å; S109-Q114 PolarHBondContact O-NE2 3.44Å; K110-Q114 WeakPolarHBondContact O-CG 3.29Å; K110-Q114 PolarHBondContact O-N 3.48Å; P111-Q114 VanDerWaalsContact CA-OE1 3.3Å; Q112-Q114 VanDerWaalsContact C-N 3.31Å; Q114-A117 PolarHBondContact O-N 3.39Å; Q114-A118 PolarHBondContact O-N 2.79Å; Q114-F157 VanDerWaalsContact C-CD2 3.49Å; Q114-F157 HydrophobicContact CB-CD1 3.8Å; Q114-F157 HydrophobicContact CB-CD2 3.66Å; Q114-F157 HydrophobicContact CB-CE1 3.79Å; Q114-F157 HydrophobicContact CB-CE2 3.67Å; Q114-F157 HydrophobicContact CB-CG 3.75Å; Q114-F157 HydrophobicContact CB-CZ 3.74Å; Q114-F157 HydrophobicContact CG-CD1 4.44Å; Q114-F157 HydrophobicContact CG-CE1 4.14Å; Q114-F157 HydrophobicContact CG-CZ 4.26Å; Q114-F157 WeakPolarHBondContact O-CE2 3.29Å
115	A	97.9	Very high	96.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61.2	-45.1	175.8	0	0	0	0	0	111.8	P111 Q112 A117 A118 D119 K156 F157 S160	P111-A115 WeakPolarHBondContact O-CB 3.46Å; P111-A115 PolarHBondContact O-N 3.46Å; Q112-A115 PolarHBondContact O-N 2.9Å; A115-A117 PolarHBondContact O-N 3.34Å; A115-A118 PolarHBondContact O-N 3.49Å; A115-D119 PolarHBondContact O-N 2.96Å; A115-K156 HydrophobicContact CB-CD 4.38Å; A115-K156 HydrophobicContact CB-CG 4.12Å; A115-F157 HydrophobicContact CB-CB 4.28Å; A115-S160 WeakPolarHBondContact O-CB 3.48Å; A115-S160 PolarHBondContact O-OG 3.32Å
116	L	98	Very high	96	Very high	17 Å²	17	34.2 Å²	34.2	9%	0.089	16%	0.163	C	C	.	.	H	α-helix	trans	-65.1	-37.8	177.2	-71.5	171.4	0	0	0	112.4	I71 I74 R75 I78 Q112 D113 A118 D119 L120	I71-L116 HydrophobicContact CG2-CD1 3.83Å; I74-L116 HydrophobicContact CG2-CB 3.66Å; R75-L116 HydrophobicContact CG-CD1 4.27Å; R75-L116 HydrophobicContact CG-CD2 4.31Å; I78-L116 HydrophobicContact CD1-CB 4.47Å; I78-L116 HydrophobicContact CD1-CD2 4.05Å; Q112-L116 HydrophobicContact CG-CD1 4.47Å; Q112-L116 WeakPolarHBondContact O-CG 3.33Å; Q112-L116 PolarHBondContact O-N 2.95Å; Q112-L116 VanDerWaalsContact O-N 3.14Å; D113-L116 PolarHBondContact O-N 3.49Å; L116-A118 VanDerWaalsContact C-N 3.29Å; L116-A118 PolarHBondContact O-N 3.06Å; L116-D119 PolarHBondContact O-N 2.96Å; L116-L120 WeakPolarHBondContact O-CB 3.19Å; L116-L120 PolarHBondContact O-N 2.86Å
117	A	98.2	Very high	95.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65.8	-32.1	175.5	0	0	0	0	0	112.3	I102 I105 F106 D113 Q114 A115 L120 L121	I102-A117 HydrophobicContact CG2-CB 4.41Å; I105-A117 HydrophobicContact CB-CB 4.08Å; I105-A117 HydrophobicContact CD1-CB 4.31Å; I105-A117 HydrophobicContact CG2-CB 3.6Å; F106-A117 HydrophobicContact CD1-CB 4.16Å; F106-A117 HydrophobicContact CE1-CB 3.64Å; F106-A117 HydrophobicContact CZ-CB 4.32Å; D113-A117 WeakPolarHBondContact O-CB 3.39Å; D113-A117 PolarHBondContact O-N 3.35Å; Q114-A117 PolarHBondContact O-N 3.39Å; A115-A117 PolarHBondContact O-N 3.34Å; A117-L120 PolarHBondContact O-N 2.88Å; A117-L121 WeakPolarHBondContact O-CB 3.43Å; A117-L121 PolarHBondContact O-N 2.95Å
118	A	98.6	Very high	95.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-71.5	-39.5	173.4	0	0	0	0	0	111.8	F106 Q114 A115 L116 L120 L121 T122 F157 A164	F106-A118 HydrophobicContact CE1-CB 3.92Å; F106-A118 HydrophobicContact CZ-CB 4.06Å; Q114-A118 PolarHBondContact O-N 2.79Å; A115-A118 PolarHBondContact O-N 3.49Å; L116-A118 VanDerWaalsContact C-N 3.29Å; L116-A118 PolarHBondContact O-N 3.06Å; A118-L120 VanDerWaalsContact C-N 3.32Å; A118-L120 PolarHBondContact O-N 2.88Å; A118-L121 PolarHBondContact O-N 3.06Å; A118-T122 PolarHBondContact O-N 3.39Å; A118-T122 PolarHBondContact O-OG1 3.29Å; A118-F157 HydrophobicContact CB-CE2 4.39Å; A118-A164 HydrophobicContact CB-CB 4.38Å
119	D	98.5	Very high	94.8	Very high	37 Å²	37	24.1 Å²	24.1	20%	0.198	12%	0.123	C	C	.	.	H	α-helix	trans	-61.8	-41.4	171.4	-65.1	-17	0	0	0	111	I78 A115 L116 T122 V123 S160	I78-D119 HydrophobicContact CD1-CB 3.92Å; A115-D119 PolarHBondContact O-N 2.96Å; L116-D119 PolarHBondContact O-N 2.96Å; D119-T122 WeakPolarHBondContact O-CB 3.43Å; D119-T122 PolarHBondContact O-N 3.06Å; D119-V123 PolarHBondContact O-N 3.12Å; D119-V123 VanDerWaalsContact O-N 3.1Å; D119-S160 WeakPolarHBondContact OD1-CB 3.36Å; D119-S160 PolarHBondContact OD1-OG 3.1Å
120	L	98.5	Very high	94.4	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.4	-47.1	175.5	177.3	55.3	0	0	0	112.1	M62 I74 L77 I78 F81 L98 I102 L116 A117 A118 T122 V123 F124	M62-L120 HydrophobicContact CE-CD2 3.77Å; M62-L120 HydrophobicContact SD-CD2 3.9Å; I74-L120 HydrophobicContact CG2-CB 4.18Å; I74-L120 HydrophobicContact CG2-CD2 4.02Å; L77-L120 HydrophobicContact CB-CD1 3.58Å; L77-L120 HydrophobicContact CB-CD2 4.15Å; L77-L120 HydrophobicContact CD1-CD2 3.93Å; I78-L120 HydrophobicContact CD1-CB 4.38Å; I78-L120 HydrophobicContact CG1-CB 3.85Å; I78-L120 HydrophobicContact CG1-CD1 4.23Å; F81-L120 HydrophobicContact CD2-CD1 3.69Å; F81-L120 HydrophobicContact CE2-CD1 3.86Å; L98-L120 HydrophobicContact CD1-CD2 3.91Å; L98-L120 HydrophobicContact CD1-CG 4.45Å; I102-L120 HydrophobicContact CD1-CD2 4.34Å; I102-L120 HydrophobicContact CD1-CG 4.14Å; I102-L120 HydrophobicContact CG1-CD2 4.31Å; L116-L120 WeakPolarHBondContact O-CB 3.19Å; L116-L120 PolarHBondContact O-N 2.86Å; A117-L120 PolarHBondContact O-N 2.88Å; A118-L120 VanDerWaalsContact C-N 3.32Å; A118-L120 PolarHBondContact O-N 2.88Å; L120-T122 PolarHBondContact O-N 2.93Å; L120-V123 HydrophobicContact CD1-CG2 4.31Å; L120-V123 WeakPolarHBondContact O-CG2 3.41Å; L120-V123 PolarHBondContact O-N 3.19Å; L120-F124 VanDerWaalsContact O-CB 3.25Å; L120-F124 WeakPolarHBondContact O-CB 3.42Å; L120-F124 PolarHBondContact O-N 2.98Å
121	L	98.2	Very high	93.9	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-56.6	-41.6	175	-178.9	58.1	0	0	0	111.2	I99 I102 F106 A117 A118 S125 F140 L144 A164 L168	I99-L121 HydrophobicContact CD1-CD1 4.18Å; I102-L121 HydrophobicContact CD1-CB 4.28Å; I102-L121 HydrophobicContact CD1-CD1 4.4Å; I102-L121 HydrophobicContact CG2-CB 4.25Å; I102-L121 HydrophobicContact CG2-CD2 4.42Å; F106-L121 HydrophobicContact CE2-CD2 3.99Å; F106-L121 HydrophobicContact CZ-CD2 4.12Å; A117-L121 WeakPolarHBondContact O-CB 3.43Å; A117-L121 PolarHBondContact O-N 2.95Å; A118-L121 PolarHBondContact O-N 3.06Å; L121-S125 WeakPolarHBondContact O-CB 3.43Å; L121-S125 PolarHBondContact O-N 2.88Å; L121-S125 PolarHBondContact O-OG 2.81Å; L121-F140 HydrophobicContact CD1-CD2 3.98Å; L121-F140 HydrophobicContact CD1-CE2 3.64Å; L121-F140 HydrophobicContact CD1-CZ 4.29Å; L121-F140 HydrophobicContact CD2-CB 4.34Å; L121-F140 HydrophobicContact CD2-CD1 4.2Å; L121-F140 HydrophobicContact CD2-CD2 3.69Å; L121-F140 HydrophobicContact CD2-CE1 4.42Å; L121-F140 HydrophobicContact CD2-CE2 3.95Å; L121-F140 HydrophobicContact CD2-CG 3.83Å; L121-F140 HydrophobicContact CD2-CZ 4.31Å; L121-F140 HydrophobicContact CG-CD2 4.49Å; L121-F140 HydrophobicContact CG-CE2 4.47Å; L121-L144 HydrophobicContact CD2-CD1 4.18Å; L121-A164 HydrophobicContact CD2-CB 4.43Å; L121-L168 HydrophobicContact CD2-CD1 4.03Å; L121-L168 HydrophobicContact CG-CD1 4.38Å
122	T	98.1	Very high	93.5	Very high	3 Å²	3	26 Å²	26	2%	0.018	13%	0.13	C	C	.	.	H	α-helix	trans	-59.7	-54.1	178.2	-54	0	0	0	0	111.5	A118 D119 L120 S125 I163 A164 V167 V346	A118-T122 PolarHBondContact O-N 3.39Å; A118-T122 PolarHBondContact O-OG1 3.29Å; D119-T122 WeakPolarHBondContact O-CB 3.43Å; D119-T122 PolarHBondContact O-N 3.06Å; L120-T122 PolarHBondContact O-N 2.93Å; T122-S125 PolarHBondContact O-N 3.31Å; T122-I163 HydrophobicContact CG2-CG2 3.75Å; T122-A164 VanDerWaalsContact OG1-CA 3.26Å; T122-A164 WeakPolarHBondContact OG1-CA 3.33Å; T122-A164 WeakPolarHBondContact OG1-CB 3.33Å; T122-A164 PolarHBondContact OG1-N 2.94Å; T122-V167 HydrophobicContact CG2-CB 4.17Å; T122-V167 HydrophobicContact CG2-CG1 4.42Å; T122-V167 HydrophobicContact CG2-CG2 3.73Å; T122-V346 HydrophobicContact CG2-CG1 3.64Å; T122-V346 HydrophobicContact CG2-CG2 4.13Å
123	V	97.1	Very high	93.4	Very high	1 Å²	1	21 Å²	21	1%	0.006	11%	0.106	C	C	.	.	H	α-helix	trans	-71.6	-33.4	-176.6	-62.5	0	0	0	0	112.2	I78 F81 R82 D119 L120 L126 V346 L347	I78-V123 HydrophobicContact CG1-CG2 4.48Å; F81-V123 HydrophobicContact CB-CB 4.06Å; F81-V123 HydrophobicContact CB-CG2 3.76Å; F81-V123 HydrophobicContact CD2-CG2 4.3Å; R82-V123 HydrophobicContact CG-CG1 3.87Å; D119-V123 PolarHBondContact O-N 3.12Å; D119-V123 VanDerWaalsContact O-N 3.1Å; L120-V123 HydrophobicContact CD1-CG2 4.31Å; L120-V123 WeakPolarHBondContact O-CG2 3.41Å; L120-V123 PolarHBondContact O-N 3.19Å; V123-L126 PolarHBondContact O-N 3.42Å; V123-V346 HydrophobicContact CG1-CG1 3.85Å; V123-L347 HydrophobicContact CG1-CD2 4.45Å
124	F	96.3	Very high	93.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-69.7	-35.4	176	-177.5	-117.8	0	0	0	112.2	F81 L88 W92 T95 L98 I99 L120 L126 Q127 W136	F81-F124 HydrophobicContact CD2-CB 4.15Å; F81-F124 HydrophobicContact CD2-CD2 4.21Å; F81-F124 HydrophobicContact CE1-CD2 4.15Å; F81-F124 HydrophobicContact CE2-CB 4.2Å; F81-F124 AromaticContact CE2-CD2 3.67Å; F81-F124 HydrophobicContact CE2-CD2 3.67Å; F81-F124 HydrophobicContact CE2-CG 4.26Å; F81-F124 AromaticContact CZ-CD2 3.64Å; F81-F124 HydrophobicContact CZ-CD2 3.64Å; F81-F124 HydrophobicContact CZ-CE2 4.09Å; L88-F124 HydrophobicContact CD1-CE2 4.06Å; W92-F124 HydrophobicContact CE3-CE2 4.32Å; W92-F124 HydrophobicContact CE3-CZ 4.34Å; W92-F124 AromaticContact CZ3-CE2 3.87Å; W92-F124 HydrophobicContact CZ3-CE2 3.87Å; W92-F124 HydrophobicContact CZ3-CZ 4.14Å; T95-F124 HydrophobicContact CG2-CE1 4.4Å; T95-F124 HydrophobicContact CG2-CZ 4.29Å; L98-F124 HydrophobicContact CD2-CB 4.46Å; L98-F124 HydrophobicContact CD2-CD1 3.71Å; L98-F124 HydrophobicContact CD2-CD2 3.64Å; L98-F124 HydrophobicContact CD2-CE1 3.75Å; L98-F124 HydrophobicContact CD2-CE2 3.7Å; L98-F124 HydrophobicContact CD2-CG 3.66Å; L98-F124 HydrophobicContact CD2-CZ 3.75Å; L98-F124 HydrophobicContact CG-CD1 4.39Å; L98-F124 HydrophobicContact CG-CE1 4.4Å; I99-F124 HydrophobicContact CD1-CD1 4.01Å; I99-F124 HydrophobicContact CD1-CE1 3.91Å; I99-F124 HydrophobicContact CG1-CE1 4.27Å; L120-F124 VanDerWaalsContact O-CB 3.25Å; L120-F124 WeakPolarHBondContact O-CB 3.42Å; L120-F124 PolarHBondContact O-N 2.98Å; F124-L126 PolarHBondContact O-N 3.06Å; F124-Q127 HydrophobicContact CD2-CB 4.23Å; F124-Q127 HydrophobicContact CD2-CG 4.48Å; F124-Q127 VanDerWaalsContact O-CB 3.3Å; F124-Q127 WeakPolarHBondContact O-CB 3.44Å; F124-Q127 PolarHBondContact O-N 3.21Å; F124-W136 AromaticContact CD1-CH2 3.9Å; F124-W136 HydrophobicContact CD1-CH2 3.9Å; F124-W136 AromaticContact CD1-CZ3 3.9Å; F124-W136 HydrophobicContact CD1-CZ3 3.9Å; F124-W136 AromaticContact CE1-CH2 3.3Å; F124-W136 HydrophobicContact CE1-CH2 3.3Å; F124-W136 HydrophobicContact CE1-CZ2 4.03Å; F124-W136 AromaticContact CE1-CZ3 3.8Å; F124-W136 HydrophobicContact CE1-CZ3 3.8Å; F124-W136 AromaticContact CZ-CH2 3.98Å; F124-W136 HydrophobicContact CZ-CH2 3.98Å
125	S	95.2	Very high	92.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.5	-26.8	174.6	-57.9	0	0	0	0	112.3	L121 T122 Q127 L168 L171	L121-S125 WeakPolarHBondContact O-CB 3.43Å; L121-S125 PolarHBondContact O-N 2.88Å; L121-S125 PolarHBondContact O-OG 2.81Å; T122-S125 PolarHBondContact O-N 3.31Å; S125-Q127 VanDerWaalsContact C-N 3.32Å; S125-L168 VanDerWaalsContact OG-CD2 3.23Å; S125-L168 WeakPolarHBondContact OG-CD2 3.36Å; S125-L171 VanDerWaalsContact O-CD1 3.3Å; S125-L171 WeakPolarHBondContact O-CD1 3.4Å
126	L	93.7	Very high	92.7	Very high	6 Å²	6	27.2 Å²	27.2	3%	0.031	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-6.5	174	-62.4	172	0	0	0	113.5	V123 F124 V167 L171 L343 V346 L347 N358 Y360	V123-L126 PolarHBondContact O-N 3.42Å; F124-L126 PolarHBondContact O-N 3.06Å; L126-V167 HydrophobicContact CD2-CG1 4.05Å; L126-V167 HydrophobicContact CG-CG1 4.18Å; L126-L171 HydrophobicContact CD2-CD1 4.33Å; L126-L343 HydrophobicContact CD1-CD2 4.27Å; L126-V346 HydrophobicContact CD1-CG1 3.82Å; L126-L347 HydrophobicContact CD1-CD1 4.25Å; L126-L347 HydrophobicContact CD1-CD2 4.09Å; L126-L347 HydrophobicContact CD1-CG 4.22Å; L126-N358 PolarHBondContact O-ND2 3.14Å; L126-Y360 HydrophobicContact CD2-CD1 3.93Å; L126-Y360 HydrophobicContact CD2-CE1 3.8Å
127	Q	89.7	Confident	92.6	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-26.2	-178.5	-67.2	-69.3	-31.6	0	0	113.8	F81 H84 F124 S125 H354	F81-Q127 HydrophobicContact CB-CG 3.96Å; F81-Q127 HydrophobicContact CD1-CG 3.62Å; F81-Q127 HydrophobicContact CE1-CG 4.32Å; F81-Q127 HydrophobicContact CG-CG 3.92Å; F81-Q127 PolarHBondContact O-NE2 3.36Å; H84-Q127 PolarHBondContact O-NE2 2.66Å; H84-Q127 PolarHBondContact O-OE1 3.11Å; F124-Q127 HydrophobicContact CD2-CB 4.23Å; F124-Q127 HydrophobicContact CD2-CG 4.48Å; F124-Q127 VanDerWaalsContact O-CB 3.3Å; F124-Q127 WeakPolarHBondContact O-CB 3.44Å; F124-Q127 PolarHBondContact O-N 3.21Å; S125-Q127 VanDerWaalsContact C-N 3.32Å; Q127-H354 PolarHBondContact NE2-CE1 3.18Å
128	I	84.9	Confident	92.4	Very high	9 Å²	9	30.2 Å²	30.2	5%	0.046	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-100.1	163.1	-171.7	-157.4	162.4	0	0	0	111.4	T95 P130 E132 V133 W136	T95-I128 HydrophobicContact CG2-CD1 4.1Å; I128-P130 WeakPolarHBondContact O-CD 3.36Å; I128-E132 HydrophobicContact CD1-CB 4Å; I128-E132 HydrophobicContact CD1-CG 3.94Å; I128-E132 HydrophobicContact CG1-CB 4.3Å; I128-E132 HydrophobicContact CG1-CG 4.13Å; I128-E132 HydrophobicContact CG2-CB 4.47Å; I128-V133 HydrophobicContact CG2-CG2 3.93Å; I128-W136 HydrophobicContact CB-CH2 3.94Å; I128-W136 HydrophobicContact CB-CZ3 4.43Å; I128-W136 HydrophobicContact CD1-CH2 3.41Å; I128-W136 VanDerWaalsContact CD1-CH2 3.41Å; I128-W136 HydrophobicContact CD1-CZ2 3.59Å; I128-W136 HydrophobicContact CG1-CH2 4.23Å; I128-W136 HydrophobicContact CG2-CH2 3.37Å; I128-W136 HydrophobicContact CG2-CZ2 4.34Å; I128-W136 HydrophobicContact CG2-CZ3 3.47Å; I128-W136 VanDerWaalsContact CG2-CZ3 3.47Å
129	N	81.5	Confident	92.3	Very high	73 Å²	73	33.2 Å²	33.2	39%	0.39	17%	0.165	S	C	.	.			trans	-54.4	125.9	167.4	-170	-33.7	0	0	0	111.1	H131 E132	N129-H131 PolarHBondContact O-N 3.06Å; N129-H131 WeakPolarHBondContact OD1-CB 3.49Å; N129-H131 PolarHBondContact OD1-CD2 3.37Å; N129-H131 PolarHBondContact OD1-N 3.26Å; N129-E132 PolarHBondContact O-N 3.24Å
130	P	83.6	Confident	92.2	Very high	41 Å²	41	31.5 Å²	31.5	27%	0.266	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-53	-23.4	178	-28.5	35.4	0	0	0	115	I128 E132 V133 P134 L171 Y360	I128-P130 WeakPolarHBondContact O-CD 3.36Å; P130-E132 PolarHBondContact O-N 3.07Å; P130-V133 WeakPolarHBondContact O-CB 3.39Å; P130-V133 PolarHBondContact O-N 3.33Å; P130-P134 VanDerWaalsContact O-CD 3.22Å; P130-P134 WeakPolarHBondContact O-CD 3.31Å; P130-L171 HydrophobicContact CB-CD2 4.2Å; P130-L171 HydrophobicContact CG-CD2 4.02Å; P130-Y360 HydrophobicContact CG-CD2 4.07Å; P130-Y360 HydrophobicContact CG-CG 4.46Å
131	H	83.7	Confident	92.1	Very high	154 Å²	154	33.2 Å²	33.2	71%	0.713	16%	0.163	S	C	*	.	G	3₁₀ helix	trans	-62.1	-23.6	176	-69.6	-60	0	0	0	114.5	N129	N129-H131 PolarHBondContact O-N 3.06Å; N129-H131 WeakPolarHBondContact OD1-CB 3.49Å; N129-H131 PolarHBondContact OD1-CD2 3.37Å; N129-H131 PolarHBondContact OD1-N 3.26Å
132	E	85.3	Confident	92	Very high	70 Å²	70	37.2 Å²	37.2	33%	0.327	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-83.8	-22.4	177.9	-59.3	-61.1	153.4	0	0	112.4	I128 N129 P130 W136	I128-E132 HydrophobicContact CD1-CB 4Å; I128-E132 HydrophobicContact CD1-CG 3.94Å; I128-E132 HydrophobicContact CG1-CB 4.3Å; I128-E132 HydrophobicContact CG1-CG 4.13Å; I128-E132 HydrophobicContact CG2-CB 4.47Å; N129-E132 PolarHBondContact O-N 3.24Å; P130-E132 PolarHBondContact O-N 3.07Å; E132-W136 HydrophobicContact CB-CZ2 4.37Å
133	V	91.1	Very high	92	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-68	-35.5	-170.5	-175.5	0	0	0	0	114.4	I128 P130 I135 W136 F137 L168 L171	I128-V133 HydrophobicContact CG2-CG2 3.93Å; P130-V133 WeakPolarHBondContact O-CB 3.39Å; P130-V133 PolarHBondContact O-N 3.33Å; V133-I135 VanDerWaalsContact C-N 3.27Å; V133-I135 PolarHBondContact O-N 2.91Å; V133-W136 HydrophobicContact CG2-CE3 4.4Å; V133-W136 WeakPolarHBondContact O-CB 3.32Å; V133-W136 PolarHBondContact O-N 3.33Å; V133-F137 PolarHBondContact O-N 2.96Å; V133-L168 HydrophobicContact CG1-CB 4.38Å; V133-L168 HydrophobicContact CG1-CD2 3.53Å; V133-L171 HydrophobicContact CB-CB 4.05Å; V133-L171 HydrophobicContact CG1-CB 3.73Å; V133-L171 HydrophobicContact CG1-CD1 4.28Å; V133-L171 HydrophobicContact CG2-CB 4.15Å; V133-L171 HydrophobicContact CG2-CD1 4.24Å
134	P	92	Very high	92	Very high	38 Å²	38	38.7 Å²	38.7	25%	0.247	20%	0.197	C	C	.	.	H	α-helix	trans	-49.9	-42.5	175.3	-29.9	34.9	0	0	0	114.6	P130 W136 F137 E138 S172	P130-P134 VanDerWaalsContact O-CD 3.22Å; P130-P134 WeakPolarHBondContact O-CD 3.31Å; P134-W136 VanDerWaalsContact C-N 3.3Å; P134-W136 PolarHBondContact O-N 2.78Å; P134-F137 WeakPolarHBondContact O-CB 3.47Å; P134-F137 PolarHBondContact O-N 3.36Å; P134-E138 PolarHBondContact O-N 3.03Å; P134-S172 WeakPolarHBondContact CA-OG 3.48Å
135	I	92	Very high	92.1	Very high	109 Å²	109	40.1 Å²	40.1	56%	0.559	20%	0.203	S	C	*	.	H	α-helix	trans	-64.8	-38.6	-180	-61.7	172.3	0	0	0	110.5	V133 R139	V133-I135 VanDerWaalsContact C-N 3.27Å; V133-I135 PolarHBondContact O-N 2.91Å; I135-R139 WeakPolarHBondContact O-CB 3.46Å; I135-R139 PolarHBondContact O-N 3.43Å; I135-R139 VanDerWaalsContact O-N 3.07Å
136	W	93.7	Very high	92.2	Very high	12 Å²	12	43.2 Å²	43.2	5%	0.045	22%	0.223	C	C	.	.	H	α-helix	trans	-72	-37.8	177.4	-55.5	-11.6	0	0	0	111.6	T95 I99 F124 I128 E132 V133 P134 R139 F140 L168	T95-W136 HydrophobicContact CG2-CH2 4.22Å; T95-W136 HydrophobicContact CG2-CZ2 3.5Å; I99-W136 HydrophobicContact CD1-CD2 3.78Å; I99-W136 HydrophobicContact CD1-CE3 4Å; I99-W136 HydrophobicContact CD1-CG 4.21Å; I99-W136 HydrophobicContact CD1-CH2 4.29Å; I99-W136 HydrophobicContact CD1-CZ2 4.15Å; I99-W136 HydrophobicContact CD1-CZ3 4.23Å; I99-W136 HydrophobicContact CG1-CD2 4.32Å; I99-W136 HydrophobicContact CG1-CZ2 4.15Å; F124-W136 AromaticContact CD1-CH2 3.9Å; F124-W136 HydrophobicContact CD1-CH2 3.9Å; F124-W136 AromaticContact CD1-CZ3 3.9Å; F124-W136 HydrophobicContact CD1-CZ3 3.9Å; F124-W136 AromaticContact CE1-CH2 3.3Å; F124-W136 HydrophobicContact CE1-CH2 3.3Å; F124-W136 HydrophobicContact CE1-CZ2 4.03Å; F124-W136 AromaticContact CE1-CZ3 3.8Å; F124-W136 HydrophobicContact CE1-CZ3 3.8Å; F124-W136 AromaticContact CZ-CH2 3.98Å; F124-W136 HydrophobicContact CZ-CH2 3.98Å; I128-W136 HydrophobicContact CB-CH2 3.94Å; I128-W136 HydrophobicContact CB-CZ3 4.43Å; I128-W136 HydrophobicContact CD1-CH2 3.41Å; I128-W136 VanDerWaalsContact CD1-CH2 3.41Å; I128-W136 HydrophobicContact CD1-CZ2 3.59Å; I128-W136 HydrophobicContact CG1-CH2 4.23Å; I128-W136 HydrophobicContact CG2-CH2 3.37Å; I128-W136 HydrophobicContact CG2-CZ2 4.34Å; I128-W136 HydrophobicContact CG2-CZ3 3.47Å; I128-W136 VanDerWaalsContact CG2-CZ3 3.47Å; E132-W136 HydrophobicContact CB-CZ2 4.37Å; V133-W136 HydrophobicContact CG2-CE3 4.4Å; V133-W136 WeakPolarHBondContact O-CB 3.32Å; V133-W136 PolarHBondContact O-N 3.33Å; P134-W136 VanDerWaalsContact C-N 3.3Å; P134-W136 PolarHBondContact O-N 2.78Å; W136-R139 PolarHBondContact O-N 3.2Å; W136-F140 HydrophobicContact CB-CD2 4.19Å; W136-F140 HydrophobicContact CB-CE2 4.36Å; W136-F140 WeakPolarHBondContact O-CB 3.37Å; W136-F140 WeakPolarHBondContact O-CD2 3.41Å; W136-F140 PolarHBondContact O-N 3.4Å; W136-L168 HydrophobicContact CB-CD2 4.26Å
137	F	95.4	Very high	92.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.4	-49.1	175.3	-179.5	-121.5	0	0	0	111	V133 P134 R139 F140 F141 L165 L168 Q169 S172 C175 I178 V183	V133-F137 PolarHBondContact O-N 2.96Å; P134-F137 WeakPolarHBondContact O-CB 3.47Å; P134-F137 PolarHBondContact O-N 3.36Å; F137-R139 VanDerWaalsContact C-N 3.3Å; F137-R139 PolarHBondContact O-N 3.05Å; F137-F140 PolarHBondContact O-N 2.86Å; F137-F141 HydrophobicContact CE2-CB 4.37Å; F137-F141 AromaticContact CE2-CD2 3.98Å; F137-F141 HydrophobicContact CE2-CD2 3.98Å; F137-F141 AromaticContact CZ-CD2 3.98Å; F137-F141 HydrophobicContact CZ-CD2 3.98Å; F137-F141 WeakPolarHBondContact O-CB 3.48Å; F137-F141 PolarHBondContact O-N 3.46Å; F137-L165 HydrophobicContact CD2-CD2 4.46Å; F137-L165 HydrophobicContact CE2-CD2 4.28Å; F137-L168 HydrophobicContact CB-CB 4.15Å; F137-L168 HydrophobicContact CD2-CB 3.68Å; F137-L168 HydrophobicContact CG-CB 4.3Å; F137-Q169 HydrophobicContact CE2-CB 3.93Å; F137-Q169 HydrophobicContact CZ-CB 4.03Å; F137-Q169 HydrophobicContact CZ-CG 4.4Å; F137-S172 WeakPolarHBondContact CB-OG 3.41Å; F137-C175 HydrophobicContact CD1-CB 4.25Å; F137-C175 HydrophobicContact CE1-CB 4.26Å; F137-I178 HydrophobicContact CD1-CD1 4.11Å; F137-I178 HydrophobicContact CE1-CB 3.7Å; F137-I178 HydrophobicContact CE1-CD1 3.8Å; F137-I178 HydrophobicContact CE1-CG1 4.38Å; F137-I178 HydrophobicContact CE1-CG2 3.61Å; F137-I178 HydrophobicContact CZ-CB 4.18Å; F137-I178 HydrophobicContact CZ-CD1 4.27Å; F137-I178 HydrophobicContact CZ-CG2 3.55Å; F137-V183 HydrophobicContact CE2-CG2 4.43Å; F137-V183 HydrophobicContact CZ-CG2 3.76Å
138	E	94.2	Very high	92.7	Very high	80 Å²	80	43.7 Å²	43.7	37%	0.374	23%	0.226	S	C	.	.	H	α-helix	trans	-60.9	-37.4	175	-70.8	-179.7	-172.7	0	0	112.8	P134 P142 C175 I178	P134-E138 PolarHBondContact O-N 3.03Å; E138-P142 WeakPolarHBondContact O-CD 3.26Å; E138-C175 PolarHBondContact OE1-SG 2.85Å; E138-I178 HydrophobicContact CG-CD1 4.33Å
139	R	95.1	Very high	93.1	Very high	64 Å²	64	48.5 Å²	48.5	24%	0.242	24%	0.244	C	C	.	.	H	α-helix	trans	-67.8	-42.7	177.4	-175.5	175.7	-176.8	166.9	-1.4	112.9	E96 T100 E103 I135 W136 F137	E96-R139 IonicContact OE1-CZ 3.74Å; E96-R139 IonicContact OE1-NH1 2.79Å; E96-R139 PolarHBondContact OE1-NH1 3.33Å; E96-R139 IonicContact OE1-NH2 3.53Å; E96-R139 PolarHBondContact OE1-NH2 3.07Å; E96-R139 IonicContact OE2-NH1 2.68Å; E96-R139 PolarHBondContact OE2-NH1 2.86Å; T100-R139 PolarHBondContact OG1-NH2 2.92Å; E103-R139 IonicContact OE2-CZ 2.84Å; E103-R139 IonicContact OE2-NE 3.14Å; E103-R139 PolarHBondContact OE2-NE 2.85Å; E103-R139 IonicContact OE2-NH2 3.73Å; E103-R139 PolarHBondContact OE2-NH2 3.17Å; I135-R139 WeakPolarHBondContact O-CB 3.46Å; I135-R139 PolarHBondContact O-N 3.43Å; I135-R139 VanDerWaalsContact O-N 3.07Å; W136-R139 PolarHBondContact O-N 3.2Å; F137-R139 VanDerWaalsContact C-N 3.3Å; F137-R139 PolarHBondContact O-N 3.05Å
140	F	97	Very high	93.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-94.9	-24.6	-172.1	-72.1	-63.8	0	0	0	114.5	I99 I102 E103 F106 L121 W136 F137 I143 L144 L168	I99-F140 HydrophobicContact CD1-CE2 4.2Å; I99-F140 HydrophobicContact CG2-CE2 3.82Å; I99-F140 HydrophobicContact CG2-CZ 3.81Å; I102-F140 HydrophobicContact CB-CZ 4.29Å; I102-F140 HydrophobicContact CG2-CE1 3.89Å; I102-F140 HydrophobicContact CG2-CZ 3.85Å; E103-F140 HydrophobicContact CB-CE1 3.88Å; E103-F140 HydrophobicContact CB-CZ 4.38Å; E103-F140 HydrophobicContact CG-CE1 4.35Å; F106-F140 AromaticContact CD2-CD1 3.78Å; F106-F140 HydrophobicContact CD2-CD1 3.78Å; F106-F140 AromaticContact CD2-CE1 3.77Å; F106-F140 HydrophobicContact CD2-CE1 3.77Å; F106-F140 AromaticContact CE2-CD1 3.58Å; F106-F140 HydrophobicContact CE2-CD1 3.58Å; F106-F140 AromaticContact CE2-CE1 3.6Å; F106-F140 HydrophobicContact CE2-CE1 3.6Å; F106-F140 HydrophobicContact CE2-CG 4.49Å; L121-F140 HydrophobicContact CD1-CD2 3.98Å; L121-F140 HydrophobicContact CD1-CE2 3.64Å; L121-F140 HydrophobicContact CD1-CZ 4.29Å; L121-F140 HydrophobicContact CD2-CB 4.34Å; L121-F140 HydrophobicContact CD2-CD1 4.2Å; L121-F140 HydrophobicContact CD2-CD2 3.69Å; L121-F140 HydrophobicContact CD2-CE1 4.42Å; L121-F140 HydrophobicContact CD2-CE2 3.95Å; L121-F140 HydrophobicContact CD2-CG 3.83Å; L121-F140 HydrophobicContact CD2-CZ 4.31Å; L121-F140 HydrophobicContact CG-CD2 4.49Å; L121-F140 HydrophobicContact CG-CE2 4.47Å; W136-F140 HydrophobicContact CB-CD2 4.19Å; W136-F140 HydrophobicContact CB-CE2 4.36Å; W136-F140 WeakPolarHBondContact O-CB 3.37Å; W136-F140 WeakPolarHBondContact O-CD2 3.41Å; W136-F140 PolarHBondContact O-N 3.4Å; F137-F140 PolarHBondContact O-N 2.86Å; F140-I143 HydrophobicContact CD1-CD1 4.3Å; F140-I143 WeakPolarHBondContact O-CB 3.03Å; F140-I143 PolarHBondContact O-N 3.07Å; F140-L144 HydrophobicContact CB-CD1 4.13Å; F140-L144 HydrophobicContact CB-CG 4.43Å; F140-L144 PolarHBondContact O-N 3.44Å; F140-L168 HydrophobicContact CB-CD1 4.28Å
141	F	96.8	Very high	94.1	Very high	37 Å²	37	50.3 Å²	50.3	16%	0.162	26%	0.255	C	S	.	.	H	α-helix	trans	-50.6	-52.4	176.4	-177.3	-98.3	0	0	0	113.9	F137 I143 L144 E145 L165 I178 V183	F137-F141 HydrophobicContact CE2-CB 4.37Å; F137-F141 AromaticContact CE2-CD2 3.98Å; F137-F141 HydrophobicContact CE2-CD2 3.98Å; F137-F141 AromaticContact CZ-CD2 3.98Å; F137-F141 HydrophobicContact CZ-CD2 3.98Å; F137-F141 WeakPolarHBondContact O-CB 3.48Å; F137-F141 PolarHBondContact O-N 3.46Å; F141-I143 PolarHBondContact O-N 3.22Å; F141-I143 VanDerWaalsContact O-N 3.07Å; F141-L144 PolarHBondContact O-N 2.97Å; F141-E145 HydrophobicContact CD2-CB 4.25Å; F141-E145 HydrophobicContact CE1-CB 4.4Å; F141-E145 HydrophobicContact CE2-CB 3.9Å; F141-E145 HydrophobicContact CE2-CG 4.04Å; F141-E145 HydrophobicContact CZ-CB 3.99Å; F141-E145 HydrophobicContact CZ-CG 3.89Å; F141-E145 WeakPolarHBondContact O-CB 3.43Å; F141-E145 PolarHBondContact O-N 3.46Å; F141-L165 HydrophobicContact CD2-CD1 4.24Å; F141-L165 HydrophobicContact CD2-CD2 4.41Å; F141-I178 HydrophobicContact CB-CD1 3.63Å; F141-I178 HydrophobicContact CD1-CD1 3.68Å; F141-I178 HydrophobicContact CD1-CG1 3.97Å; F141-I178 HydrophobicContact CD1-CG2 4.18Å; F141-I178 HydrophobicContact CD2-CD1 4.41Å; F141-I178 HydrophobicContact CD2-CG2 3.93Å; F141-I178 HydrophobicContact CE1-CD1 4.47Å; F141-I178 HydrophobicContact CE1-CG1 4.3Å; F141-I178 HydrophobicContact CE1-CG2 4.03Å; F141-I178 HydrophobicContact CE2-CG2 3.78Å; F141-I178 HydrophobicContact CG-CD1 3.64Å; F141-I178 HydrophobicContact CG-CG1 4.3Å; F141-I178 HydrophobicContact CG-CG2 4.13Å; F141-I178 HydrophobicContact CZ-CG2 3.83Å; F141-V183 HydrophobicContact CD2-CG2 4.43Å; F141-V183 HydrophobicContact CE2-CG2 3.88Å
142	P	96.4	Very high	94.6	Very high	84 Å²	84	48.6 Å²	48.6	55%	0.545	26%	0.256	S	S	.	.	H	α-helix	trans	-66.7	-11.7	179.5	27.7	-36.3	0	0	0	113.9	E138 P146	E138-P142 WeakPolarHBondContact O-CD 3.26Å; P142-P146 WeakPolarHBondContact O-CD 3.24Å; P142-P146 WeakPolarHBondContact O-CG 3.12Å
143	I	97.5	Very high	95	Very high	34 Å²	34	49.7 Å²	49.7	17%	0.174	26%	0.26	C	S	.	.	H	α-helix	trans	-92.8	-45.5	176.9	-58.1	175.4	0	0	0	110.4	E103 F106 F140 F141 V147	E103-I143 HydrophobicContact CG-CD1 3.72Å; F106-I143 HydrophobicContact CB-CG2 3.86Å; F106-I143 HydrophobicContact CD2-CG2 4.21Å; F106-I143 HydrophobicContact CG-CG2 4.39Å; F140-I143 HydrophobicContact CD1-CD1 4.3Å; F140-I143 WeakPolarHBondContact O-CB 3.03Å; F140-I143 PolarHBondContact O-N 3.07Å; F141-I143 PolarHBondContact O-N 3.22Å; F141-I143 VanDerWaalsContact O-N 3.07Å; I143-V147 WeakPolarHBondContact O-CG2 3.36Å
144	L	97.9	Very high	95.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-89.3	-35.8	-169.7	-62.8	-177.8	0	0	0	113.2	F106 L121 F140 F141 V147 I148 F157 A164 L165	F106-L144 HydrophobicContact CD1-CD2 4.46Å; F106-L144 HydrophobicContact CD2-CD2 4.02Å; F106-L144 HydrophobicContact CE1-CD2 4.3Å; F106-L144 HydrophobicContact CE2-CD1 4.34Å; F106-L144 HydrophobicContact CE2-CD2 3.84Å; F106-L144 HydrophobicContact CE2-CG 4.38Å; F106-L144 HydrophobicContact CG-CD2 4.33Å; F106-L144 HydrophobicContact CZ-CD2 4.01Å; L121-L144 HydrophobicContact CD2-CD1 4.18Å; F140-L144 HydrophobicContact CB-CD1 4.13Å; F140-L144 HydrophobicContact CB-CG 4.43Å; F140-L144 PolarHBondContact O-N 3.44Å; F141-L144 PolarHBondContact O-N 2.97Å; L144-V147 WeakPolarHBondContact O-CB 3.17Å; L144-V147 PolarHBondContact O-N 3.46Å; L144-I148 WeakPolarHBondContact O-CD1 3.16Å; L144-I148 WeakPolarHBondContact O-CG1 3.13Å; L144-I148 PolarHBondContact O-N 2.99Å; L144-F157 HydrophobicContact CD2-CE2 4.29Å; L144-F157 HydrophobicContact CD2-CZ 4.29Å; L144-A164 HydrophobicContact CD1-CB 4.25Å; L144-L165 HydrophobicContact CB-CD1 3.79Å; L144-L165 HydrophobicContact CB-CD2 3.87Å; L144-L165 HydrophobicContact CB-CG 3.7Å; L144-L165 HydrophobicContact CD1-CD2 3.84Å; L144-L165 HydrophobicContact CD1-CG 3.99Å; L144-L165 HydrophobicContact CG-CD2 4.39Å
145	E	97.5	Very high	95.3	Very high	31 Å²	31	52.6 Å²	52.6	15%	0.145	28%	0.275	C	S	.	.	H	α-helix	trans	-59.3	-46.2	179.7	-175.1	-83.6	176.7	0	0	112	F141 V147 I148 R149 L165 S186	F141-E145 HydrophobicContact CD2-CB 4.25Å; F141-E145 HydrophobicContact CE1-CB 4.4Å; F141-E145 HydrophobicContact CE2-CB 3.9Å; F141-E145 HydrophobicContact CE2-CG 4.04Å; F141-E145 HydrophobicContact CZ-CB 3.99Å; F141-E145 HydrophobicContact CZ-CG 3.89Å; F141-E145 WeakPolarHBondContact O-CB 3.43Å; F141-E145 PolarHBondContact O-N 3.46Å; E145-V147 VanDerWaalsContact C-N 3.27Å; E145-V147 PolarHBondContact O-N 3.42Å; E145-I148 PolarHBondContact O-N 3.04Å; E145-R149 PolarHBondContact O-N 3.49Å; E145-R149 WeakPolarHBondContact OE1-CD 3.33Å; E145-R149 IonicContact OE1-CZ 2.98Å; E145-R149 IonicContact OE1-NE 3.71Å; E145-R149 IonicContact OE1-NH1 2.59Å; E145-R149 PolarHBondContact OE1-NH1 3.1Å; E145-L165 HydrophobicContact CB-CD1 4.18Å; E145-S186 VanDerWaalsContact CG-OG 3.26Å; E145-S186 WeakPolarHBondContact CG-OG 3.19Å; E145-S186 PolarHBondContact OE1-OG 2.99Å
146	P	97.2	Very high	95.5	Very high	64 Å²	64	53.5 Å²	53.5	42%	0.416	28%	0.275	S	S	.	.	H	α-helix	trans	-64	-35.1	178.5	-25.7	36.5	0	0	0	112.3	P142 R149 D150	P142-P146 WeakPolarHBondContact O-CD 3.24Å; P142-P146 WeakPolarHBondContact O-CG 3.12Å; P146-R149 PolarHBondContact O-N 3.38Å; P146-D150 VanDerWaalsContact O-CB 3.29Å; P146-D150 WeakPolarHBondContact O-CB 3.05Å; P146-D150 PolarHBondContact O-N 3.48Å
147	V	96.8	Very high	95.7	Very high	17 Å²	17	53.1 Å²	53.1	10%	0.103	27%	0.273	C	S	.	.	H	α-helix	trans	-62.6	-46.2	176.4	168.9	0	0	0	0	110.6	I143 L144 E145 R149 D150 K153 F157 R158	I143-V147 WeakPolarHBondContact O-CG2 3.36Å; L144-V147 WeakPolarHBondContact O-CB 3.17Å; L144-V147 PolarHBondContact O-N 3.46Å; E145-V147 VanDerWaalsContact C-N 3.27Å; E145-V147 PolarHBondContact O-N 3.42Å; V147-R149 PolarHBondContact O-N 3.45Å; V147-D150 PolarHBondContact O-N 2.92Å; V147-K153 HydrophobicContact CG1-CB 4.35Å; V147-K153 HydrophobicContact CG1-CG 4.36Å; V147-F157 HydrophobicContact CB-CE1 4.3Å; V147-F157 HydrophobicContact CG1-CD1 3.59Å; V147-F157 HydrophobicContact CG1-CE1 3.52Å; V147-F157 HydrophobicContact CG1-CG 4.18Å; V147-F157 HydrophobicContact CG1-CZ 4.05Å; V147-F157 HydrophobicContact CG2-CE1 3.84Å; V147-F157 HydrophobicContact CG2-CZ 4.27Å; V147-R158 HydrophobicContact CG1-CG 4.21Å; V147-R158 WeakPolarHBondContact O-CG 3.44Å
148	I	96.7	Very high	95.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.4	-39.5	-178.6	-70	155.9	0	0	0	110.8	L144 E145 R158 A162 L165 F187 V190	L144-I148 WeakPolarHBondContact O-CD1 3.16Å; L144-I148 WeakPolarHBondContact O-CG1 3.13Å; L144-I148 PolarHBondContact O-N 2.99Å; E145-I148 PolarHBondContact O-N 3.04Å; I148-R158 VanDerWaalsContact O-CZ 3.28Å; I148-R158 PolarHBondContact O-NE 2.95Å; I148-R158 PolarHBondContact O-NH2 3.12Å; I148-A162 HydrophobicContact CD1-CB 4.34Å; I148-A162 HydrophobicContact CG1-CB 4.35Å; I148-L165 HydrophobicContact CD1-CD1 3.47Å; I148-L165 VanDerWaalsContact CD1-CD1 3.47Å; I148-L165 HydrophobicContact CD1-CG 4.2Å; I148-F187 HydrophobicContact CD1-CE1 4.02Å; I148-F187 HydrophobicContact CG2-CD1 4.33Å; I148-V190 HydrophobicContact CG2-CG2 3.59Å
149	R	94.8	Very high	96	Very high	110 Å²	110	50.6 Å²	50.6	42%	0.415	26%	0.263	S	S	.	.	H	α-helix	trans	-84.4	-24	-177.8	-65.2	176.5	68.5	178.2	0.2	114	E145 P146 V147 T151 F189	E145-R149 PolarHBondContact O-N 3.49Å; E145-R149 WeakPolarHBondContact OE1-CD 3.33Å; E145-R149 IonicContact OE1-CZ 2.98Å; E145-R149 IonicContact OE1-NE 3.71Å; E145-R149 IonicContact OE1-NH1 2.59Å; E145-R149 PolarHBondContact OE1-NH1 3.1Å; P146-R149 PolarHBondContact O-N 3.38Å; V147-R149 PolarHBondContact O-N 3.45Å; R149-T151 PolarHBondContact O-N 3.43Å; R149-T151 VanDerWaalsContact O-N 3.16Å; R149-F189 HydrophobicContact CB-CD1 3.96Å; R149-F189 HydrophobicContact CB-CE1 4.07Å; R149-F189 HydrophobicContact CG-CD1 3.89Å; R149-F189 HydrophobicContact CG-CE1 4.49Å; R149-F189 HydrophobicContact CG-CG 4.32Å; R149-F189 VanDerWaalsContact O-CE1 3.24Å; R149-F189 WeakPolarHBondContact O-CE1 3.49Å
150	D	93.9	Very high	96.1	Very high	52 Å²	52	48 Å²	48	28%	0.278	25%	0.254	S	S	.	.			trans	-74.3	106.6	180	-177.3	-7.7	0	0	0	111.4	P146 V147 T152 K153 R158	P146-D150 VanDerWaalsContact O-CB 3.29Å; P146-D150 WeakPolarHBondContact O-CB 3.05Å; P146-D150 PolarHBondContact O-N 3.48Å; V147-D150 PolarHBondContact O-N 2.92Å; D150-T152 VanDerWaalsContact CG-OG1 3.27Å; D150-T152 PolarHBondContact O-N 3.49Å; D150-T152 VanDerWaalsContact O-N 3.16Å; D150-T152 VanDerWaalsContact OD1-CB 3.3Å; D150-T152 WeakPolarHBondContact OD1-CB 3.3Å; D150-T152 WeakPolarHBondContact OD1-CG2 3.36Å; D150-T152 PolarHBondContact OD1-N 2.87Å; D150-T152 PolarHBondContact OD1-OG1 3.36Å; D150-T152 PolarHBondContact OD2-OG1 2.91Å; D150-K153 HydrophobicContact CB-CG 3.7Å; D150-K153 PolarHBondContact O-N 3.42Å; D150-K153 VanDerWaalsContact O-N 3.12Å; D150-K153 WeakPolarHBondContact OD2-CE 3.46Å; D150-R158 WeakPolarHBondContact O-CD 3.26Å; D150-R158 PolarHBondContact O-NE 2.9Å
151	T	92.1	Very high	96.2	Very high	100 Å²	100	48 Å²	48	61%	0.613	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.5	-179.6	57.4	0	0	0	0	114	R149	R149-T151 PolarHBondContact O-N 3.43Å; R149-T151 VanDerWaalsContact O-N 3.16Å
152	T	92.6	Very high	96.3	Very high	118 Å²	118	46.2 Å²	46.2	72%	0.724	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-14.4	176.5	75.2	0	0	0	0	112.7	D150	D150-T152 VanDerWaalsContact CG-OG1 3.27Å; D150-T152 PolarHBondContact O-N 3.49Å; D150-T152 VanDerWaalsContact O-N 3.16Å; D150-T152 VanDerWaalsContact OD1-CB 3.3Å; D150-T152 WeakPolarHBondContact OD1-CB 3.3Å; D150-T152 WeakPolarHBondContact OD1-CG2 3.36Å; D150-T152 PolarHBondContact OD1-N 2.87Å; D150-T152 PolarHBondContact OD1-OG1 3.36Å; D150-T152 PolarHBondContact OD2-OG1 2.91Å
153	K	94.5	Very high	96.4	Very high	94 Å²	94	43.2 Å²	43.2	41%	0.409	23%	0.226	S	C	.	.	S	Bend	trans	-77.1	155	177.6	-59.9	-66	178.3	179.4	0	111.2	V147 D150 R158	V147-K153 HydrophobicContact CG1-CB 4.35Å; V147-K153 HydrophobicContact CG1-CG 4.36Å; D150-K153 HydrophobicContact CB-CG 3.7Å; D150-K153 PolarHBondContact O-N 3.42Å; D150-K153 VanDerWaalsContact O-N 3.12Å; D150-K153 WeakPolarHBondContact OD2-CE 3.46Å; K153-R158 HydrophobicContact CB-CG 3.93Å; K153-R158 WeakPolarHBondContact O-CD 3.4Å
154	N	94.4	Very high	96.4	Very high	66 Å²	66	41.6 Å²	41.6	35%	0.353	22%	0.218	S	C	.	.			trans	-57.8	126.4	-179.9	-179.5	-87.9	0	0	0	111.4	P111 K156 F157 R158	P111-N154 HydrophobicContact CB-CB 3.57Å; P111-N154 HydrophobicContact CG-CB 4.13Å; N154-K156 PolarHBondContact O-N 3.28Å; N154-K156 VanDerWaalsContact O-N 3.17Å; N154-K156 WeakPolarHBondContact OD1-CA 3.29Å; N154-K156 VanDerWaalsContact OD1-CB 3.23Å; N154-K156 WeakPolarHBondContact OD1-CB 3.41Å; N154-K156 PolarHBondContact OD1-N 2.95Å; N154-F157 HydrophobicContact CB-CB 4.34Å; N154-F157 PolarHBondContact O-N 2.89Å; N154-F157 VanDerWaalsContact O-N 3.1Å; N154-F157 PolarHBondContact OD1-N 3.49Å; N154-R158 WeakPolarHBondContact O-CG 3.37Å; N154-R158 PolarHBondContact O-N 2.62Å
155	P	95.2	Very high	96.4	Very high	33 Å²	33	41.6 Å²	41.6	21%	0.214	22%	0.218	C	C	.	.	H	α-helix	trans	-56.5	-34.7	-176.5	-28.1	34.6	0	0	0	114.3	R158 A159 I202	P155-R158 PolarHBondContact O-N 3.04Å; P155-A159 WeakPolarHBondContact O-CB 3.44Å; P155-A159 PolarHBondContact O-N 3.33Å; P155-I202 HydrophobicContact CG-CG2 4.34Å
156	K	96.4	Very high	96.5	Very high	127 Å²	127	40.1 Å²	40.1	55%	0.552	21%	0.211	S	C	*	.	H	α-helix	trans	-69.2	-43	178.5	-169.3	-178.9	179	176.1	0	111.9	A115 N154 R158 A159 S160	A115-K156 HydrophobicContact CB-CD 4.38Å; A115-K156 HydrophobicContact CB-CG 4.12Å; N154-K156 PolarHBondContact O-N 3.28Å; N154-K156 VanDerWaalsContact O-N 3.17Å; N154-K156 WeakPolarHBondContact OD1-CA 3.29Å; N154-K156 VanDerWaalsContact OD1-CB 3.23Å; N154-K156 WeakPolarHBondContact OD1-CB 3.41Å; N154-K156 PolarHBondContact OD1-N 2.95Å; K156-R158 VanDerWaalsContact C-N 3.34Å; K156-A159 PolarHBondContact O-N 2.64Å; K156-S160 PolarHBondContact O-N 2.93Å; K156-S160 PolarHBondContact O-OG 3.33Å
157	F	97.6	Very high	96.5	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-62.4	-45.1	175.2	179.7	-148.9	0	0	0	110.5	F106 Q114 A115 A118 L144 V147 N154 A159 S160 S161	F106-F157 AromaticContact CD1-CE2 3.88Å; F106-F157 HydrophobicContact CD1-CE2 3.88Å; F106-F157 AromaticContact CD1-CZ 3.92Å; F106-F157 HydrophobicContact CD1-CZ 3.92Å; F106-F157 AromaticContact CE1-CE2 3.99Å; F106-F157 HydrophobicContact CE1-CE2 3.99Å; F106-F157 HydrophobicContact CE1-CZ 4.47Å; Q114-F157 VanDerWaalsContact C-CD2 3.49Å; Q114-F157 HydrophobicContact CB-CD1 3.8Å; Q114-F157 HydrophobicContact CB-CD2 3.66Å; Q114-F157 HydrophobicContact CB-CE1 3.79Å; Q114-F157 HydrophobicContact CB-CE2 3.67Å; Q114-F157 HydrophobicContact CB-CG 3.75Å; Q114-F157 HydrophobicContact CB-CZ 3.74Å; Q114-F157 HydrophobicContact CG-CD1 4.44Å; Q114-F157 HydrophobicContact CG-CE1 4.14Å; Q114-F157 HydrophobicContact CG-CZ 4.26Å; Q114-F157 WeakPolarHBondContact O-CE2 3.29Å; A115-F157 HydrophobicContact CB-CB 4.28Å; A118-F157 HydrophobicContact CB-CE2 4.39Å; L144-F157 HydrophobicContact CD2-CE2 4.29Å; L144-F157 HydrophobicContact CD2-CZ 4.29Å; V147-F157 HydrophobicContact CB-CE1 4.3Å; V147-F157 HydrophobicContact CG1-CD1 3.59Å; V147-F157 HydrophobicContact CG1-CE1 3.52Å; V147-F157 HydrophobicContact CG1-CG 4.18Å; V147-F157 HydrophobicContact CG1-CZ 4.05Å; V147-F157 HydrophobicContact CG2-CE1 3.84Å; V147-F157 HydrophobicContact CG2-CZ 4.27Å; N154-F157 HydrophobicContact CB-CB 4.34Å; N154-F157 PolarHBondContact O-N 2.89Å; N154-F157 VanDerWaalsContact O-N 3.1Å; N154-F157 PolarHBondContact OD1-N 3.49Å; F157-A159 VanDerWaalsContact C-N 3.28Å; F157-A159 PolarHBondContact O-N 3.23Å; F157-S160 PolarHBondContact O-N 3.04Å; F157-S161 WeakPolarHBondContact CD2-OG 3.27Å; F157-S161 WeakPolarHBondContact CE2-OG 3.36Å; F157-S161 WeakPolarHBondContact O-CB 3.43Å; F157-S161 PolarHBondContact O-N 3Å; F157-S161 PolarHBondContact O-OG 3.25Å
158	R	97.5	Very high	96.4	Very high	16 Å²	16	36.4 Å²	36.4	6%	0.06	19%	0.187	C	C	.	.	H	α-helix	trans	-55.6	-42.9	174.8	-63.6	175.3	66.1	-161.1	0.3	112.3	V147 I148 D150 K153 N154 P155 K156 S161 A162 L205	V147-R158 HydrophobicContact CG1-CG 4.21Å; V147-R158 WeakPolarHBondContact O-CG 3.44Å; I148-R158 VanDerWaalsContact O-CZ 3.28Å; I148-R158 PolarHBondContact O-NE 2.95Å; I148-R158 PolarHBondContact O-NH2 3.12Å; D150-R158 WeakPolarHBondContact O-CD 3.26Å; D150-R158 PolarHBondContact O-NE 2.9Å; K153-R158 HydrophobicContact CB-CG 3.93Å; K153-R158 WeakPolarHBondContact O-CD 3.4Å; N154-R158 WeakPolarHBondContact O-CG 3.37Å; N154-R158 PolarHBondContact O-N 2.62Å; P155-R158 PolarHBondContact O-N 3.04Å; K156-R158 VanDerWaalsContact C-N 3.34Å; R158-S161 PolarHBondContact O-N 3.15Å; R158-A162 PolarHBondContact O-N 3.3Å; R158-L205 HydrophobicContact CB-CD1 3.62Å; R158-L205 HydrophobicContact CB-CD2 4.22Å
159	A	97.7	Very high	96.4	Very high	12 Å²	12	36.7 Å²	36.7	10%	0.099	19%	0.188	C	C	.	.	H	α-helix	trans	-63.8	-50.7	178.9	0	0	0	0	0	111.7	P155 K156 F157 S161 A162 I163 L205 A208	P155-A159 WeakPolarHBondContact O-CB 3.44Å; P155-A159 PolarHBondContact O-N 3.33Å; K156-A159 PolarHBondContact O-N 2.64Å; F157-A159 VanDerWaalsContact C-N 3.28Å; F157-A159 PolarHBondContact O-N 3.23Å; A159-S161 VanDerWaalsContact C-N 3.34Å; A159-S161 PolarHBondContact O-N 3.36Å; A159-A162 PolarHBondContact O-N 2.63Å; A159-I163 PolarHBondContact O-N 3.5Å; A159-L205 HydrophobicContact CB-CB 4.39Å; A159-L205 HydrophobicContact CB-CD1 4.15Å; A159-A208 HydrophobicContact CB-CB 3.68Å
160	S	98.4	Very high	96.3	Very high	9 Å²	9	32 Å²	32	6%	0.063	17%	0.172	C	C	.	.	H	α-helix	trans	-62.9	-38.9	177	-65.9	0	0	0	0	112.1	A115 D119 K156 F157 A162 I163 A164	A115-S160 WeakPolarHBondContact O-CB 3.48Å; A115-S160 PolarHBondContact O-OG 3.32Å; D119-S160 WeakPolarHBondContact OD1-CB 3.36Å; D119-S160 PolarHBondContact OD1-OG 3.1Å; K156-S160 PolarHBondContact O-N 2.93Å; K156-S160 PolarHBondContact O-OG 3.33Å; F157-S160 PolarHBondContact O-N 3.04Å; S160-A162 VanDerWaalsContact C-N 3.33Å; S160-A162 PolarHBondContact O-N 3.11Å; S160-I163 PolarHBondContact O-N 3.06Å; S160-A164 WeakPolarHBondContact O-CB 3.33Å; S160-A164 PolarHBondContact O-N 3.04Å
161	S	98.5	Very high	96.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.2	-39.6	174.6	-61.3	0	0	0	0	112.5	F157 R158 A159 A164 L165	F157-S161 WeakPolarHBondContact CD2-OG 3.27Å; F157-S161 WeakPolarHBondContact CE2-OG 3.36Å; F157-S161 WeakPolarHBondContact O-CB 3.43Å; F157-S161 PolarHBondContact O-N 3Å; F157-S161 PolarHBondContact O-OG 3.25Å; R158-S161 PolarHBondContact O-N 3.15Å; A159-S161 VanDerWaalsContact C-N 3.34Å; A159-S161 PolarHBondContact O-N 3.36Å; S161-A164 PolarHBondContact O-N 3.42Å; S161-L165 PolarHBondContact O-N 3.41Å
162	A	98.5	Very high	96.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.7	-44.2	178.6	0	0	0	0	0	111.9	I148 R158 A159 S160 A166 F187 A212	I148-A162 HydrophobicContact CD1-CB 4.34Å; I148-A162 HydrophobicContact CG1-CB 4.35Å; R158-A162 PolarHBondContact O-N 3.3Å; A159-A162 PolarHBondContact O-N 2.63Å; S160-A162 VanDerWaalsContact C-N 3.33Å; S160-A162 PolarHBondContact O-N 3.11Å; A162-A166 WeakPolarHBondContact O-CB 3.36Å; A162-A166 PolarHBondContact O-N 2.94Å; A162-A166 VanDerWaalsContact O-N 3.07Å; A162-F187 HydrophobicContact CB-CD1 3.97Å; A162-F187 HydrophobicContact CB-CE1 3.76Å; A162-F187 WeakPolarHBondContact O-CZ 3.18Å; A162-A212 HydrophobicContact CB-CB 4.16Å; A162-A212 WeakPolarHBondContact O-CB 3.26Å
163	I	98.7	Very high	95.4	Very high	21 Å²	21	22.5 Å²	22.5	11%	0.108	12%	0.124	C	C	.	.	H	α-helix	trans	-64.4	-45.7	176.1	-62.3	-61.9	0	0	0	111.1	T122 A159 S160 L165 A166 V167 A208 K211 A212 F342 V346	T122-I163 HydrophobicContact CG2-CG2 3.75Å; A159-I163 PolarHBondContact O-N 3.5Å; S160-I163 PolarHBondContact O-N 3.06Å; I163-L165 PolarHBondContact O-N 3.49Å; I163-A166 PolarHBondContact O-N 3.37Å; I163-V167 PolarHBondContact O-N 3.26Å; I163-A208 HydrophobicContact CD1-CB 4.24Å; I163-A208 WeakPolarHBondContact CD1-O 3.31Å; I163-A208 HydrophobicContact CG1-CB 4.09Å; I163-K211 HydrophobicContact CD1-CB 3.99Å; I163-A212 HydrophobicContact CD1-CB 4.47Å; I163-F342 HydrophobicContact CD1-CE2 3.96Å; I163-F342 HydrophobicContact CD1-CZ 4.35Å; I163-F342 HydrophobicContact CG2-CZ 4.05Å; I163-V346 HydrophobicContact CG2-CG2 4.08Å
164	A	98.5	Very high	94.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.9	-47.8	179	0	0	0	0	0	112	A118 L121 T122 L144 S160 S161 A166 V167 L168	A118-A164 HydrophobicContact CB-CB 4.38Å; L121-A164 HydrophobicContact CD2-CB 4.43Å; T122-A164 VanDerWaalsContact OG1-CA 3.26Å; T122-A164 WeakPolarHBondContact OG1-CA 3.33Å; T122-A164 WeakPolarHBondContact OG1-CB 3.33Å; T122-A164 PolarHBondContact OG1-N 2.94Å; L144-A164 HydrophobicContact CD1-CB 4.25Å; S160-A164 WeakPolarHBondContact O-CB 3.33Å; S160-A164 PolarHBondContact O-N 3.04Å; S161-A164 PolarHBondContact O-N 3.42Å; A164-A166 PolarHBondContact O-N 3.45Å; A164-V167 PolarHBondContact O-N 2.76Å; A164-L168 VanDerWaalsContact O-CG 3.29Å; A164-L168 WeakPolarHBondContact O-CG 3.25Å; A164-L168 PolarHBondContact O-N 2.91Å
165	L	97.9	Very high	93.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.1	-38.1	177.5	-77.4	-169.8	0	0	0	113.1	F137 F141 L144 E145 I148 S161 I163 L168 Q169 F187	F137-L165 HydrophobicContact CD2-CD2 4.46Å; F137-L165 HydrophobicContact CE2-CD2 4.28Å; F141-L165 HydrophobicContact CD2-CD1 4.24Å; F141-L165 HydrophobicContact CD2-CD2 4.41Å; L144-L165 HydrophobicContact CB-CD1 3.79Å; L144-L165 HydrophobicContact CB-CD2 3.87Å; L144-L165 HydrophobicContact CB-CG 3.7Å; L144-L165 HydrophobicContact CD1-CD2 3.84Å; L144-L165 HydrophobicContact CD1-CG 3.99Å; L144-L165 HydrophobicContact CG-CD2 4.39Å; E145-L165 HydrophobicContact CB-CD1 4.18Å; I148-L165 HydrophobicContact CD1-CD1 3.47Å; I148-L165 VanDerWaalsContact CD1-CD1 3.47Å; I148-L165 HydrophobicContact CD1-CG 4.2Å; S161-L165 PolarHBondContact O-N 3.41Å; I163-L165 PolarHBondContact O-N 3.49Å; L165-L168 HydrophobicContact CD2-CD1 4.38Å; L165-Q169 VanDerWaalsContact O-CB 3.28Å; L165-Q169 WeakPolarHBondContact O-CB 3.22Å; L165-Q169 PolarHBondContact O-N 3.32Å; L165-F187 HydrophobicContact CB-CZ 4.2Å
166	A	97.8	Very high	93.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.5	-41.2	177.9	0	0	0	0	0	112.2	A162 I163 A164 Q169 S170 F187 A212 L215 I216	A162-A166 WeakPolarHBondContact O-CB 3.36Å; A162-A166 PolarHBondContact O-N 2.94Å; A162-A166 VanDerWaalsContact O-N 3.07Å; I163-A166 PolarHBondContact O-N 3.37Å; A164-A166 PolarHBondContact O-N 3.45Å; A166-Q169 PolarHBondContact O-N 3.01Å; A166-S170 WeakPolarHBondContact O-CB 3.32Å; A166-S170 PolarHBondContact O-N 3.37Å; A166-S170 PolarHBondContact O-OG 3.01Å; A166-F187 HydrophobicContact CB-CE2 4.03Å; A166-F187 HydrophobicContact CB-CZ 4.09Å; A166-A212 HydrophobicContact CB-CB 3.65Å; A166-L215 HydrophobicContact CB-CD2 4.11Å; A166-I216 HydrophobicContact CB-CD1 4.41Å; A166-I216 HydrophobicContact CB-CG1 4.21Å
167	V	97.2	Very high	92.6	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.012	16%	0.155	C	C	.	.	H	α-helix	trans	-66.3	-44.8	176.4	170.4	0	0	0	0	111.4	T122 L126 I163 A164 S170 L171 L215 F342	T122-V167 HydrophobicContact CG2-CB 4.17Å; T122-V167 HydrophobicContact CG2-CG1 4.42Å; T122-V167 HydrophobicContact CG2-CG2 3.73Å; L126-V167 HydrophobicContact CD2-CG1 4.05Å; L126-V167 HydrophobicContact CG-CG1 4.18Å; I163-V167 PolarHBondContact O-N 3.26Å; A164-V167 PolarHBondContact O-N 2.76Å; V167-S170 WeakPolarHBondContact CA-OG 3.34Å; V167-S170 PolarHBondContact O-N 2.98Å; V167-S170 PolarHBondContact O-OG 3.12Å; V167-L171 HydrophobicContact CG1-CD1 3.67Å; V167-L171 WeakPolarHBondContact O-CB 3.47Å; V167-L171 WeakPolarHBondContact O-CD1 3.28Å; V167-L171 VanDerWaalsContact O-CG 3.29Å; V167-L171 WeakPolarHBondContact O-CG 3.44Å; V167-L171 PolarHBondContact O-N 3.46Å; V167-L171 VanDerWaalsContact O-N 3.08Å; V167-L215 HydrophobicContact CG2-CD2 4.23Å; V167-F342 HydrophobicContact CG2-CE1 3.67Å; V167-F342 HydrophobicContact CG2-CZ 3.76Å
168	L	96.6	Very high	92.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-57.9	-51.4	174.9	-70.8	170.8	0	0	0	110.8	L121 S125 V133 W136 F137 F140 A164 L165 S170 L171 S172	L121-L168 HydrophobicContact CD2-CD1 4.03Å; L121-L168 HydrophobicContact CG-CD1 4.38Å; S125-L168 VanDerWaalsContact OG-CD2 3.23Å; S125-L168 WeakPolarHBondContact OG-CD2 3.36Å; V133-L168 HydrophobicContact CG1-CB 4.38Å; V133-L168 HydrophobicContact CG1-CD2 3.53Å; W136-L168 HydrophobicContact CB-CD2 4.26Å; F137-L168 HydrophobicContact CB-CB 4.15Å; F137-L168 HydrophobicContact CD2-CB 3.68Å; F137-L168 HydrophobicContact CG-CB 4.3Å; F140-L168 HydrophobicContact CB-CD1 4.28Å; A164-L168 VanDerWaalsContact O-CG 3.29Å; A164-L168 WeakPolarHBondContact O-CG 3.25Å; A164-L168 PolarHBondContact O-N 2.91Å; L165-L168 HydrophobicContact CD2-CD1 4.38Å; L168-S170 PolarHBondContact O-N 3.01Å; L168-L171 PolarHBondContact O-N 2.85Å; L168-L171 VanDerWaalsContact O-N 3.14Å; L168-S172 WeakPolarHBondContact O-CB 3.21Å; L168-S172 PolarHBondContact O-N 3.13Å; L168-S172 PolarHBondContact O-OG 2.62Å
169	Q	95.4	Very high	92	Very high	6 Å²	6	32 Å²	32	3%	0.028	17%	0.168	C	C	.	.	H	α-helix	trans	-61.2	-39.4	178.9	177	58.8	73.2	0	0	112.9	F137 L165 A166 L171 G173 V183 I216	F137-Q169 HydrophobicContact CE2-CB 3.93Å; F137-Q169 HydrophobicContact CZ-CB 4.03Å; F137-Q169 HydrophobicContact CZ-CG 4.4Å; L165-Q169 VanDerWaalsContact O-CB 3.28Å; L165-Q169 WeakPolarHBondContact O-CB 3.22Å; L165-Q169 PolarHBondContact O-N 3.32Å; A166-Q169 PolarHBondContact O-N 3.01Å; Q169-L171 VanDerWaalsContact C-N 3.26Å; Q169-L171 PolarHBondContact O-N 3.48Å; Q169-G173 PolarHBondContact NE2-O 2.99Å; Q169-G173 PolarHBondContact O-N 2.91Å; Q169-V183 HydrophobicContact CG-CG2 4.26Å; Q169-I216 HydrophobicContact CB-CD1 4.05Å; Q169-I216 HydrophobicContact CB-CG1 4.38Å; Q169-I216 HydrophobicContact CG-CD1 3.8Å; Q169-I216 HydrophobicContact CG-CG1 4.09Å; Q169-I216 HydrophobicContact CG-CG2 4.16Å
170	S	93.7	Very high	91.8	Very high	12 Å²	12	32.4 Å²	32.4	8%	0.084	17%	0.17	C	C	.	.	H	α-helix	trans	-68.6	-26.3	178	62.9	0	0	0	0	113.1	A166 V167 L168	A166-S170 WeakPolarHBondContact O-CB 3.32Å; A166-S170 PolarHBondContact O-N 3.37Å; A166-S170 PolarHBondContact O-OG 3.01Å; V167-S170 WeakPolarHBondContact CA-OG 3.34Å; V167-S170 PolarHBondContact O-N 2.98Å; V167-S170 PolarHBondContact O-OG 3.12Å; L168-S170 PolarHBondContact O-N 3.01Å
171	L	92.7	Very high	91.7	Very high	14 Å²	14	34.1 Å²	34.1	7%	0.073	18%	0.178	C	C	.	.	H	α-helix	trans	-86.1	-35.8	177.4	-74.4	164.6	0	0	0	112.4	S125 L126 P130 V133 V167 L168 Q169 G173 Y360	S125-L171 VanDerWaalsContact O-CD1 3.3Å; S125-L171 WeakPolarHBondContact O-CD1 3.4Å; L126-L171 HydrophobicContact CD2-CD1 4.33Å; P130-L171 HydrophobicContact CB-CD2 4.2Å; P130-L171 HydrophobicContact CG-CD2 4.02Å; V133-L171 HydrophobicContact CB-CB 4.05Å; V133-L171 HydrophobicContact CG1-CB 3.73Å; V133-L171 HydrophobicContact CG1-CD1 4.28Å; V133-L171 HydrophobicContact CG2-CB 4.15Å; V133-L171 HydrophobicContact CG2-CD1 4.24Å; V167-L171 HydrophobicContact CG1-CD1 3.67Å; V167-L171 WeakPolarHBondContact O-CB 3.47Å; V167-L171 WeakPolarHBondContact O-CD1 3.28Å; V167-L171 VanDerWaalsContact O-CG 3.29Å; V167-L171 WeakPolarHBondContact O-CG 3.44Å; V167-L171 PolarHBondContact O-N 3.46Å; V167-L171 VanDerWaalsContact O-N 3.08Å; L168-L171 PolarHBondContact O-N 2.85Å; L168-L171 VanDerWaalsContact O-N 3.14Å; Q169-L171 VanDerWaalsContact C-N 3.26Å; Q169-L171 PolarHBondContact O-N 3.48Å; L171-G173 VanDerWaalsContact C-N 3.32Å; L171-G173 PolarHBondContact O-N 3.45Å; L171-Y360 HydrophobicContact CD2-CD1 3.71Å; L171-Y360 HydrophobicContact CD2-CD2 3.49Å; L171-Y360 VanDerWaalsContact CD2-CD2 3.49Å; L171-Y360 HydrophobicContact CD2-CE1 3.54Å; L171-Y360 HydrophobicContact CD2-CE2 3.31Å; L171-Y360 HydrophobicContact CD2-CG 3.67Å; L171-Y360 HydrophobicContact CG-CE1 4.28Å; L171-Y360 HydrophobicContact CG-CE2 4.29Å
172	S	89.8	Confident	91.4	Very high	14 Å²	14	37.7 Å²	37.7	10%	0.098	20%	0.197	C	C	.	.	H	α-helix	trans	-72.8	-21.3	-178.1	-61.3	0	0	0	0	114	P134 F137 L168	P134-S172 WeakPolarHBondContact CA-OG 3.48Å; F137-S172 WeakPolarHBondContact CB-OG 3.41Å; L168-S172 WeakPolarHBondContact O-CB 3.21Å; L168-S172 PolarHBondContact O-N 3.13Å; L168-S172 PolarHBondContact O-OG 2.62Å
173	G	76.4	Confident	91.3	Very high	42 Å²	42	37.7 Å²	37.7	43%	0.433	20%	0.197	S	C	.	.			trans	65.7	-131.9	-173.5	0	0	0	0	0	111.6	Q169 L171	Q169-G173 PolarHBondContact NE2-O 2.99Å; Q169-G173 PolarHBondContact O-N 2.91Å; L171-G173 VanDerWaalsContact C-N 3.32Å; L171-G173 PolarHBondContact O-N 3.45Å
174	Y	75.2	Confident	91.2	Very high	182 Å²	182	36.8 Å²	36.8	71%	0.714	19%	0.193	S	C	*	.	S	Bend	trans	-84.4	118.4	177.1	-169.4	-90.8	0	0	0	110.5
175	C	80	Confident	91	Very high	6 Å²	6	42.4 Å²	42.4	4%	0.041	22%	0.217	C	C	.	.			trans	-99.8	138.1	171.7	171.9	0	0	0	0	109	F137 E138 F177	F137-C175 HydrophobicContact CD1-CB 4.25Å; F137-C175 HydrophobicContact CE1-CB 4.26Å; E138-C175 PolarHBondContact OE1-SG 2.85Å; C175-F177 PolarHBondContact O-N 3.43Å
176	D	79.8	Confident	90.9	Very high	129 Å²	129	42.6 Å²	42.6	69%	0.69	22%	0.219	S	C	*	.	S	Bend	trans	-62.3	-28.2	-175.6	-72.3	-29.3	0	0	0	113.4
177	F	86.1	Confident	90.9	Very high	167 Å²	167	42.6 Å²	42.6	73%	0.732	22%	0.219	S	C	*	.	S	Bend	trans	-111.9	-19.4	-170.6	-55.1	-69.4	0	0	0	114.5	C175	C175-F177 PolarHBondContact O-N 3.43Å
178	I	91.6	Very high	90.8	Very high	17 Å²	17	43.4 Å²	43.4	9%	0.087	22%	0.222	C	C	.	.	S	Bend	trans	-125	107.3	-174.3	-56.3	161.8	0	0	0	108.4	F137 E138 F141 V183	F137-I178 HydrophobicContact CD1-CD1 4.11Å; F137-I178 HydrophobicContact CE1-CB 3.7Å; F137-I178 HydrophobicContact CE1-CD1 3.8Å; F137-I178 HydrophobicContact CE1-CG1 4.38Å; F137-I178 HydrophobicContact CE1-CG2 3.61Å; F137-I178 HydrophobicContact CZ-CB 4.18Å; F137-I178 HydrophobicContact CZ-CD1 4.27Å; F137-I178 HydrophobicContact CZ-CG2 3.55Å; E138-I178 HydrophobicContact CG-CD1 4.33Å; F141-I178 HydrophobicContact CB-CD1 3.63Å; F141-I178 HydrophobicContact CD1-CD1 3.68Å; F141-I178 HydrophobicContact CD1-CG1 3.97Å; F141-I178 HydrophobicContact CD1-CG2 4.18Å; F141-I178 HydrophobicContact CD2-CD1 4.41Å; F141-I178 HydrophobicContact CD2-CG2 3.93Å; F141-I178 HydrophobicContact CE1-CD1 4.47Å; F141-I178 HydrophobicContact CE1-CG1 4.3Å; F141-I178 HydrophobicContact CE1-CG2 4.03Å; F141-I178 HydrophobicContact CE2-CG2 3.78Å; F141-I178 HydrophobicContact CG-CD1 3.64Å; F141-I178 HydrophobicContact CG-CG1 4.3Å; F141-I178 HydrophobicContact CG-CG2 4.13Å; F141-I178 HydrophobicContact CZ-CG2 3.83Å; I178-V183 HydrophobicContact CG2-CG2 3.85Å
179	S	92.1	Very high	90.7	Very high	38 Å²	38	47.3 Å²	47.3	27%	0.266	24%	0.239	S	C	.	.			trans	-72	136.1	177.5	-178.2	0	0	0	0	110.7	L181 D182 V183	S179-L181 PolarHBondContact O-N 3.42Å; S179-L181 PolarHBondContact OG-N 3.19Å; S179-D182 PolarHBondContact O-N 2.94Å; S179-V183 PolarHBondContact O-N 2.91Å
180	P	93.8	Very high	90.6	Very high	22 Å²	22	47.2 Å²	47.2	14%	0.143	24%	0.239	C	C	.	.	H	α-helix	trans	-52.6	-30.2	170.1	-24.4	31.4	0	0	0	113.1	V183 I184 I216 L220	P180-V183 PolarHBondContact O-N 3.15Å; P180-I184 WeakPolarHBondContact O-CB 3.44Å; P180-I184 PolarHBondContact O-N 3.36Å; P180-I216 HydrophobicContact CB-CG2 3.93Å; P180-L220 HydrophobicContact CB-CD2 3.89Å
181	L	94.6	Very high	90.6	Very high	45 Å²	45	46.6 Å²	46.6	24%	0.236	24%	0.235	C	C	.	.	H	α-helix	trans	-67.5	-33.8	177.8	-61.5	-179.6	0	0	0	112.6	S179 K185 L220 D224 V228	S179-L181 PolarHBondContact O-N 3.42Å; S179-L181 PolarHBondContact OG-N 3.19Å; L181-K185 VanDerWaalsContact O-CG 3.25Å; L181-K185 WeakPolarHBondContact O-CG 3.35Å; L181-K185 PolarHBondContact O-N 3.24Å; L181-K185 VanDerWaalsContact O-N 3.07Å; L181-L220 HydrophobicContact CD2-CD1 4.17Å; L181-L220 HydrophobicContact CD2-CD2 3.89Å; L181-D224 HydrophobicContact CD2-CB 4.23Å; L181-V228 HydrophobicContact CD2-CG2 3.78Å
182	D	93.5	Very high	90.5	Very high	75 Å²	75	51.8 Å²	51.8	40%	0.401	25%	0.253	S	S	.	.	H	α-helix	trans	-76.5	-34.5	178.9	-66.2	-31.5	0	0	0	111.4	S179 K185 S186	S179-D182 PolarHBondContact O-N 2.94Å; D182-K185 PolarHBondContact O-N 3.11Å; D182-K185 IonicContact OD1-NZ 3.11Å; D182-K185 PolarHBondContact OD1-NZ 2.8Å; D182-S186 PolarHBondContact O-N 3.4Å; D182-S186 PolarHBondContact O-OG 3.32Å; D182-S186 VanDerWaalsContact O-OG 3.04Å
183	V	95.9	Very high	89.8	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62	-48.4	169.9	-166.7	0	0	0	0	110.4	F137 F141 Q169 I178 S179 P180 K185 S186 F187 I216	F137-V183 HydrophobicContact CE2-CG2 4.43Å; F137-V183 HydrophobicContact CZ-CG2 3.76Å; F141-V183 HydrophobicContact CD2-CG2 4.43Å; F141-V183 HydrophobicContact CE2-CG2 3.88Å; Q169-V183 HydrophobicContact CG-CG2 4.26Å; I178-V183 HydrophobicContact CG2-CG2 3.85Å; S179-V183 PolarHBondContact O-N 2.91Å; P180-V183 PolarHBondContact O-N 3.15Å; V183-K185 PolarHBondContact O-N 2.99Å; V183-S186 VanDerWaalsContact O-CB 3.24Å; V183-S186 WeakPolarHBondContact O-CB 3.32Å; V183-S186 PolarHBondContact O-N 3.48Å; V183-F187 HydrophobicContact CG1-CE2 3.92Å; V183-F187 HydrophobicContact CG1-CZ 3.79Å; V183-F187 PolarHBondContact O-N 3.31Å; V183-I216 HydrophobicContact CB-CD1 3.77Å; V183-I216 HydrophobicContact CG1-CD1 3.39Å
184	I	96	Very high	89.2	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-56.9	-45.9	178.2	-87.2	177.4	0	0	0	112	P180 S186 F187 E188 I216 L220 V228	P180-I184 WeakPolarHBondContact O-CB 3.44Å; P180-I184 PolarHBondContact O-N 3.36Å; I184-S186 PolarHBondContact O-N 3.04Å; I184-F187 PolarHBondContact O-N 2.94Å; I184-E188 HydrophobicContact CG2-CG 4.32Å; I184-E188 WeakPolarHBondContact CG2-OE1 3.37Å; I184-E188 PolarHBondContact O-N 3.07Å; I184-I216 HydrophobicContact CD1-CB 3.81Å; I184-I216 HydrophobicContact CD1-CG2 3.55Å; I184-I216 HydrophobicContact CG1-CB 3.69Å; I184-I216 HydrophobicContact CG1-CD1 4.27Å; I184-I216 HydrophobicContact CG1-CG2 3.66Å; I184-L220 HydrophobicContact CD1-CD1 3.68Å; I184-L220 HydrophobicContact CD1-CD2 3.99Å; I184-L220 HydrophobicContact CD1-CG 4Å; I184-V228 HydrophobicContact CG2-CG1 4.29Å
185	K	95.5	Very high	88.4	Confident	118 Å²	118	49.5 Å²	49.5	51%	0.513	25%	0.253	S	S	.	.	H	α-helix	trans	-58.4	-31.7	177.7	-73.6	168.1	-160.2	158.6	0	112.5	L181 D182 V183 F187 E188 F189	L181-K185 VanDerWaalsContact O-CG 3.25Å; L181-K185 WeakPolarHBondContact O-CG 3.35Å; L181-K185 PolarHBondContact O-N 3.24Å; L181-K185 VanDerWaalsContact O-N 3.07Å; D182-K185 PolarHBondContact O-N 3.11Å; D182-K185 IonicContact OD1-NZ 3.11Å; D182-K185 PolarHBondContact OD1-NZ 2.8Å; V183-K185 PolarHBondContact O-N 2.99Å; K185-F187 VanDerWaalsContact C-N 3.33Å; K185-E188 PolarHBondContact O-N 3.32Å; K185-F189 PolarHBondContact O-N 2.99Å
186	S	95.8	Very high	87.1	Confident	4 Å²	4	55.7 Å²	55.7	3%	0.028	30%	0.297	C	S	.	.	H	α-helix	trans	-66	-36.9	177.3	-55.8	0	0	0	0	111.8	E145 D182 V183 I184	E145-S186 VanDerWaalsContact CG-OG 3.26Å; E145-S186 WeakPolarHBondContact CG-OG 3.19Å; E145-S186 PolarHBondContact OE1-OG 2.99Å; D182-S186 PolarHBondContact O-N 3.4Å; D182-S186 PolarHBondContact O-OG 3.32Å; D182-S186 VanDerWaalsContact O-OG 3.04Å; V183-S186 VanDerWaalsContact O-CB 3.24Å; V183-S186 WeakPolarHBondContact O-CB 3.32Å; V183-S186 PolarHBondContact O-N 3.48Å; I184-S186 PolarHBondContact O-N 3.04Å
187	F	97.2	Very high	86	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-74.2	-40.2	173.1	-52.5	-36.4	0	0	0	111.9	I148 A162 L165 A166 V183 I184 K185 F189 V190 F191 A209 A212 W213 I216	I148-F187 HydrophobicContact CD1-CE1 4.02Å; I148-F187 HydrophobicContact CG2-CD1 4.33Å; A162-F187 HydrophobicContact CB-CD1 3.97Å; A162-F187 HydrophobicContact CB-CE1 3.76Å; A162-F187 WeakPolarHBondContact O-CZ 3.18Å; L165-F187 HydrophobicContact CB-CZ 4.2Å; A166-F187 HydrophobicContact CB-CE2 4.03Å; A166-F187 HydrophobicContact CB-CZ 4.09Å; V183-F187 HydrophobicContact CG1-CE2 3.92Å; V183-F187 HydrophobicContact CG1-CZ 3.79Å; V183-F187 PolarHBondContact O-N 3.31Å; I184-F187 PolarHBondContact O-N 2.94Å; K185-F187 VanDerWaalsContact C-N 3.33Å; F187-F189 VanDerWaalsContact C-N 3.26Å; F187-F189 PolarHBondContact O-N 2.7Å; F187-V190 WeakPolarHBondContact O-CB 3.29Å; F187-V190 PolarHBondContact O-N 2.86Å; F187-F191 HydrophobicContact CB-CE1 4.34Å; F187-F191 WeakPolarHBondContact O-CD1 3.44Å; F187-F191 WeakPolarHBondContact O-CE1 3.35Å; F187-F191 PolarHBondContact O-N 3.38Å; F187-A209 HydrophobicContact CB-CB 4.44Å; F187-A212 HydrophobicContact CD1-CB 4.16Å; F187-A212 HydrophobicContact CD2-CB 3.75Å; F187-A212 HydrophobicContact CE1-CB 4.03Å; F187-A212 HydrophobicContact CE2-CB 3.55Å; F187-A212 HydrophobicContact CG-CB 4.04Å; F187-A212 HydrophobicContact CZ-CB 3.73Å; F187-W213 HydrophobicContact CB-CB 4.09Å; F187-W213 HydrophobicContact CD2-CB 4.29Å; F187-I216 HydrophobicContact CD2-CD1 4.3Å; F187-I216 HydrophobicContact CE2-CD1 3.46Å; F187-I216 VanDerWaalsContact CE2-CD1 3.46Å; F187-I216 HydrophobicContact CE2-CG1 4.32Å; F187-I216 HydrophobicContact CZ-CD1 4.26Å
188	E	95.4	Very high	85	Confident	18 Å²	18	52.1 Å²	52.1	8%	0.084	28%	0.276	C	S	.	.	H	α-helix	trans	-57.5	-40.2	174.2	-67.5	-168.5	-163.3	0	0	112	I184 K185 V190 F191 R192 W213	I184-E188 HydrophobicContact CG2-CG 4.32Å; I184-E188 WeakPolarHBondContact CG2-OE1 3.37Å; I184-E188 PolarHBondContact O-N 3.07Å; K185-E188 PolarHBondContact O-N 3.32Å; E188-V190 PolarHBondContact O-N 2.92Å; E188-F191 HydrophobicContact CB-CE2 4.32Å; E188-F191 HydrophobicContact CB-CZ 4.05Å; E188-F191 HydrophobicContact CG-CE1 4.33Å; E188-F191 HydrophobicContact CG-CE2 4.18Å; E188-F191 HydrophobicContact CG-CZ 3.64Å; E188-F191 PolarHBondContact O-N 3.46Å; E188-R192 HydrophobicContact CB-CG 4.37Å; E188-R192 WeakPolarHBondContact O-CB 3.21Å; E188-R192 WeakPolarHBondContact O-CG 3.27Å; E188-R192 PolarHBondContact O-N 3.06Å; E188-R192 IonicContact OE2-CZ 3.58Å; E188-R192 IonicContact OE2-NE 3.03Å; E188-R192 PolarHBondContact OE2-NE 3.23Å; E188-R192 IonicContact OE2-NH2 3.48Å; E188-R192 PolarHBondContact OE2-NH2 2.87Å; E188-W213 VanDerWaalsContact CG-CD1 3.43Å; E188-W213 VanDerWaalsContact CG-NE1 3.29Å; E188-W213 PolarHBondContact OE1-NE1 3.3Å
189	F	93.8	Very high	83.9	Confident	83 Å²	83	57.5 Å²	57.5	36%	0.364	30%	0.301	S	S	.	.	H	α-helix	trans	-54.1	-38.9	175.6	179	-91.6	0	0	0	112.2	R149 K185 F187 S193	R149-F189 HydrophobicContact CB-CD1 3.96Å; R149-F189 HydrophobicContact CB-CE1 4.07Å; R149-F189 HydrophobicContact CG-CD1 3.89Å; R149-F189 HydrophobicContact CG-CE1 4.49Å; R149-F189 HydrophobicContact CG-CG 4.32Å; R149-F189 VanDerWaalsContact O-CE1 3.24Å; R149-F189 WeakPolarHBondContact O-CE1 3.49Å; K185-F189 PolarHBondContact O-N 2.99Å; F187-F189 VanDerWaalsContact C-N 3.26Å; F187-F189 PolarHBondContact O-N 2.7Å; F189-S193 PolarHBondContact O-OG 3.03Å
190	V	94.5	Very high	83.2	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.018	32%	0.321	C	S	.	.	H	α-helix	trans	-65.1	-53.1	-179.6	177.3	0	0	0	0	111.3	I148 F187 E188 L205 Y206 A209	I148-V190 HydrophobicContact CG2-CG2 3.59Å; F187-V190 WeakPolarHBondContact O-CB 3.29Å; F187-V190 PolarHBondContact O-N 2.86Å; E188-V190 PolarHBondContact O-N 2.92Å; V190-L205 HydrophobicContact CG1-CD1 3.94Å; V190-L205 HydrophobicContact CG1-CD2 3.92Å; V190-L205 HydrophobicContact CG1-CG 3.62Å; V190-Y206 HydrophobicContact CG1-CD1 3.94Å; V190-Y206 HydrophobicContact CG1-CE1 4.1Å; V190-Y206 WeakPolarHBondContact O-CE1 3.41Å; V190-A209 HydrophobicContact CB-CB 3.93Å; V190-A209 HydrophobicContact CG1-CB 3.84Å; V190-A209 HydrophobicContact CG2-CB 4.47Å
191	F	92.8	Very high	82.5	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-89.9	-20.3	-173.2	60.9	-108.9	0	0	0	114.1	F187 E188 S193 S194 A209 L210 W213 V232 V235 L239	F187-F191 HydrophobicContact CB-CE1 4.34Å; F187-F191 WeakPolarHBondContact O-CD1 3.44Å; F187-F191 WeakPolarHBondContact O-CE1 3.35Å; F187-F191 PolarHBondContact O-N 3.38Å; E188-F191 HydrophobicContact CB-CE2 4.32Å; E188-F191 HydrophobicContact CB-CZ 4.05Å; E188-F191 HydrophobicContact CG-CE1 4.33Å; E188-F191 HydrophobicContact CG-CE2 4.18Å; E188-F191 HydrophobicContact CG-CZ 3.64Å; E188-F191 PolarHBondContact O-N 3.46Å; F191-S193 PolarHBondContact O-N 3.4Å; F191-S194 WeakPolarHBondContact O-CB 3.22Å; F191-S194 PolarHBondContact O-N 3.23Å; F191-S194 PolarHBondContact O-OG 3.14Å; F191-A209 HydrophobicContact CD1-CB 4.14Å; F191-L210 HydrophobicContact CD1-CD2 3.75Å; F191-L210 HydrophobicContact CD1-CG 4.02Å; F191-L210 HydrophobicContact CD2-CD2 4.15Å; F191-L210 HydrophobicContact CE1-CD2 3.77Å; F191-L210 HydrophobicContact CE1-CG 4.41Å; F191-L210 HydrophobicContact CE2-CD2 4.17Å; F191-L210 HydrophobicContact CG-CD2 3.93Å; F191-L210 HydrophobicContact CG-CG 4.28Å; F191-L210 HydrophobicContact CZ-CD2 3.95Å; F191-W213 HydrophobicContact CE1-CB 3.93Å; F191-W213 AromaticContact CE1-CD1 3.92Å; F191-W213 AromaticContact CE1-CG 3.96Å; F191-W213 HydrophobicContact CE1-CG 3.96Å; F191-W213 HydrophobicContact CZ-CB 4.39Å; F191-W213 AromaticContact CZ-CD1 3.71Å; F191-W213 HydrophobicContact CZ-CD2 4.46Å; F191-W213 AromaticContact CZ-CG 3.94Å; F191-W213 HydrophobicContact CZ-CG 3.94Å; F191-V232 HydrophobicContact CE2-CG2 3.8Å; F191-V232 HydrophobicContact CZ-CG2 4.06Å; F191-V235 HydrophobicContact CD2-CG1 3.74Å; F191-V235 HydrophobicContact CE2-CG1 4.01Å; F191-L239 HydrophobicContact CB-CD1 4.15Å; F191-L239 HydrophobicContact CD2-CD1 3.98Å; F191-L239 HydrophobicContact CG-CD1 4.32Å
192	R	90.4	Very high	82.3	Confident	122 Å²	122	62.6 Å²	62.6	46%	0.46	34%	0.335	S	S	.	.	H	α-helix	trans	-68.3	-23.7	169.5	-74	178.9	178.4	-120.1	1.9	112.3	E188 S194 V235	E188-R192 HydrophobicContact CB-CG 4.37Å; E188-R192 WeakPolarHBondContact O-CB 3.21Å; E188-R192 WeakPolarHBondContact O-CG 3.27Å; E188-R192 PolarHBondContact O-N 3.06Å; E188-R192 IonicContact OE2-CZ 3.58Å; E188-R192 IonicContact OE2-NE 3.03Å; E188-R192 PolarHBondContact OE2-NE 3.23Å; E188-R192 IonicContact OE2-NH2 3.48Å; E188-R192 PolarHBondContact OE2-NH2 2.87Å; R192-S194 PolarHBondContact O-N 3Å; R192-V235 HydrophobicContact CG-CG1 4.1Å; R192-V235 HydrophobicContact CG-CG2 4Å
193	S	75	Confident	82.3	Confident	59 Å²	59	59.8 Å²	59.8	41%	0.413	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-1.1	173.7	-59.7	0	0	0	0	113	F189 F191 T195	F189-S193 PolarHBondContact O-OG 3.03Å; F191-S193 PolarHBondContact O-N 3.4Å; S193-T195 PolarHBondContact O-N 2.93Å
194	S	64.9	Low	82.3	Confident	26 Å²	26	65.4 Å²	65.4	18%	0.182	35%	0.35	C	S	.	.			trans	-68.1	92.4	177.2	73.3	0	0	0	0	110.9	F191 R192 Y206	F191-S194 WeakPolarHBondContact O-CB 3.22Å; F191-S194 PolarHBondContact O-N 3.23Å; F191-S194 PolarHBondContact O-OG 3.14Å; R192-S194 PolarHBondContact O-N 3Å; S194-Y206 VanDerWaalsContact CA-OH 3.25Å; S194-Y206 WeakPolarHBondContact CA-OH 3.38Å; S194-Y206 VanDerWaalsContact CB-CE2 3.41Å; S194-Y206 PolarHBondContact N-OH 3.01Å
195	T	58	Low	82.3	Confident	106 Å²	106	65.5 Å²	65.5	65%	0.65	35%	0.35	S	S	*	.			trans	-86.2	165.5	164.8	63.8	0	0	0	0	109.4	S193 K197 I198	S193-T195 PolarHBondContact O-N 2.93Å; T195-K197 PolarHBondContact O-N 3.23Å; T195-I198 WeakPolarHBondContact O-CG1 3.49Å; T195-I198 PolarHBondContact O-N 3.15Å
196	S	51.4	Low	82.3	Confident	136 Å²	136	60.4 Å²	60.4	95%	0.951	33%	0.327	S	S	*	.	S	Bend	trans	-58.2	3.8	-173.4	-43.4	0	0	0	0	116.5
197	K	57.9	Low	82.3	Confident	183 Å²	183	61.2 Å²	61.2	80%	0.796	33%	0.332	S	S	*	.			trans	-121.5	53.4	177.4	-62.1	-176.9	-179.2	178.9	0	111.1	T195 E199	T195-K197 PolarHBondContact O-N 3.23Å; K197-E199 PolarHBondContact O-N 3.01Å
198	I	65.4	Low	82.4	Confident	37 Å²	37	61.7 Å²	61.7	19%	0.19	34%	0.336	C	S	.	.			trans	-64.8	117.3	175.1	-53	169.9	0	0	0	107.9	T195 I202 F203 Y206 C242	T195-I198 WeakPolarHBondContact O-CG1 3.49Å; T195-I198 PolarHBondContact O-N 3.15Å; I198-I202 HydrophobicContact CG2-CD1 3.74Å; I198-I202 HydrophobicContact CG2-CG1 3.62Å; I198-F203 HydrophobicContact CB-CE1 3.86Å; I198-F203 HydrophobicContact CB-CZ 4.4Å; I198-F203 HydrophobicContact CD1-CE1 4.39Å; I198-F203 HydrophobicContact CG2-CD1 3.67Å; I198-F203 HydrophobicContact CG2-CE1 3.33Å; I198-F203 HydrophobicContact CG2-CZ 4.12Å; I198-Y206 HydrophobicContact CD1-CD2 4.38Å; I198-Y206 HydrophobicContact CD1-CE2 3.84Å; I198-Y206 HydrophobicContact CG1-CE2 4.05Å; I198-Y206 HydrophobicContact CG2-CD2 4.25Å; I198-Y206 HydrophobicContact CG2-CE2 3.73Å; I198-C242 HydrophobicContact CD1-CB 4.43Å; I198-C242 WeakPolarHBondContact CD1-SG 3.49Å
199	E	68.5	Low	82.5	Confident	130 Å²	130	60.8 Å²	60.8	61%	0.607	33%	0.332	S	S	*	.			trans	-66.5	143.8	173.6	-64.8	-176.3	-177.6	0	0	109.6	K197 D201 I202	K197-E199 PolarHBondContact O-N 3.01Å; E199-D201 WeakPolarHBondContact CB-OD1 3.47Å; E199-D201 PolarHBondContact O-N 3.08Å; E199-D201 VanDerWaalsContact O-N 3.08Å; E199-I202 WeakPolarHBondContact O-CG1 3.43Å; E199-I202 PolarHBondContact O-N 3.42Å
200	A	76.7	Confident	82.7	Confident	83 Å²	83	56.9 Å²	56.9	69%	0.686	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.4	-172.5	0	0	0	0	0	113.7	F203	A200-F203 VanDerWaalsContact CA-CE2 3.49Å; A200-F203 HydrophobicContact CB-CD2 4.35Å; A200-F203 HydrophobicContact CB-CE2 4.01Å; A200-F203 VanDerWaalsContact O-CD2 3.26Å; A200-F203 WeakPolarHBondContact O-CD2 3.38Å
201	D	79.7	Confident	82.8	Confident	94 Å²	94	58.7 Å²	58.7	50%	0.503	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-13.8	-177	66.9	-25.2	0	0	0	114.2	E199	E199-D201 WeakPolarHBondContact CB-OD1 3.47Å; E199-D201 PolarHBondContact O-N 3.08Å; E199-D201 VanDerWaalsContact O-N 3.08Å
202	I	90.8	Very high	83.1	Confident	35 Å²	35	58.7 Å²	58.7	18%	0.179	32%	0.322	C	S	.	.	S	Bend	trans	-101.3	-1.5	179.6	61.4	169.2	0	0	0	114.1	P155 I198 E199 D204 L205 Y206	P155-I202 HydrophobicContact CG-CG2 4.34Å; I198-I202 HydrophobicContact CG2-CD1 3.74Å; I198-I202 HydrophobicContact CG2-CG1 3.62Å; E199-I202 WeakPolarHBondContact O-CG1 3.43Å; E199-I202 PolarHBondContact O-N 3.42Å; I202-D204 VanDerWaalsContact C-N 3.34Å; I202-D204 PolarHBondContact O-N 2.93Å; I202-L205 WeakPolarHBondContact O-CB 3.48Å; I202-L205 PolarHBondContact O-N 3.36Å; I202-L205 VanDerWaalsContact O-N 3.17Å; I202-Y206 HydrophobicContact CD1-CE1 4.08Å; I202-Y206 HydrophobicContact CD1-CE2 4.36Å; I202-Y206 PolarHBondContact O-N 2.92Å
203	F	93.3	Very high	83.5	Confident	17 Å²	17	52.9 Å²	52.9	8%	0.075	30%	0.3	C	S	.	.	H	α-helix	trans	-60.6	-40.9	179.6	-68.9	-47.5	0	0	0	113	I198 A200 L205 Y206 V207 S243 N244 V247	I198-F203 HydrophobicContact CB-CE1 3.86Å; I198-F203 HydrophobicContact CB-CZ 4.4Å; I198-F203 HydrophobicContact CD1-CE1 4.39Å; I198-F203 HydrophobicContact CG2-CD1 3.67Å; I198-F203 HydrophobicContact CG2-CE1 3.33Å; I198-F203 HydrophobicContact CG2-CZ 4.12Å; A200-F203 VanDerWaalsContact CA-CE2 3.49Å; A200-F203 HydrophobicContact CB-CD2 4.35Å; A200-F203 HydrophobicContact CB-CE2 4.01Å; A200-F203 VanDerWaalsContact O-CD2 3.26Å; A200-F203 WeakPolarHBondContact O-CD2 3.38Å; F203-L205 VanDerWaalsContact C-N 3.27Å; F203-L205 PolarHBondContact O-N 3.21Å; F203-Y206 PolarHBondContact O-N 3.08Å; F203-Y206 VanDerWaalsContact O-N 3.15Å; F203-V207 WeakPolarHBondContact O-CG2 3.48Å; F203-V207 PolarHBondContact O-N 3.2Å; F203-S243 WeakPolarHBondContact CZ-OG 3.3Å; F203-N244 HydrophobicContact CB-CB 4.16Å; F203-N244 WeakPolarHBondContact CB-ND2 3.25Å; F203-N244 HydrophobicContact CD1-CB 3.53Å; F203-N244 HydrophobicContact CD2-CB 3.7Å; F203-N244 WeakPolarHBondContact CD2-ND2 3.28Å; F203-N244 HydrophobicContact CE1-CB 3.71Å; F203-N244 HydrophobicContact CE2-CB 3.86Å; F203-N244 HydrophobicContact CG-CB 3.54Å; F203-N244 WeakPolarHBondContact CG-ND2 3.47Å; F203-N244 HydrophobicContact CZ-CB 3.89Å; F203-V247 HydrophobicContact CB-CG2 4.15Å; F203-V247 HydrophobicContact CD1-CG2 3.93Å; F203-V247 HydrophobicContact CG-CG2 4.42Å
204	D	94.6	Very high	84.6	Confident	118 Å²	118	50 Å²	50	63%	0.631	28%	0.281	S	S	*	.	H	α-helix	trans	-64.8	-35.1	178.1	-69.6	-19.2	0	0	0	111.7	I202 V207 A208	I202-D204 VanDerWaalsContact C-N 3.34Å; I202-D204 PolarHBondContact O-N 2.93Å; D204-V207 PolarHBondContact O-N 2.9Å; D204-A208 WeakPolarHBondContact O-CB 3.37Å; D204-A208 PolarHBondContact O-N 2.86Å
205	L	96	Very high	86.2	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.016	27%	0.274	C	S	.	.	H	α-helix	trans	-65	-41	173.1	170.5	61.9	0	0	0	111.4	R158 A159 V190 I202 F203 A208 A209	R158-L205 HydrophobicContact CB-CD1 3.62Å; R158-L205 HydrophobicContact CB-CD2 4.22Å; A159-L205 HydrophobicContact CB-CB 4.39Å; A159-L205 HydrophobicContact CB-CD1 4.15Å; V190-L205 HydrophobicContact CG1-CD1 3.94Å; V190-L205 HydrophobicContact CG1-CD2 3.92Å; V190-L205 HydrophobicContact CG1-CG 3.62Å; I202-L205 WeakPolarHBondContact O-CB 3.48Å; I202-L205 PolarHBondContact O-N 3.36Å; I202-L205 VanDerWaalsContact O-N 3.17Å; F203-L205 VanDerWaalsContact C-N 3.27Å; F203-L205 PolarHBondContact O-N 3.21Å; L205-A208 PolarHBondContact O-N 3.49Å; L205-A209 VanDerWaalsContact O-CB 3.3Å; L205-A209 WeakPolarHBondContact O-CB 3.47Å; L205-A209 PolarHBondContact O-N 3.5Å
206	Y	95.4	Very high	88.1	Confident	11 Å²	11	44.2 Å²	44.2	4%	0.043	24%	0.243	C	C	.	.	H	α-helix	trans	-65.9	-41.5	175.7	-74	5.2	0	0	0	111.9	V190 S194 I198 I202 F203 A208 A209 L210 L239	V190-Y206 HydrophobicContact CG1-CD1 3.94Å; V190-Y206 HydrophobicContact CG1-CE1 4.1Å; V190-Y206 WeakPolarHBondContact O-CE1 3.41Å; S194-Y206 VanDerWaalsContact CA-OH 3.25Å; S194-Y206 WeakPolarHBondContact CA-OH 3.38Å; S194-Y206 VanDerWaalsContact CB-CE2 3.41Å; S194-Y206 PolarHBondContact N-OH 3.01Å; I198-Y206 HydrophobicContact CD1-CD2 4.38Å; I198-Y206 HydrophobicContact CD1-CE2 3.84Å; I198-Y206 HydrophobicContact CG1-CE2 4.05Å; I198-Y206 HydrophobicContact CG2-CD2 4.25Å; I198-Y206 HydrophobicContact CG2-CE2 3.73Å; I202-Y206 HydrophobicContact CD1-CE1 4.08Å; I202-Y206 HydrophobicContact CD1-CE2 4.36Å; I202-Y206 PolarHBondContact O-N 2.92Å; F203-Y206 PolarHBondContact O-N 3.08Å; F203-Y206 VanDerWaalsContact O-N 3.15Å; Y206-A208 VanDerWaalsContact C-N 3.34Å; Y206-A209 PolarHBondContact O-N 2.9Å; Y206-L210 WeakPolarHBondContact O-CB 3.48Å; Y206-L210 WeakPolarHBondContact O-CG 3.42Å; Y206-L210 PolarHBondContact O-N 3.35Å; Y206-L239 HydrophobicContact CD2-CD2 4.44Å
207	V	97	Very high	90.3	Very high	21 Å²	21	37.7 Å²	37.7	13%	0.127	20%	0.198	C	C	.	.	H	α-helix	trans	-60.6	-46.3	174.9	173.1	0	0	0	0	110.6	F203 D204 L210 K211 N246 V247 I250	F203-V207 WeakPolarHBondContact O-CG2 3.48Å; F203-V207 PolarHBondContact O-N 3.2Å; D204-V207 PolarHBondContact O-N 2.9Å; V207-L210 PolarHBondContact O-N 3.05Å; V207-K211 HydrophobicContact CG1-CD 4.29Å; V207-K211 WeakPolarHBondContact O-CB 3.32Å; V207-K211 WeakPolarHBondContact O-CG 3.34Å; V207-K211 PolarHBondContact O-N 3.25Å; V207-N246 HydrophobicContact CG2-CB 3.81Å; V207-V247 HydrophobicContact CG2-CG2 3.84Å; V207-I250 HydrophobicContact CG2-CG2 4.34Å
208	A	98	Very high	92.1	Very high	10 Å²	10	29.6 Å²	29.6	8%	0.083	16%	0.164	C	C	.	.	H	α-helix	trans	-63.9	-45.5	178.3	0	0	0	0	0	112.3	A159 I163 D204 L205 Y206 K211 A212	A159-A208 HydrophobicContact CB-CB 3.68Å; I163-A208 HydrophobicContact CD1-CB 4.24Å; I163-A208 WeakPolarHBondContact CD1-O 3.31Å; I163-A208 HydrophobicContact CG1-CB 4.09Å; D204-A208 WeakPolarHBondContact O-CB 3.37Å; D204-A208 PolarHBondContact O-N 2.86Å; L205-A208 PolarHBondContact O-N 3.49Å; Y206-A208 VanDerWaalsContact C-N 3.34Å; A208-K211 PolarHBondContact O-N 3.14Å; A208-A212 WeakPolarHBondContact O-CB 3.23Å; A208-A212 PolarHBondContact O-N 3.38Å
209	A	97.9	Very high	93.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.6	-39.5	178.5	0	0	0	0	0	112.3	F187 V190 F191 L205 Y206 A212 W213	F187-A209 HydrophobicContact CB-CB 4.44Å; V190-A209 HydrophobicContact CB-CB 3.93Å; V190-A209 HydrophobicContact CG1-CB 3.84Å; V190-A209 HydrophobicContact CG2-CB 4.47Å; F191-A209 HydrophobicContact CD1-CB 4.14Å; L205-A209 VanDerWaalsContact O-CB 3.3Å; L205-A209 WeakPolarHBondContact O-CB 3.47Å; L205-A209 PolarHBondContact O-N 3.5Å; Y206-A209 PolarHBondContact O-N 2.9Å; A209-A212 PolarHBondContact O-N 3.14Å; A209-W213 VanDerWaalsContact O-CB 3.26Å; A209-W213 WeakPolarHBondContact O-CB 3.21Å; A209-W213 PolarHBondContact O-N 2.86Å
210	L	97.7	Very high	94.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-68.5	-41.4	175	-74.9	167.6	0	0	0	112	F191 Y206 V207 A212 W213 T214 L236 L239 I250	F191-L210 HydrophobicContact CD1-CD2 3.75Å; F191-L210 HydrophobicContact CD1-CG 4.02Å; F191-L210 HydrophobicContact CD2-CD2 4.15Å; F191-L210 HydrophobicContact CE1-CD2 3.77Å; F191-L210 HydrophobicContact CE1-CG 4.41Å; F191-L210 HydrophobicContact CE2-CD2 4.17Å; F191-L210 HydrophobicContact CG-CD2 3.93Å; F191-L210 HydrophobicContact CG-CG 4.28Å; F191-L210 HydrophobicContact CZ-CD2 3.95Å; Y206-L210 WeakPolarHBondContact O-CB 3.48Å; Y206-L210 WeakPolarHBondContact O-CG 3.42Å; Y206-L210 PolarHBondContact O-N 3.35Å; V207-L210 PolarHBondContact O-N 3.05Å; L210-A212 VanDerWaalsContact C-N 3.34Å; L210-A212 PolarHBondContact O-N 3.39Å; L210-W213 PolarHBondContact O-N 2.94Å; L210-T214 WeakPolarHBondContact O-CB 3.29Å; L210-T214 PolarHBondContact O-N 3.17Å; L210-T214 PolarHBondContact O-OG1 3Å; L210-L236 HydrophobicContact CD2-CD2 3.79Å; L210-L239 HydrophobicContact CD1-CD1 4Å; L210-L239 HydrophobicContact CD2-CD1 4.04Å; L210-L239 HydrophobicContact CG-CD1 4.48Å; L210-I250 HydrophobicContact CB-CG1 3.75Å; L210-I250 HydrophobicContact CB-CG2 3.95Å; L210-I250 HydrophobicContact CD1-CG2 3.59Å; L210-I250 HydrophobicContact CG-CG2 4.45Å
211	K	98.5	Very high	95.4	Very high	41 Å²	41	24.8 Å²	24.8	18%	0.178	13%	0.131	C	C	.	.	H	α-helix	trans	-58.6	-47.1	172.1	-79.4	-178.7	172.5	-170	0	111.6	I163 V207 A208 T214 L215 I250 F338 F342 S345	I163-K211 HydrophobicContact CD1-CB 3.99Å; V207-K211 HydrophobicContact CG1-CD 4.29Å; V207-K211 WeakPolarHBondContact O-CB 3.32Å; V207-K211 WeakPolarHBondContact O-CG 3.34Å; V207-K211 PolarHBondContact O-N 3.25Å; A208-K211 PolarHBondContact O-N 3.14Å; K211-T214 PolarHBondContact O-N 3.44Å; K211-L215 WeakPolarHBondContact O-CB 3.38Å; K211-L215 PolarHBondContact O-N 2.86Å; K211-I250 HydrophobicContact CG-CD1 3.57Å; K211-I250 HydrophobicContact CG-CG1 3.92Å; K211-F338 WeakPolarHBondContact O-CZ 3.41Å; K211-F342 HydrophobicContact CB-CD2 4.04Å; K211-F342 HydrophobicContact CB-CE2 4.11Å; K211-S345 VanDerWaalsContact NZ-CB 3.25Å; K211-S345 PolarHBondContact NZ-OG 3.32Å
212	A	98.6	Very high	95.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.8	-44.3	178	0	0	0	0	0	111.8	A162 I163 A166 F187 A208 A209 L210 L215 I216	A162-A212 HydrophobicContact CB-CB 4.16Å; A162-A212 WeakPolarHBondContact O-CB 3.26Å; I163-A212 HydrophobicContact CD1-CB 4.47Å; A166-A212 HydrophobicContact CB-CB 3.65Å; F187-A212 HydrophobicContact CD1-CB 4.16Å; F187-A212 HydrophobicContact CD2-CB 3.75Å; F187-A212 HydrophobicContact CE1-CB 4.03Å; F187-A212 HydrophobicContact CE2-CB 3.55Å; F187-A212 HydrophobicContact CG-CB 4.04Å; F187-A212 HydrophobicContact CZ-CB 3.73Å; A208-A212 WeakPolarHBondContact O-CB 3.23Å; A208-A212 PolarHBondContact O-N 3.38Å; A209-A212 PolarHBondContact O-N 3.14Å; L210-A212 VanDerWaalsContact C-N 3.34Å; L210-A212 PolarHBondContact O-N 3.39Å; A212-L215 PolarHBondContact O-N 2.85Å; A212-I216 PolarHBondContact O-N 3.49Å
213	W	98.3	Very high	95.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.2	-50.1	174.9	-176.6	98.5	0	0	0	112	F187 E188 F191 A209 L210 L215 I216 Y217 V228 V232 I258	F187-W213 HydrophobicContact CB-CB 4.09Å; F187-W213 HydrophobicContact CD2-CB 4.29Å; E188-W213 VanDerWaalsContact CG-CD1 3.43Å; E188-W213 VanDerWaalsContact CG-NE1 3.29Å; E188-W213 PolarHBondContact OE1-NE1 3.3Å; F191-W213 HydrophobicContact CE1-CB 3.93Å; F191-W213 AromaticContact CE1-CD1 3.92Å; F191-W213 AromaticContact CE1-CG 3.96Å; F191-W213 HydrophobicContact CE1-CG 3.96Å; F191-W213 HydrophobicContact CZ-CB 4.39Å; F191-W213 AromaticContact CZ-CD1 3.71Å; F191-W213 HydrophobicContact CZ-CD2 4.46Å; F191-W213 AromaticContact CZ-CG 3.94Å; F191-W213 HydrophobicContact CZ-CG 3.94Å; A209-W213 VanDerWaalsContact O-CB 3.26Å; A209-W213 WeakPolarHBondContact O-CB 3.21Å; A209-W213 PolarHBondContact O-N 2.86Å; L210-W213 PolarHBondContact O-N 2.94Å; W213-L215 VanDerWaalsContact C-N 3.29Å; W213-L215 PolarHBondContact O-N 2.94Å; W213-I216 PolarHBondContact O-N 3.29Å; W213-Y217 HydrophobicContact CH2-CD1 4.42Å; W213-Y217 AromaticContact CH2-CD2 3.43Å; W213-Y217 HydrophobicContact CH2-CD2 3.43Å; W213-Y217 VanDerWaalsContact CH2-CD2 3.43Å; W213-Y217 HydrophobicContact CH2-CE2 4.04Å; W213-Y217 AromaticContact CH2-CG 3.66Å; W213-Y217 HydrophobicContact CH2-CG 3.66Å; W213-Y217 AromaticContact CZ2-CD2 3.98Å; W213-Y217 HydrophobicContact CZ2-CD2 3.98Å; W213-Y217 HydrophobicContact CZ2-CG 4.44Å; W213-Y217 HydrophobicContact CZ3-CD1 4.32Å; W213-Y217 HydrophobicContact CZ3-CD2 4.04Å; W213-Y217 AromaticContact CZ3-CG 3.76Å; W213-Y217 HydrophobicContact CZ3-CG 3.76Å; W213-Y217 VanDerWaalsContact O-CB 3.29Å; W213-Y217 WeakPolarHBondContact O-CB 3.37Å; W213-Y217 PolarHBondContact O-N 2.94Å; W213-V228 HydrophobicContact CZ2-CG1 3.73Å; W213-V232 HydrophobicContact CH2-CB 4.39Å; W213-V232 HydrophobicContact CH2-CG1 3.45Å; W213-V232 VanDerWaalsContact CH2-CG1 3.45Å; W213-V232 HydrophobicContact CZ2-CB 3.86Å; W213-V232 HydrophobicContact CZ2-CG1 3.42Å; W213-V232 VanDerWaalsContact CZ2-CG1 3.42Å; W213-V232 HydrophobicContact CZ2-CG2 4.15Å; W213-V232 HydrophobicContact CZ3-CG1 4.29Å; W213-I258 HydrophobicContact CH2-CD1 3.72Å; W213-I258 HydrophobicContact CH2-CG1 4.02Å; W213-I258 HydrophobicContact CZ3-CD1 3.98Å; W213-I258 HydrophobicContact CZ3-CG1 4.22Å
214	T	98.6	Very high	95.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.6	-36	-178.3	-55.8	0	0	0	0	111.2	L210 K211 Y217 T218 A254 V257 F338	L210-T214 WeakPolarHBondContact O-CB 3.29Å; L210-T214 PolarHBondContact O-N 3.17Å; L210-T214 PolarHBondContact O-OG1 3Å; K211-T214 PolarHBondContact O-N 3.44Å; T214-Y217 PolarHBondContact O-N 3.09Å; T214-T218 WeakPolarHBondContact O-CG2 3.48Å; T214-T218 PolarHBondContact O-N 3.38Å; T214-T218 VanDerWaalsContact O-N 3.15Å; T214-A254 HydrophobicContact CG2-CB 4.44Å; T214-A254 VanDerWaalsContact OG1-CB 3.26Å; T214-A254 WeakPolarHBondContact OG1-CB 2.95Å; T214-V257 HydrophobicContact CG2-CB 4.22Å; T214-V257 HydrophobicContact CG2-CG1 4.15Å; T214-V257 HydrophobicContact CG2-CG2 4.21Å; T214-F338 HydrophobicContact CG2-CD1 4Å; T214-F338 HydrophobicContact CG2-CD2 3.64Å; T214-F338 HydrophobicContact CG2-CE1 3.87Å; T214-F338 HydrophobicContact CG2-CE2 3.48Å; T214-F338 VanDerWaalsContact CG2-CE2 3.48Å; T214-F338 HydrophobicContact CG2-CG 3.91Å; T214-F338 HydrophobicContact CG2-CZ 3.62Å
215	L	98	Very high	95.7	Very high	6 Å²	6	25.8 Å²	25.8	3%	0.031	13%	0.129	C	C	.	.	H	α-helix	trans	-61.7	-52.2	175	-178.1	66.6	0	0	0	111.6	A166 V167 K211 A212 W213 Y217 T218 F219 F338 Y339 F342	A166-L215 HydrophobicContact CB-CD2 4.11Å; V167-L215 HydrophobicContact CG2-CD2 4.23Å; K211-L215 WeakPolarHBondContact O-CB 3.38Å; K211-L215 PolarHBondContact O-N 2.86Å; A212-L215 PolarHBondContact O-N 2.85Å; W213-L215 VanDerWaalsContact C-N 3.29Å; W213-L215 PolarHBondContact O-N 2.94Å; L215-Y217 VanDerWaalsContact C-N 3.27Å; L215-Y217 PolarHBondContact O-N 3.3Å; L215-T218 PolarHBondContact O-N 2.87Å; L215-T218 PolarHBondContact O-OG1 3.04Å; L215-F219 HydrophobicContact CD1-CE2 3.83Å; L215-F219 HydrophobicContact CG-CE2 4.35Å; L215-F219 WeakPolarHBondContact O-CD2 3.24Å; L215-F338 HydrophobicContact CB-CE1 4.06Å; L215-F338 HydrophobicContact CB-CZ 4.1Å; L215-F338 HydrophobicContact CD1-CE1 4.22Å; L215-Y339 HydrophobicContact CD1-CD1 4.19Å; L215-Y339 HydrophobicContact CD1-CE1 4.04Å; L215-F342 HydrophobicContact CB-CD2 4.44Å; L215-F342 HydrophobicContact CB-CE2 4.21Å; L215-F342 HydrophobicContact CD2-CD1 4.35Å; L215-F342 HydrophobicContact CD2-CE1 3.73Å; L215-F342 HydrophobicContact CD2-CE2 3.93Å; L215-F342 HydrophobicContact CD2-CZ 3.5Å; L215-F342 VanDerWaalsContact CD2-CZ 3.5Å
216	I	96.9	Very high	95.6	Very high	3 Å²	3	25.8 Å²	25.8	2%	0.015	13%	0.129	C	C	.	.	H	α-helix	trans	-66.1	-36.9	178.8	-56.9	177.9	0	0	0	110.5	A166 Q169 P180 V183 I184 F187 A212 W213 T218 F219 L220	A166-I216 HydrophobicContact CB-CD1 4.41Å; A166-I216 HydrophobicContact CB-CG1 4.21Å; Q169-I216 HydrophobicContact CB-CD1 4.05Å; Q169-I216 HydrophobicContact CB-CG1 4.38Å; Q169-I216 HydrophobicContact CG-CD1 3.8Å; Q169-I216 HydrophobicContact CG-CG1 4.09Å; Q169-I216 HydrophobicContact CG-CG2 4.16Å; P180-I216 HydrophobicContact CB-CG2 3.93Å; V183-I216 HydrophobicContact CB-CD1 3.77Å; V183-I216 HydrophobicContact CG1-CD1 3.39Å; I184-I216 HydrophobicContact CD1-CB 3.81Å; I184-I216 HydrophobicContact CD1-CG2 3.55Å; I184-I216 HydrophobicContact CG1-CB 3.69Å; I184-I216 HydrophobicContact CG1-CD1 4.27Å; I184-I216 HydrophobicContact CG1-CG2 3.66Å; F187-I216 HydrophobicContact CD2-CD1 4.3Å; F187-I216 HydrophobicContact CE2-CD1 3.46Å; F187-I216 VanDerWaalsContact CE2-CD1 3.46Å; F187-I216 HydrophobicContact CE2-CG1 4.32Å; F187-I216 HydrophobicContact CZ-CD1 4.26Å; A212-I216 PolarHBondContact O-N 3.49Å; W213-I216 PolarHBondContact O-N 3.29Å; I216-T218 PolarHBondContact O-N 2.74Å; I216-F219 PolarHBondContact O-N 3.18Å; I216-L220 HydrophobicContact CG2-CD2 4.42Å; I216-L220 PolarHBondContact O-N 2.87Å
217	Y	97.6	Very high	95.5	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-55	-35.2	178.1	175.1	-93.4	0	0	0	112.2	W213 T214 L215 F219 L220 S225 V228 V257 I258 R261	W213-Y217 HydrophobicContact CH2-CD1 4.42Å; W213-Y217 AromaticContact CH2-CD2 3.43Å; W213-Y217 HydrophobicContact CH2-CD2 3.43Å; W213-Y217 VanDerWaalsContact CH2-CD2 3.43Å; W213-Y217 HydrophobicContact CH2-CE2 4.04Å; W213-Y217 AromaticContact CH2-CG 3.66Å; W213-Y217 HydrophobicContact CH2-CG 3.66Å; W213-Y217 AromaticContact CZ2-CD2 3.98Å; W213-Y217 HydrophobicContact CZ2-CD2 3.98Å; W213-Y217 HydrophobicContact CZ2-CG 4.44Å; W213-Y217 HydrophobicContact CZ3-CD1 4.32Å; W213-Y217 HydrophobicContact CZ3-CD2 4.04Å; W213-Y217 AromaticContact CZ3-CG 3.76Å; W213-Y217 HydrophobicContact CZ3-CG 3.76Å; W213-Y217 VanDerWaalsContact O-CB 3.29Å; W213-Y217 WeakPolarHBondContact O-CB 3.37Å; W213-Y217 PolarHBondContact O-N 2.94Å; T214-Y217 PolarHBondContact O-N 3.09Å; L215-Y217 VanDerWaalsContact C-N 3.27Å; L215-Y217 PolarHBondContact O-N 3.3Å; Y217-F219 VanDerWaalsContact C-N 3.26Å; Y217-F219 PolarHBondContact O-N 3.5Å; Y217-L220 HydrophobicContact CD2-CD1 4.09Å; Y217-L220 PolarHBondContact O-N 3.45Å; Y217-S225 WeakPolarHBondContact CE2-O 3.35Å; Y217-S225 PolarHBondContact OH-O 2.76Å; Y217-V228 HydrophobicContact CD2-CG1 4.17Å; Y217-V257 HydrophobicContact CD1-CG1 3.97Å; Y217-V257 HydrophobicContact CE1-CG1 4.09Å; Y217-I258 HydrophobicContact CD1-CG1 4.37Å; Y217-I258 HydrophobicContact CE1-CB 4.37Å; Y217-I258 HydrophobicContact CE1-CG1 3.8Å; Y217-I258 HydrophobicContact CE2-CG1 4.19Å; Y217-R261 HydrophobicContact CE1-CB 4.15Å; Y217-R261 PolarHBondContact O-NH1 2.95Å
218	T	96.2	Very high	95.5	Very high	12 Å²	12	29.3 Å²	29.3	7%	0.074	15%	0.149	C	C	.	.	H	α-helix	trans	-72.4	-18.7	-179.1	66.9	0	0	0	0	113.2	T214 L215 I216 V257 R261 T335 F338 Y339	T214-T218 WeakPolarHBondContact O-CG2 3.48Å; T214-T218 PolarHBondContact O-N 3.38Å; T214-T218 VanDerWaalsContact O-N 3.15Å; L215-T218 PolarHBondContact O-N 2.87Å; L215-T218 PolarHBondContact O-OG1 3.04Å; I216-T218 PolarHBondContact O-N 2.74Å; T218-V257 HydrophobicContact CG2-CG1 3.73Å; T218-R261 VanDerWaalsContact O-CZ 3.32Å; T218-R261 PolarHBondContact O-NH1 3.41Å; T218-T335 HydrophobicContact CG2-CG2 4.08Å; T218-F338 HydrophobicContact CG2-CD1 4.3Å; T218-F338 HydrophobicContact CG2-CE1 4.49Å; T218-Y339 WeakPolarHBondContact CB-OH 3.39Å; T218-Y339 HydrophobicContact CG2-CE1 3.97Å; T218-Y339 VanDerWaalsContact OG1-CE1 3.23Å; T218-Y339 WeakPolarHBondContact OG1-CE1 3.29Å; T218-Y339 PolarHBondContact OG1-OH 2.8Å
219	F	93.3	Very high	95.3	Very high	91 Å²	91	28.9 Å²	28.9	40%	0.399	15%	0.145	S	C	.	.	H	α-helix	trans	-100.5	-4.5	178.3	-65.7	-80.5	0	0	0	114.5	L215 I216 Y217 Y339 L364	L215-F219 HydrophobicContact CD1-CE2 3.83Å; L215-F219 HydrophobicContact CG-CE2 4.35Å; L215-F219 WeakPolarHBondContact O-CD2 3.24Å; I216-F219 PolarHBondContact O-N 3.18Å; Y217-F219 VanDerWaalsContact C-N 3.26Å; Y217-F219 PolarHBondContact O-N 3.5Å; F219-Y339 HydrophobicContact CE2-CE1 4.33Å; F219-L364 HydrophobicContact CE1-CD1 4.47Å; F219-L364 HydrophobicContact CZ-CD1 3.79Å
220	L	94.2	Very high	95.2	Very high	10 Å²	10	32.7 Å²	32.7	5%	0.052	16%	0.162	C	C	.	.	S	Bend	trans	-59.4	163.8	176	-68	-177.4	0	0	0	112.3	P180 L181 I184 I216 Y217 D224 V228 R261	P180-L220 HydrophobicContact CB-CD2 3.89Å; L181-L220 HydrophobicContact CD2-CD1 4.17Å; L181-L220 HydrophobicContact CD2-CD2 3.89Å; I184-L220 HydrophobicContact CD1-CD1 3.68Å; I184-L220 HydrophobicContact CD1-CD2 3.99Å; I184-L220 HydrophobicContact CD1-CG 4Å; I216-L220 HydrophobicContact CG2-CD2 4.42Å; I216-L220 PolarHBondContact O-N 2.87Å; Y217-L220 HydrophobicContact CD2-CD1 4.09Å; Y217-L220 PolarHBondContact O-N 3.45Å; L220-D224 HydrophobicContact CB-CB 4.15Å; L220-D224 HydrophobicContact CD1-CB 4.29Å; L220-V228 HydrophobicContact CD1-CB 4.12Å; L220-V228 HydrophobicContact CD1-CG1 4.12Å; L220-V228 HydrophobicContact CD1-CG2 4.1Å; L220-R261 VanDerWaalsContact N-NH1 3.16Å; L220-R261 PolarHBondContact O-NH1 2.87Å; L220-R261 PolarHBondContact O-NH2 3.03Å
221	S	92.3	Very high	95.1	Very high	48 Å²	48	35.4 Å²	35.4	34%	0.336	18%	0.184	S	C	.	.			trans	-66.4	156.5	169	76.8	0	0	0	0	111.2	Y223 D224 S225	S221-Y223 PolarHBondContact O-N 3.01Å; S221-Y223 PolarHBondContact OG-N 2.68Å; S221-D224 PolarHBondContact O-N 3.21Å; S221-D224 VanDerWaalsContact O-N 3.14Å; S221-D224 VanDerWaalsContact OG-CG 3.26Å; S221-D224 PolarHBondContact OG-N 3.43Å; S221-D224 VanDerWaalsContact OG-N 3.13Å; S221-D224 PolarHBondContact OG-OD2 3.38Å; S221-S225 WeakPolarHBondContact O-CB 3.3Å; S221-S225 PolarHBondContact O-N 3.18Å; S221-S225 PolarHBondContact O-OG 2.78Å
222	P	90.9	Very high	95	Very high	64 Å²	64	33.4 Å²	33.4	42%	0.416	18%	0.176	S	C	.	.	H	α-helix	trans	-55.4	-32.5	172.4	-29.1	36.5	0	0	0	113.9	S225 G226 E265 V266	P222-S225 WeakPolarHBondContact CA-OG 3.45Å; P222-S225 PolarHBondContact O-OG 3.3Å; P222-G226 PolarHBondContact O-N 3.07Å; P222-E265 HydrophobicContact CB-CB 4.13Å; P222-E265 HydrophobicContact CG-CB 4.41Å; P222-V266 HydrophobicContact CB-CG2 4.48Å; P222-V266 VanDerWaalsContact O-CG2 3.29Å; P222-V266 WeakPolarHBondContact O-CG2 3.3Å
223	Y	90.2	Very high	94.9	Very high	177 Å²	177	33.5 Å²	33.5	69%	0.694	18%	0.176	S	C	*	.	H	α-helix	trans	-65.9	-47.5	176.4	177.4	-95.2	0	0	0	111.5	S221 N227	S221-Y223 PolarHBondContact O-N 3.01Å; S221-Y223 PolarHBondContact OG-N 2.68Å; Y223-N227 PolarHBondContact O-ND2 2.78Å
224	D	93.3	Very high	94.7	Very high	44 Å²	44	35.6 Å²	35.6	24%	0.235	19%	0.19	C	C	.	.	H	α-helix	trans	-72	-39.1	-179.2	-64	-48.2	0	0	0	111.8	L181 L220 S221 G226 N227 V228	L181-D224 HydrophobicContact CD2-CB 4.23Å; L220-D224 HydrophobicContact CB-CB 4.15Å; L220-D224 HydrophobicContact CD1-CB 4.29Å; S221-D224 PolarHBondContact O-N 3.21Å; S221-D224 VanDerWaalsContact O-N 3.14Å; S221-D224 VanDerWaalsContact OG-CG 3.26Å; S221-D224 PolarHBondContact OG-N 3.43Å; S221-D224 VanDerWaalsContact OG-N 3.13Å; S221-D224 PolarHBondContact OG-OD2 3.38Å; D224-G226 VanDerWaalsContact C-N 3.3Å; D224-G226 PolarHBondContact O-N 3.18Å; D224-N227 PolarHBondContact O-N 3.3Å; D224-N227 VanDerWaalsContact O-N 3.11Å; D224-V228 VanDerWaalsContact O-CB 3.3Å; D224-V228 WeakPolarHBondContact O-CB 3.3Å; D224-V228 VanDerWaalsContact O-CG2 3.31Å; D224-V228 WeakPolarHBondContact O-CG2 3.3Å; D224-V228 PolarHBondContact O-N 3.49Å
225	S	91.7	Very high	94.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.2	-43.5	-179.1	72.9	0	0	0	0	111.2	Y217 S221 P222 N227 G229	Y217-S225 WeakPolarHBondContact CE2-O 3.35Å; Y217-S225 PolarHBondContact OH-O 2.76Å; S221-S225 WeakPolarHBondContact O-CB 3.3Å; S221-S225 PolarHBondContact O-N 3.18Å; S221-S225 PolarHBondContact O-OG 2.78Å; P222-S225 WeakPolarHBondContact CA-OG 3.45Å; P222-S225 PolarHBondContact O-OG 3.3Å; S225-N227 PolarHBondContact O-N 2.95Å; S225-G229 WeakPolarHBondContact O-CA 3.42Å; S225-G229 PolarHBondContact O-N 3.1Å
226	G	92.2	Very high	94.5	Very high	3 Å²	3	36.4 Å²	36.4	3%	0.031	20%	0.195	C	C	.	.	H	α-helix	trans	-58.6	-43.4	175.1	0	0	0	0	0	113.5	P222 D224 K230	P222-G226 PolarHBondContact O-N 3.07Å; D224-G226 VanDerWaalsContact C-N 3.3Å; D224-G226 PolarHBondContact O-N 3.18Å; G226-K230 WeakPolarHBondContact O-CB 3.41Å; G226-K230 WeakPolarHBondContact O-CD 3.3Å; G226-K230 WeakPolarHBondContact O-CE 3.43Å; G226-K230 WeakPolarHBondContact O-CG 3.44Å; G226-K230 PolarHBondContact O-N 2.83Å
227	N	94.4	Very high	94.4	Very high	84 Å²	84	37 Å²	37	45%	0.449	20%	0.198	S	C	.	.	H	α-helix	trans	-77.8	-50.3	-177.5	-69.9	-35.7	0	0	0	112.1	Y223 D224 S225 A231	Y223-N227 PolarHBondContact O-ND2 2.78Å; D224-N227 PolarHBondContact O-N 3.3Å; D224-N227 VanDerWaalsContact O-N 3.11Å; S225-N227 PolarHBondContact O-N 2.95Å; N227-A231 WeakPolarHBondContact O-CB 2.97Å; N227-A231 PolarHBondContact O-N 3.39Å; N227-A231 VanDerWaalsContact O-N 3.07Å
228	V	95.9	Very high	94.3	Very high	23 Å²	23	40.2 Å²	40.2	14%	0.139	22%	0.221	C	C	.	.	H	α-helix	trans	-64.1	-45.6	-178.2	172.9	0	0	0	0	110.7	L181 I184 W213 Y217 L220 D224 A231 V232	L181-V228 HydrophobicContact CD2-CG2 3.78Å; I184-V228 HydrophobicContact CG2-CG1 4.29Å; W213-V228 HydrophobicContact CZ2-CG1 3.73Å; Y217-V228 HydrophobicContact CD2-CG1 4.17Å; L220-V228 HydrophobicContact CD1-CB 4.12Å; L220-V228 HydrophobicContact CD1-CG1 4.12Å; L220-V228 HydrophobicContact CD1-CG2 4.1Å; D224-V228 VanDerWaalsContact O-CB 3.3Å; D224-V228 WeakPolarHBondContact O-CB 3.3Å; D224-V228 VanDerWaalsContact O-CG2 3.31Å; D224-V228 WeakPolarHBondContact O-CG2 3.3Å; D224-V228 PolarHBondContact O-N 3.49Å; V228-A231 PolarHBondContact O-N 3.44Å; V228-V232 PolarHBondContact O-N 3.41Å; V228-V232 VanDerWaalsContact O-N 3.17Å
229	G	95.6	Very high	94.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.8	-49.1	178.7	0	0	0	0	0	111.9	S225 A231 V232 L233	S225-G229 WeakPolarHBondContact O-CA 3.42Å; S225-G229 PolarHBondContact O-N 3.1Å; G229-A231 VanDerWaalsContact C-N 3.29Å; G229-A231 PolarHBondContact O-N 3.18Å; G229-V232 WeakPolarHBondContact O-CG1 3.45Å; G229-V232 PolarHBondContact O-N 3.31Å; G229-L233 WeakPolarHBondContact O-CG 3.27Å; G229-L233 PolarHBondContact O-N 3.48Å
230	K	95.1	Very high	94.3	Very high	80 Å²	80	35.4 Å²	35.4	35%	0.348	20%	0.199	S	C	.	.	H	α-helix	trans	-60.1	-38.9	177.3	-71.9	171.4	-161	175.4	0	112.5	G226 I262 F270	G226-K230 WeakPolarHBondContact O-CB 3.41Å; G226-K230 WeakPolarHBondContact O-CD 3.3Å; G226-K230 WeakPolarHBondContact O-CE 3.43Å; G226-K230 WeakPolarHBondContact O-CG 3.44Å; G226-K230 PolarHBondContact O-N 2.83Å; K230-I262 HydrophobicContact CG-CD1 4.13Å; K230-F270 HydrophobicContact CD-CE2 4.04Å; K230-F270 HydrophobicContact CD-CZ 4.2Å; K230-F270 VanDerWaalsContact CE-CE2 3.46Å; K230-F270 HydrophobicContact CG-CE2 4.11Å; K230-F270 HydrophobicContact CG-CZ 3.73Å
231	A	95.5	Very high	94.3	Very high	57 Å²	57	41.1 Å²	41.1	47%	0.471	23%	0.225	S	C	.	.	H	α-helix	trans	-70.5	-30.9	-176.8	0	0	0	0	0	113.5	N227 V228 G229	N227-A231 WeakPolarHBondContact O-CB 2.97Å; N227-A231 PolarHBondContact O-N 3.39Å; N227-A231 VanDerWaalsContact O-N 3.07Å; V228-A231 PolarHBondContact O-N 3.44Å; G229-A231 VanDerWaalsContact C-N 3.29Å; G229-A231 PolarHBondContact O-N 3.18Å
232	V	95.9	Very high	94.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-85.5	-21.3	-178.3	80.5	0	0	0	0	113.4	F191 W213 V228 G229 P234 V235 L236 I258	F191-V232 HydrophobicContact CE2-CG2 3.8Å; F191-V232 HydrophobicContact CZ-CG2 4.06Å; W213-V232 HydrophobicContact CH2-CB 4.39Å; W213-V232 HydrophobicContact CH2-CG1 3.45Å; W213-V232 VanDerWaalsContact CH2-CG1 3.45Å; W213-V232 HydrophobicContact CZ2-CB 3.86Å; W213-V232 HydrophobicContact CZ2-CG1 3.42Å; W213-V232 VanDerWaalsContact CZ2-CG1 3.42Å; W213-V232 HydrophobicContact CZ2-CG2 4.15Å; W213-V232 HydrophobicContact CZ3-CG1 4.29Å; V228-V232 PolarHBondContact O-N 3.41Å; V228-V232 VanDerWaalsContact O-N 3.17Å; G229-V232 WeakPolarHBondContact O-CG1 3.45Å; G229-V232 PolarHBondContact O-N 3.31Å; V232-P234 VanDerWaalsContact C-CD 3.44Å; V232-V235 HydrophobicContact CG2-CB 4.43Å; V232-V235 WeakPolarHBondContact O-CA 3.41Å; V232-V235 VanDerWaalsContact O-CB 3.31Å; V232-V235 WeakPolarHBondContact O-CB 3.28Å; V232-V235 PolarHBondContact O-N 3.18Å; V232-L236 HydrophobicContact CG1-CD1 3.92Å; V232-L236 HydrophobicContact CG1-CG 4.22Å; V232-L236 HydrophobicContact CG2-CG 4.42Å; V232-L236 PolarHBondContact O-N 3.04Å; V232-L236 VanDerWaalsContact O-N 3.15Å; V232-I258 HydrophobicContact CG1-CD1 3.56Å
233	L	96.1	Very high	94.1	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-47.3	-48.4	-175.5	-78.8	171.5	0	0	0	114.2	G229 V235 L236 L237 I258 Y259 Y274	G229-L233 WeakPolarHBondContact O-CG 3.27Å; G229-L233 PolarHBondContact O-N 3.48Å; L233-V235 PolarHBondContact O-N 3.44Å; L233-V235 VanDerWaalsContact O-N 3.14Å; L233-L236 WeakPolarHBondContact O-CA 3.34Å; L233-L236 WeakPolarHBondContact O-CB 3.48Å; L233-L236 PolarHBondContact O-N 3.5Å; L233-L237 HydrophobicContact CB-CD1 4.34Å; L233-L237 WeakPolarHBondContact O-CD1 3.46Å; L233-L237 PolarHBondContact O-N 3.21Å; L233-I258 HydrophobicContact CD2-CD1 4.38Å; L233-I258 HydrophobicContact CD2-CG2 4.43Å; L233-Y259 HydrophobicContact CD1-CE2 4.21Å; L233-Y259 HydrophobicContact CD2-CE2 3.9Å; L233-Y274 HydrophobicContact CB-CD2 3.93Å; L233-Y274 HydrophobicContact CD1-CD2 4.48Å
234	P	95.4	Very high	94.2	Very high	44 Å²	44	33.7 Å²	33.7	29%	0.286	20%	0.198	S	C	.	.	H	α-helix	trans	-55.4	-35.7	178.8	-25.1	33.9	0	0	0	114	V232 S238 Y274	V232-P234 VanDerWaalsContact C-CD 3.44Å; P234-S238 PolarHBondContact O-N 3.03Å; P234-S238 PolarHBondContact O-OG 3.06Å; P234-S238 VanDerWaalsContact O-OG 3.07Å; P234-Y274 HydrophobicContact CG-CD2 4.16Å; P234-Y274 HydrophobicContact CG-CE1 4.1Å; P234-Y274 HydrophobicContact CG-CE2 3.48Å; P234-Y274 VanDerWaalsContact CG-CE2 3.48Å; P234-Y274 VanDerWaalsContact CG-CZ 3.45Å
235	V	95	Very high	94.3	Very high	23 Å²	23	32 Å²	32	14%	0.139	19%	0.189	C	C	.	.	H	α-helix	trans	-70.8	-44.1	178.6	-175.6	0	0	0	0	109.3	F191 R192 V232 L233 L237 S238 L239	F191-V235 HydrophobicContact CD2-CG1 3.74Å; F191-V235 HydrophobicContact CE2-CG1 4.01Å; R192-V235 HydrophobicContact CG-CG1 4.1Å; R192-V235 HydrophobicContact CG-CG2 4Å; V232-V235 HydrophobicContact CG2-CB 4.43Å; V232-V235 WeakPolarHBondContact O-CA 3.41Å; V232-V235 VanDerWaalsContact O-CB 3.31Å; V232-V235 WeakPolarHBondContact O-CB 3.28Å; V232-V235 PolarHBondContact O-N 3.18Å; L233-V235 PolarHBondContact O-N 3.44Å; L233-V235 VanDerWaalsContact O-N 3.14Å; V235-L237 VanDerWaalsContact C-N 3.34Å; V235-L237 PolarHBondContact O-N 3.49Å; V235-S238 WeakPolarHBondContact O-CB 3.27Å; V235-S238 PolarHBondContact O-N 3.4Å; V235-S238 VanDerWaalsContact O-N 3.08Å; V235-L239 HydrophobicContact CG1-CD1 4.02Å; V235-L239 HydrophobicContact CG1-CG 4.49Å; V235-L239 WeakPolarHBondContact O-CG 3.45Å; V235-L239 PolarHBondContact O-N 3.16Å
236	L	96.4	Very high	94.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.7	-40.8	175.2	-61.3	-177.4	0	0	0	112.3	L210 V232 L233 S238 L239 L240 A251 A254 I258	L210-L236 HydrophobicContact CD2-CD2 3.79Å; V232-L236 HydrophobicContact CG1-CD1 3.92Å; V232-L236 HydrophobicContact CG1-CG 4.22Å; V232-L236 HydrophobicContact CG2-CG 4.42Å; V232-L236 PolarHBondContact O-N 3.04Å; V232-L236 VanDerWaalsContact O-N 3.15Å; L233-L236 WeakPolarHBondContact O-CA 3.34Å; L233-L236 WeakPolarHBondContact O-CB 3.48Å; L233-L236 PolarHBondContact O-N 3.5Å; L236-S238 PolarHBondContact O-N 3.1Å; L236-L239 HydrophobicContact CD2-CD1 4.41Å; L236-L239 PolarHBondContact O-N 3.31Å; L236-L239 VanDerWaalsContact O-N 3.12Å; L236-L240 WeakPolarHBondContact O-CG 3.23Å; L236-L240 PolarHBondContact O-N 3.25Å; L236-A251 HydrophobicContact CD2-CB 4.39Å; L236-A254 HydrophobicContact CD1-CB 4.08Å; L236-A254 HydrophobicContact CD2-CB 4.31Å; L236-I258 HydrophobicContact CD1-CD1 3.51Å
237	L	96	Very high	94.6	Very high	14 Å²	14	34.7 Å²	34.7	7%	0.073	20%	0.203	C	C	.	.	H	α-helix	trans	-59.7	-35.3	174.1	-85.6	77.7	0	0	0	112.4	L233 V235 Q241 Y274 D277 L278 L281	L233-L237 HydrophobicContact CB-CD1 4.34Å; L233-L237 WeakPolarHBondContact O-CD1 3.46Å; L233-L237 PolarHBondContact O-N 3.21Å; V235-L237 VanDerWaalsContact C-N 3.34Å; V235-L237 PolarHBondContact O-N 3.49Å; L237-Q241 PolarHBondContact O-NE2 3.22Å; L237-Y274 HydrophobicContact CD2-CD1 4.38Å; L237-Y274 HydrophobicContact CD2-CG 4.5Å; L237-D277 HydrophobicContact CD2-CB 3.54Å; L237-L278 HydrophobicContact CD1-CB 4.5Å; L237-L281 HydrophobicContact CB-CD1 4.23Å; L237-L281 HydrophobicContact CG-CD1 4.2Å
238	S	94.2	Very high	94.7	Very high	69 Å²	69	31.1 Å²	31.1	48%	0.483	18%	0.183	S	C	.	.	H	α-helix	trans	-72.1	-40.2	174.8	-56.9	0	0	0	0	111.3	P234 V235 L236 L240 Q241	P234-S238 PolarHBondContact O-N 3.03Å; P234-S238 PolarHBondContact O-OG 3.06Å; P234-S238 VanDerWaalsContact O-OG 3.07Å; V235-S238 WeakPolarHBondContact O-CB 3.27Å; V235-S238 PolarHBondContact O-N 3.4Å; V235-S238 VanDerWaalsContact O-N 3.08Å; L236-S238 PolarHBondContact O-N 3.1Å; S238-L240 VanDerWaalsContact C-N 3.35Å; S238-L240 PolarHBondContact O-N 3.18Å; S238-Q241 PolarHBondContact O-N 3.19Å; S238-Q241 VanDerWaalsContact O-N 3.1Å
239	L	94.5	Very high	94.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69.3	-30.6	178.8	-66.3	169.7	0	0	0	112.9	F191 Y206 L210 V235 L236 Q241 C242 V247 A251	F191-L239 HydrophobicContact CB-CD1 4.15Å; F191-L239 HydrophobicContact CD2-CD1 3.98Å; F191-L239 HydrophobicContact CG-CD1 4.32Å; Y206-L239 HydrophobicContact CD2-CD2 4.44Å; L210-L239 HydrophobicContact CD1-CD1 4Å; L210-L239 HydrophobicContact CD2-CD1 4.04Å; L210-L239 HydrophobicContact CG-CD1 4.48Å; V235-L239 HydrophobicContact CG1-CD1 4.02Å; V235-L239 HydrophobicContact CG1-CG 4.49Å; V235-L239 WeakPolarHBondContact O-CG 3.45Å; V235-L239 PolarHBondContact O-N 3.16Å; L236-L239 HydrophobicContact CD2-CD1 4.41Å; L236-L239 PolarHBondContact O-N 3.31Å; L236-L239 VanDerWaalsContact O-N 3.12Å; L239-Q241 PolarHBondContact O-N 2.94Å; L239-Q241 VanDerWaalsContact O-N 3.15Å; L239-C242 VanDerWaalsContact O-CB 3.22Å; L239-C242 WeakPolarHBondContact O-CB 3.22Å; L239-C242 PolarHBondContact O-N 3.26Å; L239-C242 PolarHBondContact O-SG 3.37Å; L239-V247 HydrophobicContact CB-CG1 4.3Å; L239-V247 HydrophobicContact CD2-CG1 4.21Å; L239-A251 HydrophobicContact CB-CB 3.89Å
240	L	95.8	Very high	94.9	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.01	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-19.2	169.9	-76	173.4	0	0	0	113.4	L236 S238 R248 A251 L278 L281 L282 L285 F305	L236-L240 WeakPolarHBondContact O-CG 3.23Å; L236-L240 PolarHBondContact O-N 3.25Å; S238-L240 VanDerWaalsContact C-N 3.35Å; S238-L240 PolarHBondContact O-N 3.18Å; L240-R248 WeakPolarHBondContact CD2-O 3.4Å; L240-R248 WeakPolarHBondContact O-CD 3.44Å; L240-R248 VanDerWaalsContact O-CG 3.28Å; L240-R248 WeakPolarHBondContact O-CG 3.17Å; L240-A251 HydrophobicContact CD2-CB 4.18Å; L240-A251 HydrophobicContact CG-CB 4.23Å; L240-L278 HydrophobicContact CD1-CD1 3.56Å; L240-L281 HydrophobicContact CB-CD1 4.44Å; L240-L281 HydrophobicContact CD1-CB 4.36Å; L240-L281 HydrophobicContact CD1-CD1 4.47Å; L240-L282 HydrophobicContact CD1-CD2 4.15Å; L240-L282 HydrophobicContact CD2-CD2 4.21Å; L240-L285 HydrophobicContact CB-CD1 4.34Å; L240-L285 HydrophobicContact CD2-CD1 3.95Å; L240-F305 HydrophobicContact CD2-CE1 3.61Å; L240-F305 HydrophobicContact CD2-CZ 3.75Å
241	Q	93.2	Very high	95	Very high	129 Å²	129	26.9 Å²	26.9	60%	0.603	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-0.1	177.7	-63.7	171.2	74.9	0	0	112.9	L237 S238 L239 L281	L237-Q241 PolarHBondContact O-NE2 3.22Å; S238-Q241 PolarHBondContact O-N 3.19Å; S238-Q241 VanDerWaalsContact O-N 3.1Å; L239-Q241 PolarHBondContact O-N 2.94Å; L239-Q241 VanDerWaalsContact O-N 3.15Å; Q241-L281 HydrophobicContact CG-CD2 3.81Å
242	C	90.4	Very high	95.1	Very high	12 Å²	12	24.2 Å²	24.2	8%	0.081	14%	0.141	C	C	.	.	S	Bend	trans	-60.3	153.8	175.2	-75	0	0	0	0	111.5	I198 L239 N244 V247 R248	I198-C242 HydrophobicContact CD1-CB 4.43Å; I198-C242 WeakPolarHBondContact CD1-SG 3.49Å; L239-C242 VanDerWaalsContact O-CB 3.22Å; L239-C242 WeakPolarHBondContact O-CB 3.22Å; L239-C242 PolarHBondContact O-N 3.26Å; L239-C242 PolarHBondContact O-SG 3.37Å; C242-N244 PolarHBondContact O-N 3.46Å; C242-V247 HydrophobicContact CB-CB 4.42Å; C242-V247 HydrophobicContact CB-CG1 3.97Å; C242-R248 VanDerWaalsContact O-CD 3.32Å; C242-R248 WeakPolarHBondContact O-CD 3.46Å; C242-R248 WeakPolarHBondContact O-CG 3.49Å; C242-R248 PolarHBondContact O-NH1 3.46Å
243	S	89.7	Confident	95.2	Very high	88 Å²	88	25.4 Å²	25.4	62%	0.615	15%	0.147	S	C	*	.	S	Bend	trans	-70.5	-29.9	179.9	56.8	0	0	0	0	113.5	F203 R248	F203-S243 WeakPolarHBondContact CZ-OG 3.3Å; S243-R248 PolarHBondContact O-NH1 3.26Å
244	N	92.1	Very high	95.3	Very high	34 Å²	34	25.3 Å²	25.3	18%	0.182	15%	0.146	C	C	.	.			trans	-76.9	130	-178.9	-174.7	-73.4	0	0	0	112.7	F203 C242 N246 V247 R248	F203-N244 HydrophobicContact CB-CB 4.16Å; F203-N244 WeakPolarHBondContact CB-ND2 3.25Å; F203-N244 HydrophobicContact CD1-CB 3.53Å; F203-N244 HydrophobicContact CD2-CB 3.7Å; F203-N244 WeakPolarHBondContact CD2-ND2 3.28Å; F203-N244 HydrophobicContact CE1-CB 3.71Å; F203-N244 HydrophobicContact CE2-CB 3.86Å; F203-N244 HydrophobicContact CG-CB 3.54Å; F203-N244 WeakPolarHBondContact CG-ND2 3.47Å; F203-N244 HydrophobicContact CZ-CB 3.89Å; C242-N244 PolarHBondContact O-N 3.46Å; N244-N246 WeakPolarHBondContact OD1-CA 3.18Å; N244-N246 WeakPolarHBondContact OD1-CB 3.43Å; N244-N246 PolarHBondContact OD1-N 3.1Å; N244-V247 HydrophobicContact CB-CB 4.21Å; N244-V247 HydrophobicContact CB-CG2 3.96Å; N244-V247 PolarHBondContact OD1-N 2.94Å; N244-R248 WeakPolarHBondContact O-CG 3.35Å; N244-R248 PolarHBondContact O-N 3.24Å
245	V	94.4	Very high	95.5	Very high	9 Å²	9	23.2 Å²	23.2	6%	0.055	13%	0.133	C	C	.	.	H	α-helix	trans	-69	-40.6	-175.6	176.1	0	0	0	0	112.1	R248 I249 D297 Q301	V245-R248 PolarHBondContact O-N 3.26Å; V245-I249 HydrophobicContact CG1-CD1 3.78Å; V245-I249 HydrophobicContact CG1-CG1 4.38Å; V245-I249 WeakPolarHBondContact O-CG1 3.27Å; V245-I249 PolarHBondContact O-N 3.4Å; V245-D297 HydrophobicContact CB-CB 4.45Å; V245-D297 HydrophobicContact CG1-CB 4.45Å; V245-D297 HydrophobicContact CG2-CB 3.63Å; V245-Q301 HydrophobicContact CG1-CB 4.01Å
246	N	95.3	Very high	95.6	Very high	58 Å²	58	22.2 Å²	22.2	31%	0.31	13%	0.126	S	C	.	.	H	α-helix	trans	-67.6	-39.4	-178.9	-64.2	-38.4	0	0	0	111.1	V207 N244 R248 I249 I250 K300	V207-N246 HydrophobicContact CG2-CB 3.81Å; N244-N246 WeakPolarHBondContact OD1-CA 3.18Å; N244-N246 WeakPolarHBondContact OD1-CB 3.43Å; N244-N246 PolarHBondContact OD1-N 3.1Å; N246-R248 VanDerWaalsContact C-N 3.34Å; N246-R248 PolarHBondContact O-N 2.95Å; N246-I249 PolarHBondContact O-N 2.93Å; N246-I250 WeakPolarHBondContact O-CG2 3.49Å; N246-I250 PolarHBondContact O-N 3.18Å; N246-K300 PolarHBondContact OD1-NZ 3.38Å
247	V	95.6	Very high	95.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60	-44.4	173.4	175.4	0	0	0	0	110.9	F203 V207 L239 C242 N244 I250 A251	F203-V247 HydrophobicContact CB-CG2 4.15Å; F203-V247 HydrophobicContact CD1-CG2 3.93Å; F203-V247 HydrophobicContact CG-CG2 4.42Å; V207-V247 HydrophobicContact CG2-CG2 3.84Å; L239-V247 HydrophobicContact CB-CG1 4.3Å; L239-V247 HydrophobicContact CD2-CG1 4.21Å; C242-V247 HydrophobicContact CB-CB 4.42Å; C242-V247 HydrophobicContact CB-CG1 3.97Å; N244-V247 HydrophobicContact CB-CB 4.21Å; N244-V247 HydrophobicContact CB-CG2 3.96Å; N244-V247 PolarHBondContact OD1-N 2.94Å; V247-I250 WeakPolarHBondContact O-CG2 3.49Å; V247-A251 VanDerWaalsContact O-CB 3.3Å; V247-A251 WeakPolarHBondContact O-CB 3.44Å; V247-A251 PolarHBondContact O-N 3.42Å
248	R	96.2	Very high	95.8	Very high	9 Å²	9	21.6 Å²	21.6	3%	0.034	12%	0.123	C	C	.	.	H	α-helix	trans	-61.2	-48.4	176	-67.8	-166.3	-65.8	-97.3	-6.8	111.4	L240 C242 S243 N244 V245 N246 I250 A251 G252 R293 F305	L240-R248 WeakPolarHBondContact CD2-O 3.4Å; L240-R248 WeakPolarHBondContact O-CD 3.44Å; L240-R248 VanDerWaalsContact O-CG 3.28Å; L240-R248 WeakPolarHBondContact O-CG 3.17Å; C242-R248 VanDerWaalsContact O-CD 3.32Å; C242-R248 WeakPolarHBondContact O-CD 3.46Å; C242-R248 WeakPolarHBondContact O-CG 3.49Å; C242-R248 PolarHBondContact O-NH1 3.46Å; S243-R248 PolarHBondContact O-NH1 3.26Å; N244-R248 WeakPolarHBondContact O-CG 3.35Å; N244-R248 PolarHBondContact O-N 3.24Å; V245-R248 PolarHBondContact O-N 3.26Å; N246-R248 VanDerWaalsContact C-N 3.34Å; N246-R248 PolarHBondContact O-N 2.95Å; R248-I250 PolarHBondContact O-N 2.83Å; R248-A251 PolarHBondContact O-N 3.21Å; R248-G252 PolarHBondContact O-N 3.28Å; R248-R293 VanDerWaalsContact NH2-CD 3.32Å; R248-F305 HydrophobicContact CB-CE2 4.18Å; R248-F305 HydrophobicContact CB-CZ 4Å; R248-F305 WeakPolarHBondContact O-CZ 3.28Å
249	I	97.7	Very high	96	Very high	11 Å²	11	18.3 Å²	18.3	6%	0.056	10%	0.1	C	C	.	.	H	α-helix	trans	-57.7	-52.9	-178.4	-71.2	168.7	0	0	0	110.8	V245 N246 A251 G252 E253 K300 F305	V245-I249 HydrophobicContact CG1-CD1 3.78Å; V245-I249 HydrophobicContact CG1-CG1 4.38Å; V245-I249 WeakPolarHBondContact O-CG1 3.27Å; V245-I249 PolarHBondContact O-N 3.4Å; N246-I249 PolarHBondContact O-N 2.93Å; I249-A251 VanDerWaalsContact C-N 3.32Å; I249-A251 PolarHBondContact O-N 3.07Å; I249-G252 WeakPolarHBondContact O-CA 3.31Å; I249-G252 PolarHBondContact O-N 2.84Å; I249-G252 VanDerWaalsContact O-N 3.09Å; I249-E253 HydrophobicContact CG2-CG 4.38Å; I249-E253 WeakPolarHBondContact O-CG 3.3Å; I249-E253 PolarHBondContact O-N 3.3Å; I249-K300 HydrophobicContact CD1-CD 4Å; I249-K300 HydrophobicContact CD1-CG 3.74Å; I249-F305 HydrophobicContact CG1-CE2 4.04Å
250	I	98	Very high	96.1	Very high	4 Å²	4	19.9 Å²	19.9	2%	0.021	11%	0.108	C	C	.	.	H	α-helix	trans	-66.8	-32.5	-178.6	-172.2	62.1	0	0	0	112.5	V207 L210 K211 N246 V247 R248 G252 E253 A254 F338	V207-I250 HydrophobicContact CG2-CG2 4.34Å; L210-I250 HydrophobicContact CB-CG1 3.75Å; L210-I250 HydrophobicContact CB-CG2 3.95Å; L210-I250 HydrophobicContact CD1-CG2 3.59Å; L210-I250 HydrophobicContact CG-CG2 4.45Å; K211-I250 HydrophobicContact CG-CD1 3.57Å; K211-I250 HydrophobicContact CG-CG1 3.92Å; N246-I250 WeakPolarHBondContact O-CG2 3.49Å; N246-I250 PolarHBondContact O-N 3.18Å; V247-I250 WeakPolarHBondContact O-CG2 3.49Å; R248-I250 PolarHBondContact O-N 2.83Å; I250-G252 VanDerWaalsContact C-N 3.31Å; I250-E253 HydrophobicContact CD1-CB 4.4Å; I250-E253 VanDerWaalsContact CD1-OE2 3.27Å; I250-E253 WeakPolarHBondContact CD1-OE2 3.22Å; I250-E253 PolarHBondContact O-N 3.36Å; I250-A254 VanDerWaalsContact O-CB 3.28Å; I250-A254 WeakPolarHBondContact O-CB 3.46Å; I250-A254 PolarHBondContact O-N 3.17Å; I250-F338 HydrophobicContact CD1-CD2 4.39Å; I250-F338 HydrophobicContact CD1-CE2 4.05Å
251	A	97.8	Very high	96.1	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-65.5	-36.4	172.9	0	0	0	0	0	111.9	L236 L239 L240 V247 R248 I249 S255	L236-A251 HydrophobicContact CD2-CB 4.39Å; L239-A251 HydrophobicContact CB-CB 3.89Å; L240-A251 HydrophobicContact CD2-CB 4.18Å; L240-A251 HydrophobicContact CG-CB 4.23Å; V247-A251 VanDerWaalsContact O-CB 3.3Å; V247-A251 WeakPolarHBondContact O-CB 3.44Å; V247-A251 PolarHBondContact O-N 3.42Å; R248-A251 PolarHBondContact O-N 3.21Å; I249-A251 VanDerWaalsContact C-N 3.32Å; I249-A251 PolarHBondContact O-N 3.07Å; A251-S255 WeakPolarHBondContact O-CB 3.5Å; A251-S255 PolarHBondContact O-N 3.34Å; A251-S255 PolarHBondContact O-OG 3.38Å
252	G	98.2	Very high	96.2	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-67.2	-47.1	172.9	0	0	0	0	0	112.6	R248 I249 I250 S255 A256	R248-G252 PolarHBondContact O-N 3.28Å; I249-G252 WeakPolarHBondContact O-CA 3.31Å; I249-G252 PolarHBondContact O-N 2.84Å; I249-G252 VanDerWaalsContact O-N 3.09Å; I250-G252 VanDerWaalsContact C-N 3.31Å; G252-S255 WeakPolarHBondContact O-CB 3.44Å; G252-S255 PolarHBondContact O-N 2.92Å; G252-A256 PolarHBondContact O-N 3.4Å
253	E	98.1	Very high	96.5	Very high	26 Å²	26	15 Å²	15	12%	0.121	8%	0.082	C	C	.	.	H	α-helix	trans	-58.3	-48.2	174.7	-70.6	176.9	154.3	0	0	111.3	I249 I250 S255 A256 V257 L308 N341	I249-E253 HydrophobicContact CG2-CG 4.38Å; I249-E253 WeakPolarHBondContact O-CG 3.3Å; I249-E253 PolarHBondContact O-N 3.3Å; I250-E253 HydrophobicContact CD1-CB 4.4Å; I250-E253 VanDerWaalsContact CD1-OE2 3.27Å; I250-E253 WeakPolarHBondContact CD1-OE2 3.22Å; I250-E253 PolarHBondContact O-N 3.36Å; E253-S255 VanDerWaalsContact C-N 3.3Å; E253-S255 PolarHBondContact O-N 3.4Å; E253-A256 PolarHBondContact O-N 3.45Å; E253-V257 WeakPolarHBondContact O-CG2 3.43Å; E253-V257 PolarHBondContact O-N 3.38Å; E253-L308 HydrophobicContact CG-CD2 4.31Å; E253-N341 PolarHBondContact OE1-ND2 2.84Å
254	A	98.5	Very high	96.8	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-58.3	-42.4	176	0	0	0	0	0	111.8	T214 L236 I250 V257 I258	T214-A254 HydrophobicContact CG2-CB 4.44Å; T214-A254 VanDerWaalsContact OG1-CB 3.26Å; T214-A254 WeakPolarHBondContact OG1-CB 2.95Å; L236-A254 HydrophobicContact CD1-CB 4.08Å; L236-A254 HydrophobicContact CD2-CB 4.31Å; I250-A254 VanDerWaalsContact O-CB 3.28Å; I250-A254 WeakPolarHBondContact O-CB 3.46Å; I250-A254 PolarHBondContact O-N 3.17Å; A254-V257 PolarHBondContact O-N 3.42Å; A254-I258 WeakPolarHBondContact O-CD1 3.44Å; A254-I258 VanDerWaalsContact O-CG1 3.23Å; A254-I258 WeakPolarHBondContact O-CG1 3.19Å; A254-I258 PolarHBondContact O-N 2.96Å
255	S	98.3	Very high	96.9	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62.4	-45.3	176.2	-58.5	0	0	0	0	111.4	A251 G252 E253 I258 Y259	A251-S255 WeakPolarHBondContact O-CB 3.5Å; A251-S255 PolarHBondContact O-N 3.34Å; A251-S255 PolarHBondContact O-OG 3.38Å; G252-S255 WeakPolarHBondContact O-CB 3.44Å; G252-S255 PolarHBondContact O-N 2.92Å; E253-S255 VanDerWaalsContact C-N 3.3Å; E253-S255 PolarHBondContact O-N 3.4Å; S255-I258 PolarHBondContact O-N 2.87Å; S255-Y259 WeakPolarHBondContact O-CD2 3.43Å; S255-Y259 PolarHBondContact O-N 3.29Å
256	A	98	Very high	96.7	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.008	12%	0.115	C	C	.	.	H	α-helix	trans	-62.9	-44.2	178.2	0	0	0	0	0	112	G252 E253 I258 Y259 E260 L308 A311 V312 C334	G252-A256 PolarHBondContact O-N 3.4Å; E253-A256 PolarHBondContact O-N 3.45Å; A256-I258 VanDerWaalsContact C-N 3.32Å; A256-I258 PolarHBondContact O-N 3.01Å; A256-Y259 PolarHBondContact O-N 3.18Å; A256-E260 WeakPolarHBondContact O-CB 3.43Å; A256-E260 PolarHBondContact O-N 3.4Å; A256-L308 HydrophobicContact CB-CD2 3.62Å; A256-A311 HydrophobicContact CB-CB 4.36Å; A256-V312 HydrophobicContact CB-CG2 4.12Å; A256-C334 HydrophobicContact CB-CB 4.23Å
257	V	98.1	Very high	96.5	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.006	12%	0.116	C	C	.	.	H	α-helix	trans	-59.4	-41.3	174.2	171.2	0	0	0	0	111.5	T214 Y217 T218 E253 A254 R261 C334 F338	T214-V257 HydrophobicContact CG2-CB 4.22Å; T214-V257 HydrophobicContact CG2-CG1 4.15Å; T214-V257 HydrophobicContact CG2-CG2 4.21Å; Y217-V257 HydrophobicContact CD1-CG1 3.97Å; Y217-V257 HydrophobicContact CE1-CG1 4.09Å; T218-V257 HydrophobicContact CG2-CG1 3.73Å; E253-V257 WeakPolarHBondContact O-CG2 3.43Å; E253-V257 PolarHBondContact O-N 3.38Å; A254-V257 PolarHBondContact O-N 3.42Å; V257-R261 WeakPolarHBondContact O-CB 3.12Å; V257-R261 PolarHBondContact O-N 3.32Å; V257-C334 HydrophobicContact CG2-CB 4.05Å; V257-F338 HydrophobicContact CG2-CB 3.99Å; V257-F338 HydrophobicContact CG2-CG 4.41Å
258	I	98	Very high	96.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-59.9	-49.8	175.5	-70.9	161.4	0	0	0	111.2	W213 Y217 V232 L233 L236 A254 S255 A256 R261 I262	W213-I258 HydrophobicContact CH2-CD1 3.72Å; W213-I258 HydrophobicContact CH2-CG1 4.02Å; W213-I258 HydrophobicContact CZ3-CD1 3.98Å; W213-I258 HydrophobicContact CZ3-CG1 4.22Å; Y217-I258 HydrophobicContact CD1-CG1 4.37Å; Y217-I258 HydrophobicContact CE1-CB 4.37Å; Y217-I258 HydrophobicContact CE1-CG1 3.8Å; Y217-I258 HydrophobicContact CE2-CG1 4.19Å; V232-I258 HydrophobicContact CG1-CD1 3.56Å; L233-I258 HydrophobicContact CD2-CD1 4.38Å; L233-I258 HydrophobicContact CD2-CG2 4.43Å; L236-I258 HydrophobicContact CD1-CD1 3.51Å; A254-I258 WeakPolarHBondContact O-CD1 3.44Å; A254-I258 VanDerWaalsContact O-CG1 3.23Å; A254-I258 WeakPolarHBondContact O-CG1 3.19Å; A254-I258 PolarHBondContact O-N 2.96Å; S255-I258 PolarHBondContact O-N 2.87Å; A256-I258 VanDerWaalsContact C-N 3.32Å; A256-I258 PolarHBondContact O-N 3.01Å; I258-R261 PolarHBondContact O-N 3.18Å; I258-I262 HydrophobicContact CG2-CD1 3.68Å; I258-I262 HydrophobicContact CG2-CG1 4.44Å; I258-I262 WeakPolarHBondContact O-CB 3.23Å; I258-I262 VanDerWaalsContact O-CG1 3.26Å; I258-I262 WeakPolarHBondContact O-CG1 3.29Å; I258-I262 PolarHBondContact O-N 2.81Å
259	Y	97.8	Very high	96.4	Very high	1 Å²	1	35.7 Å²	35.7	0%	0.004	18%	0.178	C	C	.	.	H	α-helix	trans	-67	-44	-178.5	-88.2	-91.7	0	0	0	112.7	L233 S255 A256 R261 R263 F270 K271 Y275 L278 V312	L233-Y259 HydrophobicContact CD1-CE2 4.21Å; L233-Y259 HydrophobicContact CD2-CE2 3.9Å; S255-Y259 WeakPolarHBondContact O-CD2 3.43Å; S255-Y259 PolarHBondContact O-N 3.29Å; A256-Y259 PolarHBondContact O-N 3.18Å; Y259-R261 VanDerWaalsContact C-N 3.32Å; Y259-R261 PolarHBondContact O-N 3.26Å; Y259-R263 VanDerWaalsContact O-CB 3.31Å; Y259-R263 WeakPolarHBondContact O-CB 3.4Å; Y259-R263 VanDerWaalsContact O-CG 3.23Å; Y259-R263 WeakPolarHBondContact O-CG 3.37Å; Y259-R263 PolarHBondContact O-N 3.4Å; Y259-F270 AromaticContact CD1-CD1 3.95Å; Y259-F270 HydrophobicContact CD1-CD1 3.95Å; Y259-F270 HydrophobicContact CD1-CE1 4.18Å; Y259-F270 AromaticContact CE1-CD1 3.96Å; Y259-F270 HydrophobicContact CE1-CD1 3.96Å; Y259-F270 AromaticContact CE1-CE1 3.9Å; Y259-F270 HydrophobicContact CE1-CE1 3.9Å; Y259-K271 VanDerWaalsContact CE1-O 3.29Å; Y259-K271 WeakPolarHBondContact CE1-O 3.35Å; Y259-K271 PolarHBondContact OH-O 2.82Å; Y259-Y275 AromaticContact CE1-CD2 3.71Å; Y259-Y275 HydrophobicContact CE1-CD2 3.71Å; Y259-Y275 HydrophobicContact CE1-CE2 4.34Å; Y259-Y275 WeakPolarHBondContact OH-CA 3.19Å; Y259-L278 HydrophobicContact CD2-CD2 3.82Å; Y259-L278 HydrophobicContact CE2-CD2 3.23Å; Y259-V312 HydrophobicContact CG-CG1 4.46Å
260	E	97.2	Very high	96.3	Very high	33 Å²	33	35.7 Å²	35.7	15%	0.154	18%	0.177	C	C	.	.	H	α-helix	trans	-55.4	-50.4	174.4	176.3	175.5	87.9	0	0	110.3	A256 R263 N264 S333 C334 T335	A256-E260 WeakPolarHBondContact O-CB 3.43Å; A256-E260 PolarHBondContact O-N 3.4Å; E260-R263 PolarHBondContact O-N 2.74Å; E260-N264 WeakPolarHBondContact O-CB 3.45Å; E260-N264 PolarHBondContact O-N 3.02Å; E260-N264 PolarHBondContact O-ND2 2.98Å; E260-S333 WeakPolarHBondContact OE2-CA 3.28Å; E260-S333 WeakPolarHBondContact OE2-CB 3.26Å; E260-C334 HydrophobicContact CB-CB 4.33Å; E260-C334 PolarHBondContact OE1-N 3.38Å; E260-C334 WeakPolarHBondContact OE2-CB 3.46Å; E260-C334 PolarHBondContact OE2-N 3.02Å; E260-C334 PolarHBondContact OE2-SG 3.46Å; E260-T335 VanDerWaalsContact OE1-CB 3.23Å; E260-T335 WeakPolarHBondContact OE1-CB 3.45Å; E260-T335 PolarHBondContact OE1-N 3.43Å; E260-T335 PolarHBondContact OE1-OG1 3.01Å
261	R	95.9	Very high	96.1	Very high	19 Å²	19	41.2 Å²	41.2	7%	0.072	20%	0.201	C	C	.	.	H	α-helix	trans	-65.3	-47	-176.6	-164.7	169.9	-165.5	-147.3	-13.2	113	Y217 T218 L220 V257 I258 Y259 R263 N264 E265	Y217-R261 HydrophobicContact CE1-CB 4.15Å; Y217-R261 PolarHBondContact O-NH1 2.95Å; T218-R261 VanDerWaalsContact O-CZ 3.32Å; T218-R261 PolarHBondContact O-NH1 3.41Å; L220-R261 VanDerWaalsContact N-NH1 3.16Å; L220-R261 PolarHBondContact O-NH1 2.87Å; L220-R261 PolarHBondContact O-NH2 3.03Å; V257-R261 WeakPolarHBondContact O-CB 3.12Å; V257-R261 PolarHBondContact O-N 3.32Å; I258-R261 PolarHBondContact O-N 3.18Å; Y259-R261 VanDerWaalsContact C-N 3.32Å; Y259-R261 PolarHBondContact O-N 3.26Å; R261-R263 VanDerWaalsContact C-N 3.32Å; R261-R263 PolarHBondContact O-N 3.04Å; R261-N264 PolarHBondContact O-N 2.54Å; R261-E265 HydrophobicContact CG-CG 4.45Å; R261-E265 WeakPolarHBondContact CG-OE1 3.28Å; R261-E265 IonicContact CZ-OE1 2.7Å; R261-E265 IonicContact CZ-OE2 3.14Å; R261-E265 IonicContact NE-OE1 3.49Å; R261-E265 PolarHBondContact NE-OE1 3.45Å; R261-E265 IonicContact NE-OE2 3.67Å; R261-E265 PolarHBondContact NE-OE2 3.14Å; R261-E265 VanDerWaalsContact NE-OE2 3.15Å; R261-E265 IonicContact NH2-OE1 2.77Å; R261-E265 PolarHBondContact NH2-OE1 2.97Å; R261-E265 IonicContact NH2-OE2 3.28Å; R261-E265 PolarHBondContact NH2-OE2 3.45Å; R261-E265 WeakPolarHBondContact O-CB 3.48Å; R261-E265 PolarHBondContact O-N 3.27Å
262	I	96.1	Very high	95.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.8	-41.6	178.3	-66.5	173.9	0	0	0	110.5	K230 I258 V266 D267 F270	K230-I262 HydrophobicContact CG-CD1 4.13Å; I258-I262 HydrophobicContact CG2-CD1 3.68Å; I258-I262 HydrophobicContact CG2-CG1 4.44Å; I258-I262 WeakPolarHBondContact O-CB 3.23Å; I258-I262 VanDerWaalsContact O-CG1 3.26Å; I258-I262 WeakPolarHBondContact O-CG1 3.29Å; I258-I262 PolarHBondContact O-N 2.81Å; I262-V266 HydrophobicContact CG2-CB 4.2Å; I262-V266 CarbonylContact O-C 3.59Å; I262-V266 WeakPolarHBondContact O-CA 3.5Å; I262-V266 WeakPolarHBondContact O-CB 3.31Å; I262-V266 PolarHBondContact O-N 3.07Å; I262-D267 PolarHBondContact O-N 3.3Å; I262-F270 HydrophobicContact CB-CD1 4.01Å; I262-F270 HydrophobicContact CB-CG 4.37Å; I262-F270 HydrophobicContact CD1-CD1 4.1Å; I262-F270 HydrophobicContact CD1-CE1 3.8Å; I262-F270 HydrophobicContact CD1-CZ 4.28Å; I262-F270 HydrophobicContact CG2-CB 3.58Å; I262-F270 HydrophobicContact CG2-CD1 3.54Å; I262-F270 HydrophobicContact CG2-CD2 4.03Å; I262-F270 HydrophobicContact CG2-CE1 4.24Å; I262-F270 HydrophobicContact CG2-CG 3.41Å; I262-F270 VanDerWaalsContact CG2-CG 3.41Å
263	R	96.1	Very high	95.8	Very high	22 Å²	22	48 Å²	48	8%	0.083	25%	0.251	C	S	.	.	H	α-helix	trans	-69.5	-34.8	179.6	-69.7	175.2	-171.7	161.8	5.2	113.3	Y259 E260 R261 D267 D268 F270 V312 S315	Y259-R263 VanDerWaalsContact O-CB 3.31Å; Y259-R263 WeakPolarHBondContact O-CB 3.4Å; Y259-R263 VanDerWaalsContact O-CG 3.23Å; Y259-R263 WeakPolarHBondContact O-CG 3.37Å; Y259-R263 PolarHBondContact O-N 3.4Å; E260-R263 PolarHBondContact O-N 2.74Å; R261-R263 VanDerWaalsContact C-N 3.32Å; R261-R263 PolarHBondContact O-N 3.04Å; R263-D267 VanDerWaalsContact CA-O 3.3Å; R263-D267 WeakPolarHBondContact CA-O 3.36Å; R263-D268 VanDerWaalsContact O-CA 3.23Å; R263-D268 WeakPolarHBondContact O-CA 3.41Å; R263-D268 PolarHBondContact O-N 2.87Å; R263-F270 HydrophobicContact CG-CB 4.18Å; R263-F270 PolarHBondContact NE-O 2.9Å; R263-F270 PolarHBondContact NH2-O 3.33Å; R263-V312 VanDerWaalsContact CZ-O 3.31Å; R263-V312 PolarHBondContact NH1-O 3.37Å; R263-V312 PolarHBondContact NH2-O 2.96Å; R263-S315 WeakPolarHBondContact CD-OG 3.46Å; R263-S315 PolarHBondContact NH1-OG 3.22Å
264	N	94.8	Very high	95.7	Very high	128 Å²	128	50.7 Å²	50.7	68%	0.684	26%	0.261	S	S	*	.	H	α-helix	trans	-78.1	-34.7	179.7	-69.5	-12.1	0	0	0	112.8	E260 R261	E260-N264 WeakPolarHBondContact O-CB 3.45Å; E260-N264 PolarHBondContact O-N 3.02Å; E260-N264 PolarHBondContact O-ND2 2.98Å; R261-N264 PolarHBondContact O-N 2.54Å
265	E	94.2	Very high	95.7	Very high	88 Å²	88	52.3 Å²	52.3	41%	0.411	27%	0.267	S	S	.	.	H	α-helix	trans	-113.4	-20.5	-167.3	-58.7	174.7	-167.5	0	0	114.8	P222 R261	P222-E265 HydrophobicContact CB-CB 4.13Å; P222-E265 HydrophobicContact CG-CB 4.41Å; R261-E265 HydrophobicContact CG-CG 4.45Å; R261-E265 WeakPolarHBondContact CG-OE1 3.28Å; R261-E265 IonicContact CZ-OE1 2.7Å; R261-E265 IonicContact CZ-OE2 3.14Å; R261-E265 IonicContact NE-OE1 3.49Å; R261-E265 PolarHBondContact NE-OE1 3.45Å; R261-E265 IonicContact NE-OE2 3.67Å; R261-E265 PolarHBondContact NE-OE2 3.14Å; R261-E265 VanDerWaalsContact NE-OE2 3.15Å; R261-E265 IonicContact NH2-OE1 2.77Å; R261-E265 PolarHBondContact NH2-OE1 2.97Å; R261-E265 IonicContact NH2-OE2 3.28Å; R261-E265 PolarHBondContact NH2-OE2 3.45Å; R261-E265 WeakPolarHBondContact O-CB 3.48Å; R261-E265 PolarHBondContact O-N 3.27Å
266	V	90.2	Very high	95.6	Very high	73 Å²	73	56.7 Å²	56.7	44%	0.442	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	-54	-168.1	-173.8	0	0	0	0	113.2	P222 I262	P222-V266 HydrophobicContact CB-CG2 4.48Å; P222-V266 VanDerWaalsContact O-CG2 3.29Å; P222-V266 WeakPolarHBondContact O-CG2 3.3Å; I262-V266 HydrophobicContact CG2-CB 4.2Å; I262-V266 CarbonylContact O-C 3.59Å; I262-V266 WeakPolarHBondContact O-CA 3.5Å; I262-V266 WeakPolarHBondContact O-CB 3.31Å; I262-V266 PolarHBondContact O-N 3.07Å
267	D	92.7	Very high	95.6	Very high	65 Å²	65	60.2 Å²	60.2	35%	0.348	32%	0.317	S	S	.	.			trans	-153.2	101.8	-175.4	170.7	15.1	0	0	0	110.4	I262 R263 K269 F270	I262-D267 PolarHBondContact O-N 3.3Å; R263-D267 VanDerWaalsContact CA-O 3.3Å; R263-D267 WeakPolarHBondContact CA-O 3.36Å; D267-K269 PolarHBondContact O-N 3.5Å; D267-K269 PolarHBondContact OD1-N 2.93Å; D267-K269 VanDerWaalsContact OD1-N 3.11Å; D267-F270 HydrophobicContact CB-CB 4.11Å; D267-F270 WeakPolarHBondContact O-CB 3.16Å; D267-F270 PolarHBondContact O-N 3.17Å
268	D	93.9	Very high	95.6	Very high	113 Å²	113	60.2 Å²	60.2	60%	0.604	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-20.5	-177.1	71.4	-24.7	0	0	0	114.5	R263	R263-D268 VanDerWaalsContact O-CA 3.23Å; R263-D268 WeakPolarHBondContact O-CA 3.41Å; R263-D268 PolarHBondContact O-N 2.87Å
269	K	94.7	Very high	95.6	Very high	165 Å²	165	62.1 Å²	62.1	72%	0.717	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	12.3	-179.2	-69.7	166.5	-166.8	173.9	0	112.8	D267 K271	D267-K269 PolarHBondContact O-N 3.5Å; D267-K269 PolarHBondContact OD1-N 2.93Å; D267-K269 VanDerWaalsContact OD1-N 3.11Å; K269-K271 PolarHBondContact O-N 3.34Å; K269-K271 VanDerWaalsContact O-N 3.09Å
270	F	95.5	Very high	95.7	Very high	10 Å²	10	67.4 Å²	67.4	4%	0.044	35%	0.348	C	S	.	.			trans	-58.5	118.6	-176.7	-179.5	-105.9	0	0	0	112.2	K230 Y259 I262 R263 D267	K230-F270 HydrophobicContact CD-CE2 4.04Å; K230-F270 HydrophobicContact CD-CZ 4.2Å; K230-F270 VanDerWaalsContact CE-CE2 3.46Å; K230-F270 HydrophobicContact CG-CE2 4.11Å; K230-F270 HydrophobicContact CG-CZ 3.73Å; Y259-F270 AromaticContact CD1-CD1 3.95Å; Y259-F270 HydrophobicContact CD1-CD1 3.95Å; Y259-F270 HydrophobicContact CD1-CE1 4.18Å; Y259-F270 AromaticContact CE1-CD1 3.96Å; Y259-F270 HydrophobicContact CE1-CD1 3.96Å; Y259-F270 AromaticContact CE1-CE1 3.9Å; Y259-F270 HydrophobicContact CE1-CE1 3.9Å; I262-F270 HydrophobicContact CB-CD1 4.01Å; I262-F270 HydrophobicContact CB-CG 4.37Å; I262-F270 HydrophobicContact CD1-CD1 4.1Å; I262-F270 HydrophobicContact CD1-CE1 3.8Å; I262-F270 HydrophobicContact CD1-CZ 4.28Å; I262-F270 HydrophobicContact CG2-CB 3.58Å; I262-F270 HydrophobicContact CG2-CD1 3.54Å; I262-F270 HydrophobicContact CG2-CD2 4.03Å; I262-F270 HydrophobicContact CG2-CE1 4.24Å; I262-F270 HydrophobicContact CG2-CG 3.41Å; I262-F270 VanDerWaalsContact CG2-CG 3.41Å; R263-F270 HydrophobicContact CG-CB 4.18Å; R263-F270 PolarHBondContact NE-O 2.9Å; R263-F270 PolarHBondContact NH2-O 3.33Å; D267-F270 HydrophobicContact CB-CB 4.11Å; D267-F270 WeakPolarHBondContact O-CB 3.16Å; D267-F270 PolarHBondContact O-N 3.17Å
271	K	95.3	Very high	95.7	Very high	120 Å²	120	66.1 Å²	66.1	52%	0.522	34%	0.342	S	S	.	.			trans	-110.6	-48.2	164.8	-69.9	-175.1	177.4	-177.4	0	110.2	Y259 K269 Y275	Y259-K271 VanDerWaalsContact CE1-O 3.29Å; Y259-K271 WeakPolarHBondContact CE1-O 3.35Å; Y259-K271 PolarHBondContact OH-O 2.82Å; K269-K271 PolarHBondContact O-N 3.34Å; K269-K271 VanDerWaalsContact O-N 3.09Å; K271-Y275 HydrophobicContact CB-CD1 4.21Å; K271-Y275 HydrophobicContact CB-CD2 4.08Å; K271-Y275 HydrophobicContact CB-CG 3.78Å; K271-Y275 HydrophobicContact CD-CD1 3.89Å; K271-Y275 HydrophobicContact CD-CE1 3.91Å; K271-Y275 HydrophobicContact CD-CG 4.29Å; K271-Y275 HydrophobicContact CG-CD1 4.1Å; K271-Y275 HydrophobicContact CG-CD2 4.09Å; K271-Y275 HydrophobicContact CG-CE1 4.26Å; K271-Y275 HydrophobicContact CG-CE2 4.26Å; K271-Y275 HydrophobicContact CG-CG 4Å; K271-Y275 WeakPolarHBondContact O-CB 3.3Å
272	G	93.6	Very high	95.8	Very high	34 Å²	34	65.2 Å²	65.2	35%	0.351	34%	0.339	S	S	.	.			trans	70.2	177.5	-175.8	0	0	0	0	0	113.2	Y274	G272-Y274 PolarHBondContact O-N 3.44Å
273	P	95.2	Very high	95.9	Very high	108 Å²	108	66.5 Å²	66.5	70%	0.701	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-24.5	-170.9	26.6	-33.8	0	0	0	114.2
274	Y	96	Very high	96	Very high	83 Å²	83	70.1 Å²	70.1	33%	0.325	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	5.7	-174.8	-54.7	-66.2	0	0	0	113.8	L233 P234 L237 G272 S276 D277 L278	L233-Y274 HydrophobicContact CB-CD2 3.93Å; L233-Y274 HydrophobicContact CD1-CD2 4.48Å; P234-Y274 HydrophobicContact CG-CD2 4.16Å; P234-Y274 HydrophobicContact CG-CE1 4.1Å; P234-Y274 HydrophobicContact CG-CE2 3.48Å; P234-Y274 VanDerWaalsContact CG-CE2 3.48Å; P234-Y274 VanDerWaalsContact CG-CZ 3.45Å; L237-Y274 HydrophobicContact CD2-CD1 4.38Å; L237-Y274 HydrophobicContact CD2-CG 4.5Å; G272-Y274 PolarHBondContact O-N 3.44Å; Y274-S276 PolarHBondContact O-N 2.92Å; Y274-D277 PolarHBondContact O-N 3.3Å; Y274-L278 WeakPolarHBondContact O-CB 3.4Å; Y274-L278 PolarHBondContact O-N 3.06Å
275	Y	97.6	Very high	96.1	Very high	34 Å²	34	64.6 Å²	64.6	13%	0.133	34%	0.34	C	S	.	.	H	α-helix	trans	-56.9	-51.5	-174.3	-177	-107	0	0	0	113.1	Y259 K271 D277 L278 V279 V312	Y259-Y275 AromaticContact CE1-CD2 3.71Å; Y259-Y275 HydrophobicContact CE1-CD2 3.71Å; Y259-Y275 HydrophobicContact CE1-CE2 4.34Å; Y259-Y275 WeakPolarHBondContact OH-CA 3.19Å; K271-Y275 HydrophobicContact CB-CD1 4.21Å; K271-Y275 HydrophobicContact CB-CD2 4.08Å; K271-Y275 HydrophobicContact CB-CG 3.78Å; K271-Y275 HydrophobicContact CD-CD1 3.89Å; K271-Y275 HydrophobicContact CD-CE1 3.91Å; K271-Y275 HydrophobicContact CD-CG 4.29Å; K271-Y275 HydrophobicContact CG-CD1 4.1Å; K271-Y275 HydrophobicContact CG-CD2 4.09Å; K271-Y275 HydrophobicContact CG-CE1 4.26Å; K271-Y275 HydrophobicContact CG-CE2 4.26Å; K271-Y275 HydrophobicContact CG-CG 4Å; K271-Y275 WeakPolarHBondContact O-CB 3.3Å; Y275-D277 VanDerWaalsContact C-N 3.33Å; Y275-D277 PolarHBondContact O-N 3.44Å; Y275-L278 PolarHBondContact O-N 3Å; Y275-V279 HydrophobicContact CD1-CG2 4.32Å; Y275-V279 HydrophobicContact CD2-CG2 4.2Å; Y275-V279 HydrophobicContact CE1-CG2 3.96Å; Y275-V279 HydrophobicContact CE2-CG2 3.83Å; Y275-V279 HydrophobicContact CG-CG2 4.45Å; Y275-V279 WeakPolarHBondContact O-CG2 3.48Å; Y275-V279 PolarHBondContact O-N 3.38Å; Y275-V312 HydrophobicContact CE2-CG1 4.13Å
276	S	97.7	Very high	96.3	Very high	92 Å²	92	60.9 Å²	60.9	64%	0.643	33%	0.325	S	S	*	.	H	α-helix	trans	-62.3	-41.1	-176.4	-61.2	0	0	0	0	112	Y274 R280	Y274-S276 PolarHBondContact O-N 2.92Å; S276-R280 WeakPolarHBondContact O-CB 3.42Å; S276-R280 PolarHBondContact O-N 3.28Å
277	D	97.7	Very high	96.6	Very high	76 Å²	76	62.5 Å²	62.5	41%	0.406	34%	0.335	S	S	.	.	H	α-helix	trans	-68.7	-41.2	177.2	-74.1	-42.8	0	0	0	112.2	L237 Y274 Y275 R280 L281	L237-D277 HydrophobicContact CD2-CB 3.54Å; Y274-D277 PolarHBondContact O-N 3.3Å; Y275-D277 VanDerWaalsContact C-N 3.33Å; Y275-D277 PolarHBondContact O-N 3.44Å; D277-R280 PolarHBondContact O-N 3.22Å; D277-R280 IonicContact OD1-NH2 3.05Å; D277-L281 WeakPolarHBondContact O-CB 3.41Å; D277-L281 VanDerWaalsContact O-CG 3.3Å; D277-L281 WeakPolarHBondContact O-CG 3.3Å; D277-L281 PolarHBondContact O-N 3.43Å
278	L	98.2	Very high	96.6	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-59.8	-53.9	175.3	177.3	62.6	0	0	0	110.7	L237 L240 Y259 Y274 Y275 R280 L281 L282 V312	L237-L278 HydrophobicContact CD1-CB 4.5Å; L240-L278 HydrophobicContact CD1-CD1 3.56Å; Y259-L278 HydrophobicContact CD2-CD2 3.82Å; Y259-L278 HydrophobicContact CE2-CD2 3.23Å; Y274-L278 WeakPolarHBondContact O-CB 3.4Å; Y274-L278 PolarHBondContact O-N 3.06Å; Y275-L278 PolarHBondContact O-N 3Å; L278-R280 VanDerWaalsContact C-N 3.27Å; L278-R280 PolarHBondContact O-N 3.42Å; L278-L281 PolarHBondContact O-N 2.97Å; L278-L281 VanDerWaalsContact O-N 3.14Å; L278-L282 HydrophobicContact CD1-CD1 3.95Å; L278-L282 HydrophobicContact CD1-CD2 4.06Å; L278-L282 HydrophobicContact CD1-CG 3.83Å; L278-L282 HydrophobicContact CG-CD1 3.91Å; L278-L282 HydrophobicContact CG-CG 4.17Å; L278-L282 VanDerWaalsContact O-CG 3.28Å; L278-L282 WeakPolarHBondContact O-CG 3.49Å; L278-L282 PolarHBondContact O-N 3.42Å; L278-V312 HydrophobicContact CD2-CG1 3.9Å; L278-V312 HydrophobicContact CD2-CG2 4.48Å; L278-V312 HydrophobicContact CG-CG1 4.44Å
279	V	98.2	Very high	96.6	Very high	40 Å²	40	59.7 Å²	59.7	24%	0.242	33%	0.328	C	S	.	.	H	α-helix	trans	-57.4	-42.3	-179.3	171.7	0	0	0	0	111.2	Y275 G283 V312 V313	Y275-V279 HydrophobicContact CD1-CG2 4.32Å; Y275-V279 HydrophobicContact CD2-CG2 4.2Å; Y275-V279 HydrophobicContact CE1-CG2 3.96Å; Y275-V279 HydrophobicContact CE2-CG2 3.83Å; Y275-V279 HydrophobicContact CG-CG2 4.45Å; Y275-V279 WeakPolarHBondContact O-CG2 3.48Å; Y275-V279 PolarHBondContact O-N 3.38Å; V279-G283 PolarHBondContact O-N 2.68Å; V279-V312 HydrophobicContact CG2-CG1 4.24Å; V279-V313 HydrophobicContact CB-CG2 4.48Å; V279-V313 HydrophobicContact CG1-CG2 3.8Å; V279-V313 HydrophobicContact CG2-CG2 3.85Å
280	R	98.3	Very high	96.5	Very high	112 Å²	112	53.7 Å²	53.7	42%	0.423	31%	0.307	S	S	.	.	H	α-helix	trans	-59.9	-51.4	175.4	-176.1	-174.3	58.2	69.5	3.8	111.6	S276 D277 L278 L282 G283 E284	S276-R280 WeakPolarHBondContact O-CB 3.42Å; S276-R280 PolarHBondContact O-N 3.28Å; D277-R280 PolarHBondContact O-N 3.22Å; D277-R280 IonicContact OD1-NH2 3.05Å; L278-R280 VanDerWaalsContact C-N 3.27Å; L278-R280 PolarHBondContact O-N 3.42Å; R280-L282 PolarHBondContact O-N 2.94Å; R280-G283 PolarHBondContact O-N 3.2Å; R280-E284 WeakPolarHBondContact CG-OE1 3.29Å; R280-E284 IonicContact CZ-OE1 3Å; R280-E284 VanDerWaalsContact NH1-CD 3.28Å; R280-E284 IonicContact NH1-OE1 3.15Å; R280-E284 PolarHBondContact NH1-OE1 3.35Å; R280-E284 IonicContact NH1-OE2 3.41Å; R280-E284 PolarHBondContact NH1-OE2 3.03Å; R280-E284 WeakPolarHBondContact O-CG 3.48Å; R280-E284 PolarHBondContact O-N 3Å
281	L	98	Very high	96.2	Very high	7 Å²	7	63.3 Å²	63.3	4%	0.037	35%	0.348	C	S	.	.	H	α-helix	trans	-62.6	-42.7	-179.6	-72.7	170.9	0	0	0	112.2	L237 L240 Q241 D277 L278 G283 E284 L285	L237-L281 HydrophobicContact CB-CD1 4.23Å; L237-L281 HydrophobicContact CG-CD1 4.2Å; L240-L281 HydrophobicContact CB-CD1 4.44Å; L240-L281 HydrophobicContact CD1-CB 4.36Å; L240-L281 HydrophobicContact CD1-CD1 4.47Å; Q241-L281 HydrophobicContact CG-CD2 3.81Å; D277-L281 WeakPolarHBondContact O-CB 3.41Å; D277-L281 VanDerWaalsContact O-CG 3.3Å; D277-L281 WeakPolarHBondContact O-CG 3.3Å; D277-L281 PolarHBondContact O-N 3.43Å; L278-L281 PolarHBondContact O-N 2.97Å; L278-L281 VanDerWaalsContact O-N 3.14Å; L281-G283 VanDerWaalsContact C-N 3.34Å; L281-G283 PolarHBondContact O-N 3.39Å; L281-E284 PolarHBondContact O-N 3.39Å; L281-L285 VanDerWaalsContact O-CG 3.28Å; L281-L285 WeakPolarHBondContact O-CG 3.25Å; L281-L285 PolarHBondContact O-N 2.93Å; L281-L285 VanDerWaalsContact O-N 3.07Å
282	L	98.2	Very high	96	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-61.6	-43.2	176.1	-62.9	-179.1	0	0	0	110.9	L240 L278 R280 L285 A286 F305 V309 V312	L240-L282 HydrophobicContact CD1-CD2 4.15Å; L240-L282 HydrophobicContact CD2-CD2 4.21Å; L278-L282 HydrophobicContact CD1-CD1 3.95Å; L278-L282 HydrophobicContact CD1-CD2 4.06Å; L278-L282 HydrophobicContact CD1-CG 3.83Å; L278-L282 HydrophobicContact CG-CD1 3.91Å; L278-L282 HydrophobicContact CG-CG 4.17Å; L278-L282 VanDerWaalsContact O-CG 3.28Å; L278-L282 WeakPolarHBondContact O-CG 3.49Å; L278-L282 PolarHBondContact O-N 3.42Å; R280-L282 PolarHBondContact O-N 2.94Å; L282-L285 PolarHBondContact O-N 3.36Å; L282-A286 WeakPolarHBondContact O-CB 3.4Å; L282-A286 PolarHBondContact O-N 3.29Å; L282-F305 HydrophobicContact CB-CD1 4.39Å; L282-F305 HydrophobicContact CD2-CD1 3.59Å; L282-F305 HydrophobicContact CD2-CE1 3.48Å; L282-F305 VanDerWaalsContact CD2-CE1 3.48Å; L282-V309 HydrophobicContact CB-CG2 3.55Å; L282-V312 HydrophobicContact CD1-CB 3.99Å; L282-V312 HydrophobicContact CD1-CG1 4.32Å; L282-V312 HydrophobicContact CD1-CG2 3.8Å
283	G	98.1	Very high	95.8	Very high	27 Å²	27	63.8 Å²	63.8	28%	0.278	35%	0.353	S	S	.	.	H	α-helix	trans	-64.1	-40.5	177.5	0	0	0	0	0	114	V279 R280 L281 A286 T287	V279-G283 PolarHBondContact O-N 2.68Å; R280-G283 PolarHBondContact O-N 3.2Å; L281-G283 VanDerWaalsContact C-N 3.34Å; L281-G283 PolarHBondContact O-N 3.39Å; G283-A286 PolarHBondContact O-N 3.26Å; G283-T287 PolarHBondContact O-N 3.48Å; G283-T287 PolarHBondContact O-OG1 2.92Å
284	E	97.6	Very high	95.7	Very high	97 Å²	97	61.3 Å²	61.3	45%	0.453	34%	0.338	S	S	.	.	H	α-helix	trans	-61	-44.1	173.4	-74.3	169.7	-170.4	0	0	111.2	R280 L281 T287 D288	R280-E284 WeakPolarHBondContact CG-OE1 3.29Å; R280-E284 IonicContact CZ-OE1 3Å; R280-E284 VanDerWaalsContact NH1-CD 3.28Å; R280-E284 IonicContact NH1-OE1 3.15Å; R280-E284 PolarHBondContact NH1-OE1 3.35Å; R280-E284 IonicContact NH1-OE2 3.41Å; R280-E284 PolarHBondContact NH1-OE2 3.03Å; R280-E284 WeakPolarHBondContact O-CG 3.48Å; R280-E284 PolarHBondContact O-N 3Å; L281-E284 PolarHBondContact O-N 3.39Å; E284-T287 PolarHBondContact O-N 2.88Å; E284-T287 PolarHBondContact O-OG1 3.03Å; E284-D288 PolarHBondContact O-N 3.19Å; E284-D288 VanDerWaalsContact O-N 3.16Å
285	L	97.6	Very high	95.6	Very high	13 Å²	13	66.1 Å²	66.1	7%	0.068	36%	0.36	C	S	.	.	H	α-helix	trans	-72.3	-29.1	179.9	-66.1	170.1	0	0	0	113.1	L240 L281 L282 T287 Q301 F305	L240-L285 HydrophobicContact CB-CD1 4.34Å; L240-L285 HydrophobicContact CD2-CD1 3.95Å; L281-L285 VanDerWaalsContact O-CG 3.28Å; L281-L285 WeakPolarHBondContact O-CG 3.25Å; L281-L285 PolarHBondContact O-N 2.93Å; L281-L285 VanDerWaalsContact O-N 3.07Å; L282-L285 PolarHBondContact O-N 3.36Å; L285-T287 VanDerWaalsContact C-N 3.32Å; L285-Q301 HydrophobicContact CB-CG 4.47Å; L285-Q301 PolarHBondContact O-NE2 2.68Å; L285-F305 HydrophobicContact CB-CB 4.12Å; L285-F305 HydrophobicContact CB-CD1 3.7Å; L285-F305 HydrophobicContact CB-CD2 3.72Å; L285-F305 HydrophobicContact CB-CE1 4.01Å; L285-F305 HydrophobicContact CB-CE2 4.01Å; L285-F305 HydrophobicContact CB-CG 3.54Å; L285-F305 HydrophobicContact CB-CZ 4.14Å; L285-F305 HydrophobicContact CD1-CD1 4.01Å; L285-F305 HydrophobicContact CD1-CD2 4.49Å; L285-F305 HydrophobicContact CD1-CE1 3.44Å; L285-F305 VanDerWaalsContact CD1-CE1 3.44Å; L285-F305 HydrophobicContact CD1-CE2 3.97Å; L285-F305 HydrophobicContact CD1-CZ 3.4Å; L285-F305 VanDerWaalsContact CD1-CZ 3.4Å; L285-F305 HydrophobicContact CG-CE1 4.37Å; L285-F305 HydrophobicContact CG-CZ 4.35Å
286	A	97.4	Very high	95.5	Very high	10 Å²	10	70.5 Å²	70.5	8%	0.083	39%	0.386	C	S	.	.	H	α-helix	trans	-70	-26.2	175.7	0	0	0	0	0	113.4	L282 G283 R302 F305 R306 V309	L282-A286 WeakPolarHBondContact O-CB 3.4Å; L282-A286 PolarHBondContact O-N 3.29Å; G283-A286 PolarHBondContact O-N 3.26Å; A286-R302 WeakPolarHBondContact O-CB 3.26Å; A286-R302 VanDerWaalsContact O-CG 3.3Å; A286-R302 WeakPolarHBondContact O-CG 3.36Å; A286-F305 HydrophobicContact CB-CB 3.87Å; A286-R306 HydrophobicContact CB-CG 4.12Å; A286-V309 HydrophobicContact CB-CG2 4.27Å
287	T	96.6	Very high	95.4	Very high	106 Å²	106	69 Å²	69	65%	0.65	37%	0.371	S	S	*	.	S	Bend	trans	-112.1	6.6	-176.3	56.1	0	0	0	0	113.9	G283 E284 L285 S289	G283-T287 PolarHBondContact O-N 3.48Å; G283-T287 PolarHBondContact O-OG1 2.92Å; E284-T287 PolarHBondContact O-N 2.88Å; E284-T287 PolarHBondContact O-OG1 3.03Å; L285-T287 VanDerWaalsContact C-N 3.32Å; T287-S289 PolarHBondContact O-N 2.84Å
288	D	94.6	Very high	95.2	Very high	21 Å²	21	66.1 Å²	66.1	11%	0.112	36%	0.356	C	S	.	.			trans	-53.9	131.9	-170.5	-153	-39.8	0	0	0	114.7	E284 S290 R293 L298 Q301 R302	E284-D288 PolarHBondContact O-N 3.19Å; E284-D288 VanDerWaalsContact O-N 3.16Å; D288-S290 WeakPolarHBondContact OD1-CB 3.3Å; D288-S290 PolarHBondContact OD1-N 3.45Å; D288-R293 IonicContact OD1-CZ 3.1Å; D288-R293 IonicContact OD1-NH1 3.68Å; D288-R293 PolarHBondContact OD1-NH1 3.43Å; D288-R293 IonicContact OD1-NH2 2.75Å; D288-R293 PolarHBondContact OD1-NH2 2.88Å; D288-R293 VanDerWaalsContact OD1-NH2 3.11Å; D288-R293 IonicContact OD2-CZ 3.28Å; D288-R293 IonicContact OD2-NH1 2.63Å; D288-R293 PolarHBondContact OD2-NH1 3.06Å; D288-R293 IonicContact OD2-NH2 3.39Å; D288-R293 PolarHBondContact OD2-NH2 3.02Å; D288-L298 HydrophobicContact CB-CD2 4.29Å; D288-Q301 PolarHBondContact OD2-NE2 3.03Å; D288-R302 HydrophobicContact CB-CG 4.45Å; D288-R302 VanDerWaalsContact O-CD 3.28Å; D288-R302 WeakPolarHBondContact O-CD 3.36Å; D288-R302 PolarHBondContact O-NH1 2.82Å
289	S	93	Very high	95.1	Very high	99 Å²	99	73.5 Å²	73.5	69%	0.692	39%	0.387	S	S	*	.			trans	-126.9	15.2	-177.1	59.7	0	0	0	0	112.9	T287 K291	T287-S289 PolarHBondContact O-N 2.84Å; S289-K291 PolarHBondContact O-N 3.25Å
290	S	91.7	Very high	95	Very high	39 Å²	39	73.8 Å²	73.8	27%	0.273	39%	0.386	S	S	.	.			trans	-58.9	119.5	-176.5	-177.3	0	0	0	0	112.7	D288 S292 R293 L298	D288-S290 WeakPolarHBondContact OD1-CB 3.3Å; D288-S290 PolarHBondContact OD1-N 3.45Å; S290-S292 PolarHBondContact O-N 3.22Å; S290-S292 PolarHBondContact OG-OG 3.35Å; S290-S292 VanDerWaalsContact OG-OG 3.06Å; S290-R293 PolarHBondContact O-N 3.2Å; S290-L298 WeakPolarHBondContact O-CD1 3.44Å
291	K	90.5	Very high	94.9	Very high	212 Å²	212	68.5 Å²	68.5	92%	0.922	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-13	179.7	-64.7	-178.7	-179.4	176.5	0	113.8	S289 R293	S289-K291 PolarHBondContact O-N 3.25Å; K291-R293 VanDerWaalsContact C-N 3.31Å
292	S	89.8	Confident	94.8	Very high	107 Å²	107	72 Å²	72	75%	0.748	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-9.5	179.8	69.4	0	0	0	0	113.4	S290	S290-S292 PolarHBondContact O-N 3.22Å; S290-S292 PolarHBondContact OG-OG 3.35Å; S290-S292 VanDerWaalsContact OG-OG 3.06Å
293	R	89.9	Confident	94.7	Very high	57 Å²	57	74.6 Å²	74.6	22%	0.215	39%	0.39	C	S	.	.	S	Bend	trans	-105	150.1	-179.9	-80.6	-177	-96.2	134.2	-3.4	112.1	R248 D288 S290 K291 L298	R248-R293 VanDerWaalsContact NH2-CD 3.32Å; D288-R293 IonicContact OD1-CZ 3.1Å; D288-R293 IonicContact OD1-NH1 3.68Å; D288-R293 PolarHBondContact OD1-NH1 3.43Å; D288-R293 IonicContact OD1-NH2 2.75Å; D288-R293 PolarHBondContact OD1-NH2 2.88Å; D288-R293 VanDerWaalsContact OD1-NH2 3.11Å; D288-R293 IonicContact OD2-CZ 3.28Å; D288-R293 IonicContact OD2-NH1 2.63Å; D288-R293 PolarHBondContact OD2-NH1 3.06Å; D288-R293 IonicContact OD2-NH2 3.39Å; D288-R293 PolarHBondContact OD2-NH2 3.02Å; S290-R293 PolarHBondContact O-N 3.2Å; K291-R293 VanDerWaalsContact C-N 3.31Å; R293-L298 HydrophobicContact CB-CD1 4.48Å; R293-L298 HydrophobicContact CB-CD2 4.03Å; R293-L298 HydrophobicContact CB-CG 3.98Å
294	S	93.3	Very high	94.6	Very high	56 Å²	56	74.2 Å²	74.2	39%	0.392	38%	0.384	S	S	.	.			trans	-63.8	151.9	-179.5	84.4	0	0	0	0	110.9	N296 D297 L298	S294-N296 VanDerWaalsContact C-N 3.27Å; S294-N296 PolarHBondContact O-N 3.04Å; S294-D297 WeakPolarHBondContact CB-OD2 3.44Å; S294-D297 PolarHBondContact O-N 3.01Å; S294-D297 VanDerWaalsContact OG-CB 3.27Å; S294-D297 WeakPolarHBondContact OG-CB 3.36Å; S294-D297 PolarHBondContact OG-N 3.31Å; S294-D297 VanDerWaalsContact OG-N 3.11Å; S294-D297 PolarHBondContact OG-OD2 2.75Å; S294-L298 WeakPolarHBondContact O-CG 3.41Å; S294-L298 PolarHBondContact O-N 3.04Å
295	K	94.1	Very high	94.6	Very high	183 Å²	183	69.6 Å²	69.6	80%	0.796	36%	0.362	S	S	*	.	H	α-helix	trans	-61.2	-37.9	178.8	-69.2	-177.1	-179.4	177.7	0	112.1	K299	K295-K299 WeakPolarHBondContact O-CB 3.12Å; K295-K299 PolarHBondContact O-N 3.19Å
296	N	95	Very high	94.5	Very high	127 Å²	127	75.5 Å²	75.5	68%	0.679	38%	0.383	S	S	*	.	H	α-helix	trans	-65.7	-46.5	178.6	-69.2	-3.6	0	0	0	110.5	S294 L298 K299 K300	S294-N296 VanDerWaalsContact C-N 3.27Å; S294-N296 PolarHBondContact O-N 3.04Å; N296-L298 PolarHBondContact O-N 2.8Å; N296-K299 WeakPolarHBondContact O-CB 3.06Å; N296-K299 PolarHBondContact O-N 3.11Å; N296-K299 VanDerWaalsContact O-N 3.15Å; N296-K300 WeakPolarHBondContact O-CB 3.5Å; N296-K300 PolarHBondContact O-N 2.87Å
297	D	95	Very high	94.4	Very high	61 Å²	61	77 Å²	77	33%	0.326	39%	0.388	S	S	.	.	H	α-helix	trans	-60.1	-45.3	176.3	-72.6	-32.6	0	0	0	112.6	V245 S294 K299 K300 Q301	V245-D297 HydrophobicContact CB-CB 4.45Å; V245-D297 HydrophobicContact CG1-CB 4.45Å; V245-D297 HydrophobicContact CG2-CB 3.63Å; S294-D297 WeakPolarHBondContact CB-OD2 3.44Å; S294-D297 PolarHBondContact O-N 3.01Å; S294-D297 VanDerWaalsContact OG-CB 3.27Å; S294-D297 WeakPolarHBondContact OG-CB 3.36Å; S294-D297 PolarHBondContact OG-N 3.31Å; S294-D297 VanDerWaalsContact OG-N 3.11Å; S294-D297 PolarHBondContact OG-OD2 2.75Å; D297-K299 VanDerWaalsContact C-N 3.29Å; D297-K299 PolarHBondContact O-N 3.06Å; D297-K300 PolarHBondContact O-N 3.06Å; D297-Q301 WeakPolarHBondContact O-CB 3.36Å; D297-Q301 PolarHBondContact O-N 3.35Å
298	L	94.9	Very high	94.5	Very high	15 Å²	15	72 Å²	72	8%	0.079	36%	0.358	C	S	.	.	H	α-helix	trans	-64	-35	176.9	-71.2	170.2	0	0	0	111.9	D288 S290 R293 S294 N296 R302	D288-L298 HydrophobicContact CB-CD2 4.29Å; S290-L298 WeakPolarHBondContact O-CD1 3.44Å; R293-L298 HydrophobicContact CB-CD1 4.48Å; R293-L298 HydrophobicContact CB-CD2 4.03Å; R293-L298 HydrophobicContact CB-CG 3.98Å; S294-L298 WeakPolarHBondContact O-CG 3.41Å; S294-L298 PolarHBondContact O-N 3.04Å; N296-L298 PolarHBondContact O-N 2.8Å; L298-R302 VanDerWaalsContact O-CB 3.27Å; L298-R302 WeakPolarHBondContact O-CB 3.47Å; L298-R302 WeakPolarHBondContact O-CG 3.34Å; L298-R302 PolarHBondContact O-N 3.13Å; L298-R302 VanDerWaalsContact O-N 3.1Å; L298-R302 PolarHBondContact O-NE 2.9Å
299	K	96.1	Very high	94.6	Very high	154 Å²	154	72.7 Å²	72.7	67%	0.67	36%	0.363	S	S	*	.	H	α-helix	trans	-67.6	-51.4	176.4	-176	-174.6	175.2	-168.4	0	110.4	K295 N296 D297 R302 H303	K295-K299 WeakPolarHBondContact O-CB 3.12Å; K295-K299 PolarHBondContact O-N 3.19Å; N296-K299 WeakPolarHBondContact O-CB 3.06Å; N296-K299 PolarHBondContact O-N 3.11Å; N296-K299 VanDerWaalsContact O-N 3.15Å; D297-K299 VanDerWaalsContact C-N 3.29Å; D297-K299 PolarHBondContact O-N 3.06Å; K299-R302 PolarHBondContact O-N 3.14Å; K299-H303 WeakPolarHBondContact O-CB 3.39Å; K299-H303 PolarHBondContact O-N 3.41Å
300	K	95.1	Very high	94.7	Very high	47 Å²	47	71.4 Å²	71.4	20%	0.204	35%	0.346	C	S	.	.	H	α-helix	trans	-57.6	-52.8	178.4	-179.3	178.5	-176.6	-177.7	0	111.2	L19 N246 I249 N296 D297 H303 S304	L19-K300 HydrophobicContact CD1-CB 4.15Å; L19-K300 HydrophobicContact CD1-CD 4.46Å; L19-K300 HydrophobicContact CD1-CG 3.85Å; N246-K300 PolarHBondContact OD1-NZ 3.38Å; I249-K300 HydrophobicContact CD1-CD 4Å; I249-K300 HydrophobicContact CD1-CG 3.74Å; N296-K300 WeakPolarHBondContact O-CB 3.5Å; N296-K300 PolarHBondContact O-N 2.87Å; D297-K300 PolarHBondContact O-N 3.06Å; K300-H303 PolarHBondContact O-N 3.19Å; K300-S304 PolarHBondContact O-N 3.26Å; K300-S304 PolarHBondContact O-OG 2.61Å
301	Q	96.3	Very high	94.9	Very high	0 Å²	0	70 Å²	70	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-56	-57.1	178	-174.1	-178.3	-69.4	0	0	111.6	V245 L285 D288 D297 H303 S304 F305	V245-Q301 HydrophobicContact CG1-CB 4.01Å; L285-Q301 HydrophobicContact CB-CG 4.47Å; L285-Q301 PolarHBondContact O-NE2 2.68Å; D288-Q301 PolarHBondContact OD2-NE2 3.03Å; D297-Q301 WeakPolarHBondContact O-CB 3.36Å; D297-Q301 PolarHBondContact O-N 3.35Å; Q301-H303 PolarHBondContact O-N 3.38Å; Q301-S304 PolarHBondContact O-N 3.33Å; Q301-F305 HydrophobicContact CB-CD2 4.45Å; Q301-F305 HydrophobicContact CG-CD2 3.38Å; Q301-F305 HydrophobicContact CG-CE2 3.63Å; Q301-F305 VanDerWaalsContact O-CD2 3.27Å; Q301-F305 WeakPolarHBondContact O-CD2 3.44Å; Q301-F305 PolarHBondContact O-N 3.23Å
302	R	97.4	Very high	95.2	Very high	82 Å²	82	59.9 Å²	59.9	31%	0.309	29%	0.292	S	S	.	.	H	α-helix	trans	-60.6	-34	-175.8	-72.3	-177	-77.5	-164.4	2.1	112.4	A286 D288 L298 K299 R306	A286-R302 WeakPolarHBondContact O-CB 3.26Å; A286-R302 VanDerWaalsContact O-CG 3.3Å; A286-R302 WeakPolarHBondContact O-CG 3.36Å; D288-R302 HydrophobicContact CB-CG 4.45Å; D288-R302 VanDerWaalsContact O-CD 3.28Å; D288-R302 WeakPolarHBondContact O-CD 3.36Å; D288-R302 PolarHBondContact O-NH1 2.82Å; L298-R302 VanDerWaalsContact O-CB 3.27Å; L298-R302 WeakPolarHBondContact O-CB 3.47Å; L298-R302 WeakPolarHBondContact O-CG 3.34Å; L298-R302 PolarHBondContact O-N 3.13Å; L298-R302 VanDerWaalsContact O-N 3.1Å; L298-R302 PolarHBondContact O-NE 2.9Å; K299-R302 PolarHBondContact O-N 3.14Å; R302-R306 VanDerWaalsContact O-CG 3.3Å; R302-R306 WeakPolarHBondContact O-CG 3.36Å; R302-R306 PolarHBondContact O-N 2.88Å; R302-R306 PolarHBondContact O-NH1 3.42Å; R302-R306 VanDerWaalsContact O-NH1 3.11Å
303	H	94.9	Very high	95.5	Very high	54 Å²	54	56.9 Å²	56.9	25%	0.25	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-56.4	174.3	176.9	34.5	0	0	0	111.5	K299 K300 Q301 F305 R306 E307	K299-H303 WeakPolarHBondContact O-CB 3.39Å; K299-H303 PolarHBondContact O-N 3.41Å; K300-H303 PolarHBondContact O-N 3.19Å; Q301-H303 PolarHBondContact O-N 3.38Å; H303-F305 PolarHBondContact O-N 2.87Å; H303-R306 PolarHBondContact O-N 3.3Å; H303-E307 IonicContact CE1-OE1 3.24Å; H303-E307 PolarHBondContact CE1-OE1 3.43Å; H303-E307 IonicContact ND1-OE1 2.77Å
304	S	95.9	Very high	95.7	Very high	19 Å²	19	59.8 Å²	59.8	13%	0.133	29%	0.285	C	S	.	.	H	α-helix	trans	-57.8	-46.7	179.5	-56.7	0	0	0	0	111.9	K300 Q301 R306 E307 L308	K300-S304 PolarHBondContact O-N 3.26Å; K300-S304 PolarHBondContact O-OG 2.61Å; Q301-S304 PolarHBondContact O-N 3.33Å; S304-R306 VanDerWaalsContact C-N 3.33Å; S304-R306 PolarHBondContact O-N 3.11Å; S304-E307 PolarHBondContact O-N 3.34Å; S304-L308 VanDerWaalsContact O-CG 3.3Å; S304-L308 WeakPolarHBondContact O-CG 3.48Å; S304-L308 PolarHBondContact O-N 3.39Å
305	F	97.6	Very high	95.6	Very high	0 Å²	0	61 Å²	61	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-71.6	-23.1	-175.6	-80	-79.7	0	0	0	114.2	L240 R248 I249 L282 L285 A286 Q301 H303 L308 V309	L240-F305 HydrophobicContact CD2-CE1 3.61Å; L240-F305 HydrophobicContact CD2-CZ 3.75Å; R248-F305 HydrophobicContact CB-CE2 4.18Å; R248-F305 HydrophobicContact CB-CZ 4Å; R248-F305 WeakPolarHBondContact O-CZ 3.28Å; I249-F305 HydrophobicContact CG1-CE2 4.04Å; L282-F305 HydrophobicContact CB-CD1 4.39Å; L282-F305 HydrophobicContact CD2-CD1 3.59Å; L282-F305 HydrophobicContact CD2-CE1 3.48Å; L282-F305 VanDerWaalsContact CD2-CE1 3.48Å; L285-F305 HydrophobicContact CB-CB 4.12Å; L285-F305 HydrophobicContact CB-CD1 3.7Å; L285-F305 HydrophobicContact CB-CD2 3.72Å; L285-F305 HydrophobicContact CB-CE1 4.01Å; L285-F305 HydrophobicContact CB-CE2 4.01Å; L285-F305 HydrophobicContact CB-CG 3.54Å; L285-F305 HydrophobicContact CB-CZ 4.14Å; L285-F305 HydrophobicContact CD1-CD1 4.01Å; L285-F305 HydrophobicContact CD1-CD2 4.49Å; L285-F305 HydrophobicContact CD1-CE1 3.44Å; L285-F305 VanDerWaalsContact CD1-CE1 3.44Å; L285-F305 HydrophobicContact CD1-CE2 3.97Å; L285-F305 HydrophobicContact CD1-CZ 3.4Å; L285-F305 VanDerWaalsContact CD1-CZ 3.4Å; L285-F305 HydrophobicContact CG-CE1 4.37Å; L285-F305 HydrophobicContact CG-CZ 4.35Å; A286-F305 HydrophobicContact CB-CB 3.87Å; Q301-F305 HydrophobicContact CB-CD2 4.45Å; Q301-F305 HydrophobicContact CG-CD2 3.38Å; Q301-F305 HydrophobicContact CG-CE2 3.63Å; Q301-F305 VanDerWaalsContact O-CD2 3.27Å; Q301-F305 WeakPolarHBondContact O-CD2 3.44Å; Q301-F305 PolarHBondContact O-N 3.23Å; H303-F305 PolarHBondContact O-N 2.87Å; F305-L308 HydrophobicContact CD1-CD1 4.11Å; F305-L308 HydrophobicContact CE1-CD1 4.18Å; F305-V309 WeakPolarHBondContact O-CB 3.14Å; F305-V309 WeakPolarHBondContact O-CG2 3.23Å; F305-V309 PolarHBondContact O-N 2.64Å
306	R	96.4	Very high	95.5	Very high	136 Å²	136	56.8 Å²	56.8	51%	0.513	28%	0.28	S	S	.	.	H	α-helix	trans	-64.9	-41.9	170.3	-80.7	-170.4	-54.8	-87.8	2.2	111.7	A286 R302 H303 S304 E310	A286-R306 HydrophobicContact CB-CG 4.12Å; R302-R306 VanDerWaalsContact O-CG 3.3Å; R302-R306 WeakPolarHBondContact O-CG 3.36Å; R302-R306 PolarHBondContact O-N 2.88Å; R302-R306 PolarHBondContact O-NH1 3.42Å; R302-R306 VanDerWaalsContact O-NH1 3.11Å; H303-R306 PolarHBondContact O-N 3.3Å; S304-R306 VanDerWaalsContact C-N 3.33Å; S304-R306 PolarHBondContact O-N 3.11Å; R306-E310 PolarHBondContact O-N 2.64Å
307	E	95.3	Very high	95.2	Very high	41 Å²	41	51.6 Å²	51.6	19%	0.192	25%	0.251	C	S	.	.	H	α-helix	trans	-69.8	-41.5	178.4	-53.9	-175.1	161.3	0	0	111	H303 S304 V309 E310 A311 Y317 P318	H303-E307 IonicContact CE1-OE1 3.24Å; H303-E307 PolarHBondContact CE1-OE1 3.43Å; H303-E307 IonicContact ND1-OE1 2.77Å; S304-E307 PolarHBondContact O-N 3.34Å; E307-V309 VanDerWaalsContact C-N 3.35Å; E307-V309 PolarHBondContact O-N 2.97Å; E307-E310 WeakPolarHBondContact O-CB 3.37Å; E307-E310 PolarHBondContact O-N 3.3Å; E307-A311 WeakPolarHBondContact O-CB 3.25Å; E307-A311 PolarHBondContact O-N 3.47Å; E307-Y317 HydrophobicContact CB-CE2 4.46Å; E307-Y317 PolarHBondContact OE2-OH 2.64Å; E307-Y317 VanDerWaalsContact OE2-OH 3.14Å; E307-P318 HydrophobicContact CB-CG 3.99Å; E307-P318 HydrophobicContact CG-CG 3.74Å
308	L	97	Very high	94.9	Very high	3 Å²	3	51 Å²	51	2%	0.016	25%	0.25	C	S	.	.	H	α-helix	trans	-66.6	-33.1	178.3	-63.9	170.8	0	0	0	113.2	E253 A256 S304 F305 V312	E253-L308 HydrophobicContact CG-CD2 4.31Å; A256-L308 HydrophobicContact CB-CD2 3.62Å; S304-L308 VanDerWaalsContact O-CG 3.3Å; S304-L308 WeakPolarHBondContact O-CG 3.48Å; S304-L308 PolarHBondContact O-N 3.39Å; F305-L308 HydrophobicContact CD1-CD1 4.11Å; F305-L308 HydrophobicContact CE1-CD1 4.18Å; L308-V312 WeakPolarHBondContact O-CB 3.48Å; L308-V312 WeakPolarHBondContact O-CG2 3.33Å; L308-V312 PolarHBondContact O-N 3.15Å
309	V	97.1	Very high	94.8	Very high	35 Å²	35	56.7 Å²	56.7	21%	0.212	28%	0.277	C	S	.	.	H	α-helix	trans	-62.6	-47.6	172	168.2	0	0	0	0	110.1	L282 A286 F305 E307 A311 V312 V313	L282-V309 HydrophobicContact CB-CG2 3.55Å; A286-V309 HydrophobicContact CB-CG2 4.27Å; F305-V309 WeakPolarHBondContact O-CB 3.14Å; F305-V309 WeakPolarHBondContact O-CG2 3.23Å; F305-V309 PolarHBondContact O-N 2.64Å; E307-V309 VanDerWaalsContact C-N 3.35Å; E307-V309 PolarHBondContact O-N 2.97Å; V309-A311 VanDerWaalsContact C-N 3.34Å; V309-A311 PolarHBondContact O-N 3.45Å; V309-V312 PolarHBondContact O-N 3.37Å; V309-V313 HydrophobicContact CG1-CG2 4.15Å; V309-V313 VanDerWaalsContact O-CB 3.29Å; V309-V313 WeakPolarHBondContact O-CB 3.5Å; V309-V313 VanDerWaalsContact O-CG2 3.27Å; V309-V313 WeakPolarHBondContact O-CG2 3.47Å; V309-V313 PolarHBondContact O-N 3.45Å
310	E	95.3	Very high	94.6	Very high	72 Å²	72	50.5 Å²	50.5	34%	0.336	25%	0.251	S	S	.	.	H	α-helix	trans	-58.8	-47.8	178.3	-165	62	-148.2	0	0	110.9	R306 E307 V312 V313 H314 D316	R306-E310 PolarHBondContact O-N 2.64Å; E307-E310 WeakPolarHBondContact O-CB 3.37Å; E307-E310 PolarHBondContact O-N 3.3Å; E310-V312 PolarHBondContact O-N 3.07Å; E310-V313 PolarHBondContact O-N 2.92Å; E310-H314 VanDerWaalsContact CD-CD2 3.4Å; E310-H314 WeakPolarHBondContact O-CA 3.47Å; E310-H314 WeakPolarHBondContact O-CB 3.4Å; E310-H314 PolarHBondContact O-N 3.05Å; E310-H314 VanDerWaalsContact OE1-CB 3.26Å; E310-H314 WeakPolarHBondContact OE1-CB 3.23Å; E310-H314 IonicContact OE1-CD2 3.83Å; E310-H314 PolarHBondContact OE1-CD2 3.27Å; E310-H314 IonicContact OE1-CG 3.69Å; E310-H314 VanDerWaalsContact OE1-CG 3.24Å; E310-H314 IonicContact OE2-CD2 2.86Å; E310-H314 PolarHBondContact OE2-CD2 3.41Å; E310-D316 CarbonylContact C-O 3.55Å; E310-D316 VanDerWaalsContact C-O 3.24Å; E310-D316 HydrophobicContact CG-CB 4.31Å
311	A	96.2	Very high	94.6	Very high	8 Å²	8	49.9 Å²	49.9	7%	0.066	25%	0.253	C	S	.	.	H	α-helix	trans	-57	-47.6	178.6	0	0	0	0	0	113.2	A256 E307 V309 S315 D316 Y317	A256-A311 HydrophobicContact CB-CB 4.36Å; E307-A311 WeakPolarHBondContact O-CB 3.25Å; E307-A311 PolarHBondContact O-N 3.47Å; V309-A311 VanDerWaalsContact C-N 3.34Å; V309-A311 PolarHBondContact O-N 3.45Å; A311-S315 VanDerWaalsContact O-CA 3.24Å; A311-S315 WeakPolarHBondContact O-CA 3.18Å; A311-S315 PolarHBondContact O-N 2.96Å; A311-S315 VanDerWaalsContact O-N 3.16Å; A311-D316 WeakPolarHBondContact CA-O 3.47Å; A311-D316 PolarHBondContact N-O 2.92Å; A311-Y317 HydrophobicContact CB-CD2 3.73Å; A311-Y317 HydrophobicContact CB-CE2 4.36Å
312	V	96.8	Very high	94.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-78.1	-35.1	-176.3	174	0	0	0	0	112.1	A256 Y259 R263 Y275 L278 V279 L282 L308 V309 E310	A256-V312 HydrophobicContact CB-CG2 4.12Å; Y259-V312 HydrophobicContact CG-CG1 4.46Å; R263-V312 VanDerWaalsContact CZ-O 3.31Å; R263-V312 PolarHBondContact NH1-O 3.37Å; R263-V312 PolarHBondContact NH2-O 2.96Å; Y275-V312 HydrophobicContact CE2-CG1 4.13Å; L278-V312 HydrophobicContact CD2-CG1 3.9Å; L278-V312 HydrophobicContact CD2-CG2 4.48Å; L278-V312 HydrophobicContact CG-CG1 4.44Å; V279-V312 HydrophobicContact CG2-CG1 4.24Å; L282-V312 HydrophobicContact CD1-CB 3.99Å; L282-V312 HydrophobicContact CD1-CG1 4.32Å; L282-V312 HydrophobicContact CD1-CG2 3.8Å; L308-V312 WeakPolarHBondContact O-CB 3.48Å; L308-V312 WeakPolarHBondContact O-CG2 3.33Å; L308-V312 PolarHBondContact O-N 3.15Å; V309-V312 PolarHBondContact O-N 3.37Å; E310-V312 PolarHBondContact O-N 3.07Å
313	V	96.3	Very high	94.2	Very high	45 Å²	45	50.1 Å²	50.1	27%	0.273	26%	0.261	S	S	.	.	H	α-helix	trans	-84.1	-45.1	-175.9	178.5	0	0	0	0	112	V279 V309 E310	V279-V313 HydrophobicContact CB-CG2 4.48Å; V279-V313 HydrophobicContact CG1-CG2 3.8Å; V279-V313 HydrophobicContact CG2-CG2 3.85Å; V309-V313 HydrophobicContact CG1-CG2 4.15Å; V309-V313 VanDerWaalsContact O-CB 3.29Å; V309-V313 WeakPolarHBondContact O-CB 3.5Å; V309-V313 VanDerWaalsContact O-CG2 3.27Å; V309-V313 WeakPolarHBondContact O-CG2 3.47Å; V309-V313 PolarHBondContact O-N 3.45Å; E310-V313 PolarHBondContact O-N 2.92Å
314	H	93.5	Very high	93.9	Very high	118 Å²	118	47.9 Å²	47.9	55%	0.546	25%	0.25	S	S	.	.	H	α-helix	trans	-107.9	-4.9	-170	-61.9	-71.3	0	0	0	113.7	E310 D316	E310-H314 VanDerWaalsContact CD-CD2 3.4Å; E310-H314 WeakPolarHBondContact O-CA 3.47Å; E310-H314 WeakPolarHBondContact O-CB 3.4Å; E310-H314 PolarHBondContact O-N 3.05Å; E310-H314 VanDerWaalsContact OE1-CB 3.26Å; E310-H314 WeakPolarHBondContact OE1-CB 3.23Å; E310-H314 IonicContact OE1-CD2 3.83Å; E310-H314 PolarHBondContact OE1-CD2 3.27Å; E310-H314 IonicContact OE1-CG 3.69Å; E310-H314 VanDerWaalsContact OE1-CG 3.24Å; E310-H314 IonicContact OE2-CD2 2.86Å; E310-H314 PolarHBondContact OE2-CD2 3.41Å; H314-D316 HydrophobicContact CB-CB 4.39Å; H314-D316 PolarHBondContact O-N 3.24Å
315	S	92.4	Very high	93.3	Very high	81 Å²	81	49.9 Å²	49.9	57%	0.566	27%	0.274	S	S	*	.	S	Bend	trans	55.6	33.6	-172.4	-57.7	0	0	0	0	112	R263 A311	R263-S315 WeakPolarHBondContact CD-OG 3.46Å; R263-S315 PolarHBondContact NH1-OG 3.22Å; A311-S315 VanDerWaalsContact O-CA 3.24Å; A311-S315 WeakPolarHBondContact O-CA 3.18Å; A311-S315 PolarHBondContact O-N 2.96Å; A311-S315 VanDerWaalsContact O-N 3.16Å
316	D	90.3	Very high	92.6	Very high	94 Å²	94	55.4 Å²	55.4	50%	0.503	31%	0.307	S	S	.	.			trans	-125.4	139	179	-170.6	18.8	0	0	0	109.7	E310 A311 H314	E310-D316 CarbonylContact C-O 3.55Å; E310-D316 VanDerWaalsContact C-O 3.24Å; E310-D316 HydrophobicContact CG-CB 4.31Å; A311-D316 WeakPolarHBondContact CA-O 3.47Å; A311-D316 PolarHBondContact N-O 2.92Å; H314-D316 HydrophobicContact CB-CB 4.39Å; H314-D316 PolarHBondContact O-N 3.24Å
317	Y	89.8	Confident	92.3	Very high	18 Å²	18	51.1 Å²	51.1	7%	0.071	29%	0.293	C	S	.	.			trans	-129.7	130.3	179.7	-160.6	-73.1	0	0	0	109	E307 A311 E319 C334 H337	E307-Y317 HydrophobicContact CB-CE2 4.46Å; E307-Y317 PolarHBondContact OE2-OH 2.64Å; E307-Y317 VanDerWaalsContact OE2-OH 3.14Å; A311-Y317 HydrophobicContact CB-CD2 3.73Å; A311-Y317 HydrophobicContact CB-CE2 4.36Å; Y317-E319 PolarHBondContact O-N 2.86Å; Y317-C334 HydrophobicContact CD2-CB 4.29Å; Y317-C334 VanDerWaalsContact CD2-SG 3.51Å; Y317-H337 AromaticContact CD1-CE1 3.18Å; Y317-H337 WeakPolarHBondContact CD1-CE1 3.15Å; Y317-H337 AromaticContact CD1-ND1 3.24Å; Y317-H337 WeakPolarHBondContact CD1-ND1 3.47Å; Y317-H337 AromaticContact CD1-NE2 3.94Å; Y317-H337 HydrophobicContact CE1-CB 4.17Å; Y317-H337 AromaticContact CE1-CD2 3.59Å; Y317-H337 AromaticContact CE1-CE1 3.15Å; Y317-H337 WeakPolarHBondContact CE1-CE1 3.18Å; Y317-H337 AromaticContact CE1-CG 3.39Å; Y317-H337 AromaticContact CE1-ND1 3.11Å; Y317-H337 WeakPolarHBondContact CE1-ND1 3.11Å; Y317-H337 AromaticContact CE1-NE2 3.47Å; Y317-H337 WeakPolarHBondContact CE1-NE2 3.24Å; Y317-H337 AromaticContact CZ-CG 3.82Å; Y317-H337 AromaticContact CZ-ND1 3.88Å
318	P	87.8	Confident	92.1	Very high	49 Å²	49	52.4 Å²	52.4	32%	0.318	30%	0.304	S	S	.	.			trans	-57.8	132.5	-176.9	23.3	-34.8	0	0	0	112.1	E307 T320 H337	E307-P318 HydrophobicContact CB-CG 3.99Å; E307-P318 HydrophobicContact CG-CG 3.74Å; P318-T320 PolarHBondContact O-N 2.77Å; P318-H337 PolarHBondContact O-CE1 3.46Å
319	E	92.4	Very high	92	Very high	135 Å²	135	52.5 Å²	52.5	63%	0.631	30%	0.304	S	S	*	.			trans	-69.2	124.3	177.2	-168.9	-177.5	111.3	0	0	111.1	Y317 T330 L331	Y317-E319 PolarHBondContact O-N 2.86Å; E319-T330 HydrophobicContact CG-CG2 3.31Å; E319-T330 WeakPolarHBondContact OE1-CG2 3.4Å; E319-L331 CarbonylContact C-O 3.24Å; E319-L331 VanDerWaalsContact CA-O 3.3Å; E319-L331 WeakPolarHBondContact CA-O 3.34Å
320	T	93	Very high	92	Very high	23 Å²	23	54 Å²	54	14%	0.141	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122.6	174.8	-58.9	0	0	0	0	110.2	P318 I322 L331 H337	P318-T320 PolarHBondContact O-N 2.77Å; T320-I322 HydrophobicContact CG2-CG1 4.39Å; T320-L331 PolarHBondContact N-O 2.99Å; T320-L331 PolarHBondContact O-N 2.84Å; T320-H337 WeakPolarHBondContact CB-NE2 3.36Å; T320-H337 PolarHBondContact OG1-NE2 3.33Å; T320-H337 VanDerWaalsContact OG1-NE2 3.09Å
321	S	94.1	Very high	92	Very high	34 Å²	34	50.8 Å²	50.8	24%	0.238	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	124.8	175.3	-68.7	0	0	0	0	111.6	L329	S321-L329 CarbonylContact C-O 3.56Å; S321-L329 WeakPolarHBondContact CA-O 3.38Å
322	I	93.6	Very high	91.9	Very high	7 Å²	7	54 Å²	54	4%	0.036	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	112.8	177.5	-65.2	142	0	0	0	109.4	T320 V328 L329 L331 Y340	T320-I322 HydrophobicContact CG2-CG1 4.39Å; I322-V328 WeakPolarHBondContact O-CA 3.35Å; I322-L329 HydrophobicContact CB-CB 4.29Å; I322-L329 HydrophobicContact CD1-CD2 4.28Å; I322-L329 PolarHBondContact N-O 2.99Å; I322-L329 PolarHBondContact O-N 3.25Å; I322-L331 HydrophobicContact CD1-CD1 3.4Å; I322-L331 VanDerWaalsContact CD1-CD1 3.4Å; I322-L331 HydrophobicContact CD1-CG 3.96Å; I322-Y340 HydrophobicContact CD1-CD1 4.01Å; I322-Y340 HydrophobicContact CD1-CD2 3.66Å; I322-Y340 HydrophobicContact CD1-CE1 3.77Å; I322-Y340 HydrophobicContact CD1-CE2 3.42Å; I322-Y340 VanDerWaalsContact CD1-CE2 3.42Å; I322-Y340 HydrophobicContact CD1-CG 3.95Å; I322-Y340 VanDerWaalsContact CD1-CZ 3.46Å; I322-Y340 HydrophobicContact CG1-CE1 4.47Å; I322-Y340 HydrophobicContact CG1-CE2 4.2Å; I322-Y340 HydrophobicContact CG2-CE2 4.06Å
323	N	91.9	Very high	91.8	Very high	81 Å²	81	55.8 Å²	55.8	43%	0.433	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	129	174.2	-58.6	-43.1	0	0	0	110.1	V328	N323-V328 WeakPolarHBondContact OD1-CG2 3.46Å
324	F	89.6	Confident	91.8	Very high	6 Å²	6	54 Å²	54	3%	0.026	32%	0.323	C	S	.	.			trans	-129.8	26.6	179.3	61.4	-92.9	0	0	0	113.6	E327 L329 R352 L355 R356 L367	F324-E327 HydrophobicContact CD2-CB 4.3Å; F324-E327 HydrophobicContact CE1-CB 3.95Å; F324-E327 HydrophobicContact CE2-CB 3.55Å; F324-E327 HydrophobicContact CE2-CG 4.32Å; F324-E327 WeakPolarHBondContact CE2-OE2 3.16Å; F324-E327 HydrophobicContact CZ-CB 3.33Å; F324-E327 HydrophobicContact CZ-CG 4.32Å; F324-E327 PolarHBondContact N-O 3.28Å; F324-E327 VanDerWaalsContact N-O 3.15Å; F324-L329 HydrophobicContact CD1-CB 3.99Å; F324-L329 HydrophobicContact CE1-CB 3.68Å; F324-R352 HydrophobicContact CB-CB 4.26Å; F324-R352 HydrophobicContact CB-CG 4.35Å; F324-L355 HydrophobicContact CB-CB 4.39Å; F324-L355 HydrophobicContact CB-CD1 4.34Å; F324-L355 HydrophobicContact CD1-CB 4.35Å; F324-L355 HydrophobicContact CD1-CD1 4.23Å; F324-L355 HydrophobicContact CD2-CB 3.81Å; F324-L355 HydrophobicContact CE2-CB 4.08Å; F324-L355 HydrophobicContact CG-CB 3.94Å; F324-L355 HydrophobicContact CG-CD1 4.28Å; F324-L355 HydrophobicContact CZ-CB 4.47Å; F324-R356 HydrophobicContact CD2-CG 3.66Å; F324-R356 HydrophobicContact CE2-CG 4.18Å; F324-R356 WeakPolarHBondContact O-CD 3.07Å; F324-R356 WeakPolarHBondContact O-CG 3.24Å; F324-R356 PolarHBondContact O-NE 2.73Å; F324-L367 HydrophobicContact CE1-CD1 4.23Å; F324-L367 HydrophobicContact CE1-CD2 4.38Å; F324-L367 HydrophobicContact CZ-CD1 3.83Å; F324-L367 HydrophobicContact CZ-CD2 4.16Å
325	G	82.9	Confident	92	Very high	62 Å²	62	49.7 Å²	49.7	64%	0.639	31%	0.305	S	S	*	.	S	Bend	trans	138.8	-117.3	179.6	0	0	0	0	0	109.4
326	V	82.8	Confident	92.2	Very high	115 Å²	115	46.3 Å²	46.3	70%	0.697	28%	0.282	S	S	*	.	S	Bend	trans	-86.8	-15.3	172.5	-62.6	0	0	0	0	113
327	E	89.4	Confident	92.5	Very high	46 Å²	46	42.4 Å²	42.4	22%	0.215	26%	0.261	C	S	.	.			trans	-105.2	158.9	-179.5	-62.9	179.1	98.5	0	0	111.7	F324 R362	F324-E327 HydrophobicContact CD2-CB 4.3Å; F324-E327 HydrophobicContact CE1-CB 3.95Å; F324-E327 HydrophobicContact CE2-CB 3.55Å; F324-E327 HydrophobicContact CE2-CG 4.32Å; F324-E327 WeakPolarHBondContact CE2-OE2 3.16Å; F324-E327 HydrophobicContact CZ-CB 3.33Å; F324-E327 HydrophobicContact CZ-CG 4.32Å; F324-E327 PolarHBondContact N-O 3.28Å; F324-E327 VanDerWaalsContact N-O 3.15Å; E327-R362 IonicContact OE1-CZ 3.06Å; E327-R362 IonicContact OE1-NH1 3.86Å; E327-R362 IonicContact OE1-NH2 2.74Å; E327-R362 PolarHBondContact OE1-NH2 2.77Å; E327-R362 IonicContact OE2-CZ 3.02Å; E327-R362 IonicContact OE2-NH1 2.88Å; E327-R362 PolarHBondContact OE2-NH1 2.78Å; E327-R362 IonicContact OE2-NH2 3.18Å; E327-R362 PolarHBondContact OE2-NH2 3.28Å
328	V	91.9	Very high	92.9	Very high	68 Å²	68	41.7 Å²	41.7	41%	0.412	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	126.1	178.2	-173.3	0	0	0	0	108.7	I322 N323	I322-V328 WeakPolarHBondContact O-CA 3.35Å; N323-V328 WeakPolarHBondContact OD1-CG2 3.46Å
329	L	95.3	Very high	93.3	Very high	5 Å²	5	40.4 Å²	40.4	3%	0.026	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	117.3	171.2	170	61.1	0	0	0	107.7	S321 I322 F324 L331 Y340 L355 F365 L367	S321-L329 CarbonylContact C-O 3.56Å; S321-L329 WeakPolarHBondContact CA-O 3.38Å; I322-L329 HydrophobicContact CB-CB 4.29Å; I322-L329 HydrophobicContact CD1-CD2 4.28Å; I322-L329 PolarHBondContact N-O 2.99Å; I322-L329 PolarHBondContact O-N 3.25Å; F324-L329 HydrophobicContact CD1-CB 3.99Å; F324-L329 HydrophobicContact CE1-CB 3.68Å; L329-L331 HydrophobicContact CD1-CD2 3.92Å; L329-L331 HydrophobicContact CD2-CD2 3.9Å; L329-L331 HydrophobicContact CD2-CG 4.4Å; L329-L331 HydrophobicContact CG-CD2 3.79Å; L329-L331 HydrophobicContact CG-CG 4.16Å; L329-Y340 HydrophobicContact CD2-CD2 3.99Å; L329-Y340 HydrophobicContact CD2-CE2 4.45Å; L329-L355 HydrophobicContact CD2-CD1 4.21Å; L329-L355 HydrophobicContact CD2-CD2 3.99Å; L329-F365 HydrophobicContact CD1-CB 3.65Å; L329-F365 HydrophobicContact CD1-CD1 3.84Å; L329-F365 HydrophobicContact CD1-CG 3.81Å; L329-F365 HydrophobicContact CD2-CD1 4.06Å; L329-F365 HydrophobicContact CD2-CD2 4.25Å; L329-F365 HydrophobicContact CD2-CE1 4.17Å; L329-F365 HydrophobicContact CD2-CE2 4.36Å; L329-F365 HydrophobicContact CD2-CG 4.11Å; L329-F365 HydrophobicContact CD2-CZ 4.32Å; L329-L367 HydrophobicContact CD1-CD2 4.14Å
330	T	95.9	Very high	93.6	Very high	66 Å²	66	34.4 Å²	34.4	41%	0.405	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	114.8	174.8	-61.4	0	0	0	0	109.3	E319	E319-T330 HydrophobicContact CG-CG2 3.31Å; E319-T330 WeakPolarHBondContact OE1-CG2 3.4Å
331	L	96.2	Very high	93.7	Very high	5 Å²	5	35.8 Å²	35.8	3%	0.026	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	121	175.5	-57.5	178.4	0	0	0	109.1	E319 T320 I322 L329 H337 Y340 F365	E319-L331 CarbonylContact C-O 3.24Å; E319-L331 VanDerWaalsContact CA-O 3.3Å; E319-L331 WeakPolarHBondContact CA-O 3.34Å; T320-L331 PolarHBondContact N-O 2.99Å; T320-L331 PolarHBondContact O-N 2.84Å; I322-L331 HydrophobicContact CD1-CD1 3.4Å; I322-L331 VanDerWaalsContact CD1-CD1 3.4Å; I322-L331 HydrophobicContact CD1-CG 3.96Å; L329-L331 HydrophobicContact CD1-CD2 3.92Å; L329-L331 HydrophobicContact CD2-CD2 3.9Å; L329-L331 HydrophobicContact CD2-CG 4.4Å; L329-L331 HydrophobicContact CG-CD2 3.79Å; L329-L331 HydrophobicContact CG-CG 4.16Å; L331-H337 VanDerWaalsContact C-CE1 3.49Å; L331-H337 WeakPolarHBondContact CB-CE1 3.15Å; L331-H337 PolarHBondContact O-CE1 3.21Å; L331-Y340 HydrophobicContact CD1-CD1 4.2Å; L331-Y340 HydrophobicContact CD1-CD2 4.31Å; L331-Y340 HydrophobicContact CD1-CG 3.79Å; L331-F365 HydrophobicContact CD2-CD1 3.93Å; L331-F365 HydrophobicContact CD2-CE1 3.82Å
332	S	93.2	Very high	93.9	Very high	75 Å²	75	34.6 Å²	34.6	52%	0.524	22%	0.216	S	C	.	.			trans	-130.5	7.9	-178.4	56.3	0	0	0	0	113.7
333	S	95.5	Very high	94.1	Very high	38 Å²	38	34.5 Å²	34.5	27%	0.266	22%	0.215	S	C	.	.	S	Bend	trans	-132.6	155.9	-179	65.3	0	0	0	0	111.9	E260 T335 G336 H337	E260-S333 WeakPolarHBondContact OE2-CA 3.28Å; E260-S333 WeakPolarHBondContact OE2-CB 3.26Å; S333-T335 VanDerWaalsContact C-N 3.27Å; S333-T335 PolarHBondContact O-N 3.39Å; S333-G336 PolarHBondContact O-N 3.4Å; S333-G336 PolarHBondContact OG-N 2.95Å; S333-H337 PolarHBondContact O-N 3.3Å; S333-H337 PolarHBondContact O-ND1 3.27Å
334	C	97.1	Very high	94.4	Very high	9 Å²	9	31.1 Å²	31.1	6%	0.061	20%	0.198	C	C	.	.	H	α-helix	trans	-58.4	-44.2	173.2	-51.4	0	0	0	0	110.3	A256 V257 E260 Y317 H337 F338	A256-C334 HydrophobicContact CB-CB 4.23Å; V257-C334 HydrophobicContact CG2-CB 4.05Å; E260-C334 HydrophobicContact CB-CB 4.33Å; E260-C334 PolarHBondContact OE1-N 3.38Å; E260-C334 WeakPolarHBondContact OE2-CB 3.46Å; E260-C334 PolarHBondContact OE2-N 3.02Å; E260-C334 PolarHBondContact OE2-SG 3.46Å; Y317-C334 HydrophobicContact CD2-CB 4.29Å; Y317-C334 VanDerWaalsContact CD2-SG 3.51Å; C334-H337 PolarHBondContact O-N 2.85Å; C334-F338 VanDerWaalsContact O-CB 3.31Å; C334-F338 WeakPolarHBondContact O-CB 3.2Å; C334-F338 PolarHBondContact O-N 3.43Å
335	T	96.6	Very high	94.7	Very high	27 Å²	27	33.5 Å²	33.5	17%	0.166	22%	0.215	C	C	.	.	H	α-helix	trans	-63.3	-45.5	179.6	-59.2	0	0	0	0	111.3	T218 E260 S333 F338 Y339	T218-T335 HydrophobicContact CG2-CG2 4.08Å; E260-T335 VanDerWaalsContact OE1-CB 3.23Å; E260-T335 WeakPolarHBondContact OE1-CB 3.45Å; E260-T335 PolarHBondContact OE1-N 3.43Å; E260-T335 PolarHBondContact OE1-OG1 3.01Å; S333-T335 VanDerWaalsContact C-N 3.27Å; S333-T335 PolarHBondContact O-N 3.39Å; T335-F338 WeakPolarHBondContact O-CB 3.29Å; T335-F338 PolarHBondContact O-N 2.95Å; T335-Y339 HydrophobicContact CG2-CD2 4.11Å; T335-Y339 HydrophobicContact CG2-CE1 4.19Å; T335-Y339 HydrophobicContact CG2-CE2 3.51Å; T335-Y339 PolarHBondContact O-N 3.19Å
336	G	96.6	Very high	95.4	Very high	9 Å²	9	30.9 Å²	30.9	9%	0.093	19%	0.187	C	C	.	.	H	α-helix	trans	-62.6	-43.9	176.6	0	0	0	0	0	112.6	S333 Y339 Y340	S333-G336 PolarHBondContact O-N 3.4Å; S333-G336 PolarHBondContact OG-N 2.95Å; G336-Y339 PolarHBondContact O-N 3.37Å; G336-Y340 PolarHBondContact O-N 3.01Å
337	H	96.6	Very high	96	Very high	12 Å²	12	25.4 Å²	25.4	6%	0.056	15%	0.154	C	C	.	.	H	α-helix	trans	-64	-40.5	174.6	-75.5	89.9	0	0	0	112.4	Y317 P318 T320 L331 S333 C334 Y340 N341	Y317-H337 AromaticContact CD1-CE1 3.18Å; Y317-H337 WeakPolarHBondContact CD1-CE1 3.15Å; Y317-H337 AromaticContact CD1-ND1 3.24Å; Y317-H337 WeakPolarHBondContact CD1-ND1 3.47Å; Y317-H337 AromaticContact CD1-NE2 3.94Å; Y317-H337 HydrophobicContact CE1-CB 4.17Å; Y317-H337 AromaticContact CE1-CD2 3.59Å; Y317-H337 AromaticContact CE1-CE1 3.15Å; Y317-H337 WeakPolarHBondContact CE1-CE1 3.18Å; Y317-H337 AromaticContact CE1-CG 3.39Å; Y317-H337 AromaticContact CE1-ND1 3.11Å; Y317-H337 WeakPolarHBondContact CE1-ND1 3.11Å; Y317-H337 AromaticContact CE1-NE2 3.47Å; Y317-H337 WeakPolarHBondContact CE1-NE2 3.24Å; Y317-H337 AromaticContact CZ-CG 3.82Å; Y317-H337 AromaticContact CZ-ND1 3.88Å; P318-H337 PolarHBondContact O-CE1 3.46Å; T320-H337 WeakPolarHBondContact CB-NE2 3.36Å; T320-H337 PolarHBondContact OG1-NE2 3.33Å; T320-H337 VanDerWaalsContact OG1-NE2 3.09Å; L331-H337 VanDerWaalsContact C-CE1 3.49Å; L331-H337 WeakPolarHBondContact CB-CE1 3.15Å; L331-H337 PolarHBondContact O-CE1 3.21Å; S333-H337 PolarHBondContact O-N 3.3Å; S333-H337 PolarHBondContact O-ND1 3.27Å; C334-H337 PolarHBondContact O-N 2.85Å; H337-Y340 PolarHBondContact O-N 3.17Å; H337-N341 WeakPolarHBondContact O-CB 3.2Å; H337-N341 VanDerWaalsContact O-CG 3.32Å; H337-N341 PolarHBondContact O-N 2.95Å
338	F	97.8	Very high	96.3	Very high	4 Å²	4	24.4 Å²	24.4	2%	0.018	16%	0.156	C	C	.	.	H	α-helix	trans	-59.9	-47.9	174.7	169.2	-96.3	0	0	0	111.5	K211 T214 L215 T218 I250 V257 C334 T335 Y340 N341 F342	K211-F338 WeakPolarHBondContact O-CZ 3.41Å; T214-F338 HydrophobicContact CG2-CD1 4Å; T214-F338 HydrophobicContact CG2-CD2 3.64Å; T214-F338 HydrophobicContact CG2-CE1 3.87Å; T214-F338 HydrophobicContact CG2-CE2 3.48Å; T214-F338 VanDerWaalsContact CG2-CE2 3.48Å; T214-F338 HydrophobicContact CG2-CG 3.91Å; T214-F338 HydrophobicContact CG2-CZ 3.62Å; L215-F338 HydrophobicContact CB-CE1 4.06Å; L215-F338 HydrophobicContact CB-CZ 4.1Å; L215-F338 HydrophobicContact CD1-CE1 4.22Å; T218-F338 HydrophobicContact CG2-CD1 4.3Å; T218-F338 HydrophobicContact CG2-CE1 4.49Å; I250-F338 HydrophobicContact CD1-CD2 4.39Å; I250-F338 HydrophobicContact CD1-CE2 4.05Å; V257-F338 HydrophobicContact CG2-CB 3.99Å; V257-F338 HydrophobicContact CG2-CG 4.41Å; C334-F338 VanDerWaalsContact O-CB 3.31Å; C334-F338 WeakPolarHBondContact O-CB 3.2Å; C334-F338 PolarHBondContact O-N 3.43Å; T335-F338 WeakPolarHBondContact O-CB 3.29Å; T335-F338 PolarHBondContact O-N 2.95Å; F338-Y340 VanDerWaalsContact C-N 3.35Å; F338-Y340 PolarHBondContact O-N 3.14Å; F338-N341 PolarHBondContact O-N 3.09Å; F338-F342 HydrophobicContact CE1-CB 4.48Å; F338-F342 HydrophobicContact CZ-CB 4.34Å; F338-F342 HydrophobicContact CZ-CD2 4.02Å; F338-F342 VanDerWaalsContact O-CB 3.3Å; F338-F342 WeakPolarHBondContact O-CB 3.38Å; F338-F342 PolarHBondContact O-N 2.84Å
339	Y	97.6	Very high	96.2	Very high	22 Å²	22	25.3 Å²	25.3	9%	0.086	17%	0.165	C	C	.	.	H	α-helix	trans	-58.4	-45.8	176.5	-68.8	-25.6	0	0	0	112.4	L215 T218 F219 T335 G336 F342 L343 L364	L215-Y339 HydrophobicContact CD1-CD1 4.19Å; L215-Y339 HydrophobicContact CD1-CE1 4.04Å; T218-Y339 WeakPolarHBondContact CB-OH 3.39Å; T218-Y339 HydrophobicContact CG2-CE1 3.97Å; T218-Y339 VanDerWaalsContact OG1-CE1 3.23Å; T218-Y339 WeakPolarHBondContact OG1-CE1 3.29Å; T218-Y339 PolarHBondContact OG1-OH 2.8Å; F219-Y339 HydrophobicContact CE2-CE1 4.33Å; T335-Y339 HydrophobicContact CG2-CD2 4.11Å; T335-Y339 HydrophobicContact CG2-CE1 4.19Å; T335-Y339 HydrophobicContact CG2-CE2 3.51Å; T335-Y339 PolarHBondContact O-N 3.19Å; G336-Y339 PolarHBondContact O-N 3.37Å; Y339-F342 PolarHBondContact O-N 3.22Å; Y339-L343 WeakPolarHBondContact O-CB 3.41Å; Y339-L343 WeakPolarHBondContact O-CG 3.47Å; Y339-L343 PolarHBondContact O-N 3.27Å; Y339-L364 HydrophobicContact CD1-CD1 4.28Å; Y339-L364 HydrophobicContact CD1-CD2 4.25Å; Y339-L364 HydrophobicContact CD2-CD1 3.62Å; Y339-L364 HydrophobicContact CD2-CD2 4.02Å; Y339-L364 HydrophobicContact CD2-CG 3.55Å; Y339-L364 HydrophobicContact CE1-CD1 4.15Å; Y339-L364 HydrophobicContact CE2-CD1 3.45Å; Y339-L364 VanDerWaalsContact CE2-CD1 3.45Å; Y339-L364 HydrophobicContact CE2-CG 3.93Å; Y339-L364 HydrophobicContact CG-CD1 4.03Å; Y339-L364 HydrophobicContact CG-CD2 3.79Å; Y339-L364 HydrophobicContact CG-CG 3.87Å
340	Y	97.3	Very high	96.1	Very high	9 Å²	9	25.3 Å²	25.3	4%	0.035	17%	0.167	C	C	.	.	H	α-helix	trans	-60.9	-47.8	177.7	-175.5	-97.1	0	0	0	111.6	I322 L329 L331 G336 H337 F338 F342 L343 C344 L351 L355	I322-Y340 HydrophobicContact CD1-CD1 4.01Å; I322-Y340 HydrophobicContact CD1-CD2 3.66Å; I322-Y340 HydrophobicContact CD1-CE1 3.77Å; I322-Y340 HydrophobicContact CD1-CE2 3.42Å; I322-Y340 VanDerWaalsContact CD1-CE2 3.42Å; I322-Y340 HydrophobicContact CD1-CG 3.95Å; I322-Y340 VanDerWaalsContact CD1-CZ 3.46Å; I322-Y340 HydrophobicContact CG1-CE1 4.47Å; I322-Y340 HydrophobicContact CG1-CE2 4.2Å; I322-Y340 HydrophobicContact CG2-CE2 4.06Å; L329-Y340 HydrophobicContact CD2-CD2 3.99Å; L329-Y340 HydrophobicContact CD2-CE2 4.45Å; L331-Y340 HydrophobicContact CD1-CD1 4.2Å; L331-Y340 HydrophobicContact CD1-CD2 4.31Å; L331-Y340 HydrophobicContact CD1-CG 3.79Å; G336-Y340 PolarHBondContact O-N 3.01Å; H337-Y340 PolarHBondContact O-N 3.17Å; F338-Y340 VanDerWaalsContact C-N 3.35Å; F338-Y340 PolarHBondContact O-N 3.14Å; Y340-F342 VanDerWaalsContact C-N 3.34Å; Y340-F342 PolarHBondContact O-N 3.42Å; Y340-L343 PolarHBondContact O-N 2.71Å; Y340-C344 WeakPolarHBondContact CE1-SG 3.23Å; Y340-C344 WeakPolarHBondContact O-CB 3.46Å; Y340-C344 PolarHBondContact O-N 3.15Å; Y340-C344 PolarHBondContact O-SG 3.19Å; Y340-L351 HydrophobicContact CD2-CD2 3.79Å; Y340-L351 HydrophobicContact CE2-CD2 3.51Å; Y340-L351 HydrophobicContact CE2-CG 4.44Å; Y340-L355 HydrophobicContact CE2-CD1 4.41Å
341	N	96.4	Very high	96.1	Very high	52 Å²	52	22.4 Å²	22.4	28%	0.278	15%	0.149	S	C	.	.	H	α-helix	trans	-64.1	-38.2	178.2	-72.9	-13.8	0	0	0	112.5	E253 H337 F338 S345	E253-N341 PolarHBondContact OE1-ND2 2.84Å; H337-N341 WeakPolarHBondContact O-CB 3.2Å; H337-N341 VanDerWaalsContact O-CG 3.32Å; H337-N341 PolarHBondContact O-N 2.95Å; F338-N341 PolarHBondContact O-N 3.09Å; N341-S345 PolarHBondContact O-N 3.06Å
342	F	98.2	Very high	95.9	Very high	8 Å²	8	26.8 Å²	26.8	4%	0.035	17%	0.165	C	C	.	.	H	α-helix	trans	-61.1	-53	174.6	-175.8	-84	0	0	0	110.3	I163 V167 K211 L215 F338 Y339 Y340 C344 S345 V346	I163-F342 HydrophobicContact CD1-CE2 3.96Å; I163-F342 HydrophobicContact CD1-CZ 4.35Å; I163-F342 HydrophobicContact CG2-CZ 4.05Å; V167-F342 HydrophobicContact CG2-CE1 3.67Å; V167-F342 HydrophobicContact CG2-CZ 3.76Å; K211-F342 HydrophobicContact CB-CD2 4.04Å; K211-F342 HydrophobicContact CB-CE2 4.11Å; L215-F342 HydrophobicContact CB-CD2 4.44Å; L215-F342 HydrophobicContact CB-CE2 4.21Å; L215-F342 HydrophobicContact CD2-CD1 4.35Å; L215-F342 HydrophobicContact CD2-CE1 3.73Å; L215-F342 HydrophobicContact CD2-CE2 3.93Å; L215-F342 HydrophobicContact CD2-CZ 3.5Å; L215-F342 VanDerWaalsContact CD2-CZ 3.5Å; F338-F342 HydrophobicContact CE1-CB 4.48Å; F338-F342 HydrophobicContact CZ-CB 4.34Å; F338-F342 HydrophobicContact CZ-CD2 4.02Å; F338-F342 VanDerWaalsContact O-CB 3.3Å; F338-F342 WeakPolarHBondContact O-CB 3.38Å; F338-F342 PolarHBondContact O-N 2.84Å; Y339-F342 PolarHBondContact O-N 3.22Å; Y340-F342 VanDerWaalsContact C-N 3.34Å; Y340-F342 PolarHBondContact O-N 3.42Å; F342-C344 PolarHBondContact O-N 3.1Å; F342-S345 PolarHBondContact O-N 2.8Å; F342-S345 PolarHBondContact O-OG 3.36Å; F342-V346 HydrophobicContact CD1-CG2 4.21Å; F342-V346 HydrophobicContact CE1-CG2 3.77Å; F342-V346 HydrophobicContact CZ-CG2 4.26Å; F342-V346 PolarHBondContact O-N 2.84Å
343	L	97.8	Very high	95.8	Very high	5 Å²	5	25 Å²	25	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-64.5	-36.5	179.6	-71.8	173.6	0	0	0	112.5	L126 Y339 Y340 S345 V346 L347 L351 I361 L364 F365	L126-L343 HydrophobicContact CD1-CD2 4.27Å; Y339-L343 WeakPolarHBondContact O-CB 3.41Å; Y339-L343 WeakPolarHBondContact O-CG 3.47Å; Y339-L343 PolarHBondContact O-N 3.27Å; Y340-L343 PolarHBondContact O-N 2.71Å; L343-S345 PolarHBondContact O-N 3.23Å; L343-V346 PolarHBondContact O-N 3Å; L343-V346 VanDerWaalsContact O-N 3.1Å; L343-L347 HydrophobicContact CD2-CD1 4.2Å; L343-L347 WeakPolarHBondContact O-CB 3.18Å; L343-L347 PolarHBondContact O-N 3.49Å; L343-L351 HydrophobicContact CB-CD1 3.77Å; L343-L351 HydrophobicContact CB-CD2 4.09Å; L343-L351 HydrophobicContact CD1-CD1 4.12Å; L343-I361 HydrophobicContact CD1-CG1 4.32Å; L343-I361 HydrophobicContact CD1-CG2 3.96Å; L343-I361 HydrophobicContact CD2-CD1 4.3Å; L343-I361 HydrophobicContact CD2-CG1 4.34Å; L343-L364 HydrophobicContact CD1-CD2 3.87Å; L343-F365 HydrophobicContact CD1-CE2 3.64Å; L343-F365 HydrophobicContact CD1-CZ 3.97Å
344	C	97.1	Very high	95.7	Very high	10 Å²	10	23.2 Å²	23.2	7%	0.068	14%	0.136	C	C	.	.	H	α-helix	trans	-56.9	-38.4	170.7	-81.2	0	0	0	0	111.7	Y340 F342 V346 G348 L351	Y340-C344 WeakPolarHBondContact CE1-SG 3.23Å; Y340-C344 WeakPolarHBondContact O-CB 3.46Å; Y340-C344 PolarHBondContact O-N 3.15Å; Y340-C344 PolarHBondContact O-SG 3.19Å; F342-C344 PolarHBondContact O-N 3.1Å; C344-V346 VanDerWaalsContact C-N 3.32Å; C344-V346 PolarHBondContact O-N 3.47Å; C344-G348 VanDerWaalsContact O-CA 3.23Å; C344-G348 WeakPolarHBondContact O-CA 3.49Å; C344-G348 PolarHBondContact O-N 3.09Å; C344-L351 VanDerWaalsContact SG-CD2 3.51Å
345	S	96.1	Very high	95.6	Very high	56 Å²	56	22.8 Å²	22.8	39%	0.392	13%	0.133	S	C	.	.	H	α-helix	trans	-74.5	-20.9	178.3	66.9	0	0	0	0	114.5	K211 N341 F342 L343	K211-S345 VanDerWaalsContact NZ-CB 3.25Å; K211-S345 PolarHBondContact NZ-OG 3.32Å; N341-S345 PolarHBondContact O-N 3.06Å; F342-S345 PolarHBondContact O-N 2.8Å; F342-S345 PolarHBondContact O-OG 3.36Å; L343-S345 PolarHBondContact O-N 3.23Å
346	V	97.1	Very high	95.3	Very high	7 Å²	7	26.4 Å²	26.4	4%	0.042	14%	0.143	C	C	.	.	H	α-helix	trans	-93.9	-44.7	179.2	174.1	0	0	0	0	111.7	R82 T122 V123 L126 I163 F342 L343 C344	R82-V346 PolarHBondContact NE-O 3.5Å; R82-V346 PolarHBondContact NH2-O 3.04Å; T122-V346 HydrophobicContact CG2-CG1 3.64Å; T122-V346 HydrophobicContact CG2-CG2 4.13Å; V123-V346 HydrophobicContact CG1-CG1 3.85Å; L126-V346 HydrophobicContact CD1-CG1 3.82Å; I163-V346 HydrophobicContact CG2-CG2 4.08Å; F342-V346 HydrophobicContact CD1-CG2 4.21Å; F342-V346 HydrophobicContact CE1-CG2 3.77Å; F342-V346 HydrophobicContact CZ-CG2 4.26Å; F342-V346 PolarHBondContact O-N 2.84Å; L343-V346 PolarHBondContact O-N 3Å; L343-V346 VanDerWaalsContact O-N 3.1Å; C344-V346 VanDerWaalsContact C-N 3.32Å; C344-V346 PolarHBondContact O-N 3.47Å
347	L	97	Very high	94.9	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-103.1	-15	-172	-63	173.3	0	0	0	114.2	V123 L126 L343 S349 G350 L351 H354 I361	V123-L347 HydrophobicContact CG1-CD2 4.45Å; L126-L347 HydrophobicContact CD1-CD1 4.25Å; L126-L347 HydrophobicContact CD1-CD2 4.09Å; L126-L347 HydrophobicContact CD1-CG 4.22Å; L343-L347 HydrophobicContact CD2-CD1 4.2Å; L343-L347 WeakPolarHBondContact O-CB 3.18Å; L343-L347 PolarHBondContact O-N 3.49Å; L347-S349 PolarHBondContact O-N 3.21Å; L347-G350 PolarHBondContact O-N 2.89Å; L347-L351 HydrophobicContact CB-CB 4.27Å; L347-L351 HydrophobicContact CD1-CD1 4Å; L347-H354 HydrophobicContact CD1-CB 4.03Å; L347-I361 HydrophobicContact CD1-CD1 3.47Å; L347-I361 VanDerWaalsContact CD1-CD1 3.47Å
348	G	94.2	Very high	94.6	Very high	25 Å²	25	28.4 Å²	28.4	26%	0.258	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	56.7	-133.8	179.5	0	0	0	0	0	112.7	C344 G350 L351	C344-G348 VanDerWaalsContact O-CA 3.23Å; C344-G348 WeakPolarHBondContact O-CA 3.49Å; C344-G348 PolarHBondContact O-N 3.09Å; G348-G350 PolarHBondContact O-N 3.44Å; G348-L351 PolarHBondContact O-N 3.37Å
349	S	90.6	Very high	94.2	Very high	87 Å²	87	31.7 Å²	31.7	61%	0.608	17%	0.172	S	C	*	.	G	3₁₀ helix	trans	-64.6	-21	179.9	45.2	0	0	0	0	114.1	L347 L351	L347-S349 PolarHBondContact O-N 3.21Å; S349-L351 VanDerWaalsContact C-N 3.31Å; S349-L351 PolarHBondContact O-N 2.98Å
350	G	93.4	Very high	93.8	Very high	6 Å²	6	32.6 Å²	32.6	6%	0.062	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-79.8	-7.5	-178.9	0	0	0	0	0	114.7	R82 L347 G348 R352 H353 H354	R82-G350 CarbonylContact O-C 3.56Å; R82-G350 WeakPolarHBondContact O-CA 3.26Å; L347-G350 PolarHBondContact O-N 2.89Å; G348-G350 PolarHBondContact O-N 3.44Å; G350-R352 PolarHBondContact O-N 3.38Å; G350-H353 VanDerWaalsContact O-CB 3.29Å; G350-H353 WeakPolarHBondContact O-CB 3.31Å; G350-H353 PolarHBondContact O-N 3.15Å; G350-H354 PolarHBondContact O-CD2 2.92Å; G350-H354 PolarHBondContact O-N 2.85Å
351	L	95.6	Very high	93.6	Very high	4 Å²	4	32.1 Å²	32.1	2%	0.021	17%	0.174	C	C	.	.	H	α-helix	trans	-52	-36	176.9	178	56.5	0	0	0	112.9	Y340 L343 C344 L347 G348 S349 H353 H354 L355 I361	Y340-L351 HydrophobicContact CD2-CD2 3.79Å; Y340-L351 HydrophobicContact CE2-CD2 3.51Å; Y340-L351 HydrophobicContact CE2-CG 4.44Å; L343-L351 HydrophobicContact CB-CD1 3.77Å; L343-L351 HydrophobicContact CB-CD2 4.09Å; L343-L351 HydrophobicContact CD1-CD1 4.12Å; C344-L351 VanDerWaalsContact SG-CD2 3.51Å; L347-L351 HydrophobicContact CB-CB 4.27Å; L347-L351 HydrophobicContact CD1-CD1 4Å; G348-L351 PolarHBondContact O-N 3.37Å; S349-L351 VanDerWaalsContact C-N 3.31Å; S349-L351 PolarHBondContact O-N 2.98Å; L351-H353 VanDerWaalsContact C-N 3.27Å; L351-H353 PolarHBondContact O-N 2.98Å; L351-H354 PolarHBondContact O-N 2.94Å; L351-L355 HydrophobicContact CD1-CD1 4.4Å; L351-L355 HydrophobicContact CD1-CG 4.12Å; L351-L355 HydrophobicContact CG-CD1 4.05Å; L351-L355 HydrophobicContact CG-CG 4.29Å; L351-L355 WeakPolarHBondContact O-CG 3.33Å; L351-L355 PolarHBondContact O-N 3.41Å; L351-I361 HydrophobicContact CD1-CG2 4.36Å
352	R	92.6	Very high	93.5	Very high	98 Å²	98	29.7 Å²	29.7	37%	0.37	16%	0.161	S	C	.	.	H	α-helix	trans	-65.6	-28.4	177.9	-65.3	-177.1	-177.4	176.9	2	113.4	F324 G350 R356	F324-R352 HydrophobicContact CB-CB 4.26Å; F324-R352 HydrophobicContact CB-CG 4.35Å; G350-R352 PolarHBondContact O-N 3.38Å; R352-R356 WeakPolarHBondContact O-CG 3.45Å; R352-R356 PolarHBondContact O-NE 3Å
353	H	91.3	Very high	93.2	Very high	38 Å²	38	34.7 Å²	34.7	18%	0.176	19%	0.188	C	C	.	.	H	α-helix	trans	-74	-45.2	173.9	-158.5	-47.3	0	0	0	110.1	S83 H84 G350 L351 L355 R356 E357	S83-H353 WeakPolarHBondContact O-CB 3.26Å; S83-H353 PolarHBondContact O-CD2 2.79Å; H84-H353 AromaticContact ND1-CD2 3.75Å; H84-H353 AromaticContact ND1-NE2 3.4Å; H84-H353 PolarHBondContact ND1-NE2 2.92Å; G350-H353 VanDerWaalsContact O-CB 3.29Å; G350-H353 WeakPolarHBondContact O-CB 3.31Å; G350-H353 PolarHBondContact O-N 3.15Å; L351-H353 VanDerWaalsContact C-N 3.27Å; L351-H353 PolarHBondContact O-N 2.98Å; H353-L355 PolarHBondContact O-N 3.16Å; H353-R356 WeakPolarHBondContact O-CB 3.33Å; H353-R356 PolarHBondContact O-N 3.41Å; H353-E357 IonicContact CE1-OE1 2.62Å; H353-E357 PolarHBondContact CE1-OE1 2.99Å; H353-E357 IonicContact CE1-OE2 3.41Å; H353-E357 PolarHBondContact CE1-OE2 3.02Å; H353-E357 VanDerWaalsContact ND1-CD 3.31Å; H353-E357 IonicContact ND1-OE1 2.8Å; H353-E357 PolarHBondContact ND1-OE1 3.46Å; H353-E357 IonicContact ND1-OE2 3.07Å; H353-E357 PolarHBondContact ND1-OE2 3.4Å; H353-E357 PolarHBondContact O-N 3.05Å
354	H	93.2	Very high	92.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.6	-41.6	176.5	-80.5	-101	0	0	0	112.9	F81 R82 H84 Q127 L347 G350 L351 R356 E357 N358 I361	F81-H354 PolarHBondContact O-NE2 2.82Å; R82-H354 PolarHBondContact O-CD2 3.39Å; R82-H354 PolarHBondContact O-NE2 3.28Å; H84-H354 PolarHBondContact O-NE2 2.91Å; Q127-H354 PolarHBondContact NE2-CE1 3.18Å; L347-H354 HydrophobicContact CD1-CB 4.03Å; G350-H354 PolarHBondContact O-CD2 2.92Å; G350-H354 PolarHBondContact O-N 2.85Å; L351-H354 PolarHBondContact O-N 2.94Å; H354-R356 PolarHBondContact O-N 3.05Å; H354-E357 PolarHBondContact O-N 2.84Å; H354-N358 HydrophobicContact CB-CB 4.12Å; H354-N358 PolarHBondContact ND1-ND2 3Å; H354-N358 WeakPolarHBondContact O-CA 3.44Å; H354-N358 WeakPolarHBondContact O-CB 3.48Å; H354-N358 PolarHBondContact O-N 3.47Å; H354-I361 HydrophobicContact CB-CD1 3.61Å
355	L	94.2	Very high	92.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.2	-28.3	174.3	-76.3	167.4	0	0	0	112.9	F324 L329 Y340 L351 H353 I361 R362 F365 L367	F324-L355 HydrophobicContact CB-CB 4.39Å; F324-L355 HydrophobicContact CB-CD1 4.34Å; F324-L355 HydrophobicContact CD1-CB 4.35Å; F324-L355 HydrophobicContact CD1-CD1 4.23Å; F324-L355 HydrophobicContact CD2-CB 3.81Å; F324-L355 HydrophobicContact CE2-CB 4.08Å; F324-L355 HydrophobicContact CG-CB 3.94Å; F324-L355 HydrophobicContact CG-CD1 4.28Å; F324-L355 HydrophobicContact CZ-CB 4.47Å; L329-L355 HydrophobicContact CD2-CD1 4.21Å; L329-L355 HydrophobicContact CD2-CD2 3.99Å; Y340-L355 HydrophobicContact CE2-CD1 4.41Å; L351-L355 HydrophobicContact CD1-CD1 4.4Å; L351-L355 HydrophobicContact CD1-CG 4.12Å; L351-L355 HydrophobicContact CG-CD1 4.05Å; L351-L355 HydrophobicContact CG-CG 4.29Å; L351-L355 WeakPolarHBondContact O-CG 3.33Å; L351-L355 PolarHBondContact O-N 3.41Å; H353-L355 PolarHBondContact O-N 3.16Å; L355-I361 HydrophobicContact CD2-CG2 3.89Å; L355-I361 HydrophobicContact CG-CG2 4.33Å; L355-R362 WeakPolarHBondContact O-CD 3.27Å; L355-R362 WeakPolarHBondContact O-CG 3.49Å; L355-R362 PolarHBondContact O-NH1 3.38Å; L355-F365 HydrophobicContact CD2-CD2 3.66Å; L355-F365 HydrophobicContact CD2-CE2 3.84Å; L355-L367 HydrophobicContact CD2-CD1 3.78Å
356	R	91	Very high	92.7	Very high	103 Å²	103	40.9 Å²	40.9	39%	0.389	21%	0.214	S	C	.	.	H	α-helix	trans	-77.5	-40.1	177	-71.5	-180	-90.8	159.3	0.2	112.6	F324 R352 H353 H354 R362 P370	F324-R356 HydrophobicContact CD2-CG 3.66Å; F324-R356 HydrophobicContact CE2-CG 4.18Å; F324-R356 WeakPolarHBondContact O-CD 3.07Å; F324-R356 WeakPolarHBondContact O-CG 3.24Å; F324-R356 PolarHBondContact O-NE 2.73Å; R352-R356 WeakPolarHBondContact O-CG 3.45Å; R352-R356 PolarHBondContact O-NE 3Å; H353-R356 WeakPolarHBondContact O-CB 3.33Å; H353-R356 PolarHBondContact O-N 3.41Å; H354-R356 PolarHBondContact O-N 3.05Å; R356-R362 PolarHBondContact O-NH1 3.38Å; R356-P370 WeakPolarHBondContact O-CB 3.29Å
357	E	88.3	Confident	92.5	Very high	60 Å²	60	42.1 Å²	42.1	28%	0.28	22%	0.221	S	C	.	.	H	α-helix	trans	-122.5	-28.1	-160.7	-70.3	169.6	-161	0	0	115	H85 H353 H354 P359 P370	H85-E357 HydrophobicContact CB-CB 4.3Å; H353-E357 IonicContact CE1-OE1 2.62Å; H353-E357 PolarHBondContact CE1-OE1 2.99Å; H353-E357 IonicContact CE1-OE2 3.41Å; H353-E357 PolarHBondContact CE1-OE2 3.02Å; H353-E357 VanDerWaalsContact ND1-CD 3.31Å; H353-E357 IonicContact ND1-OE1 2.8Å; H353-E357 PolarHBondContact ND1-OE1 3.46Å; H353-E357 IonicContact ND1-OE2 3.07Å; H353-E357 PolarHBondContact ND1-OE2 3.4Å; H353-E357 PolarHBondContact O-N 3.05Å; H354-E357 PolarHBondContact O-N 2.84Å; E357-P359 WeakPolarHBondContact O-CD 3.44Å; E357-P370 WeakPolarHBondContact O-CG 3.38Å
358	N	90.9	Very high	92.1	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.011	24%	0.244	C	C	.	.			trans	-80.1	111.6	-173.5	-176.9	-53.3	0	0	0	110.1	H85 L126 H354 Y360 I361 R362	H85-N358 HydrophobicContact CB-CB 4.38Å; H85-N358 PolarHBondContact CD2-ND2 3.14Å; H85-N358 VanDerWaalsContact CD2-ND2 3.28Å; L126-N358 PolarHBondContact O-ND2 3.14Å; H354-N358 HydrophobicContact CB-CB 4.12Å; H354-N358 PolarHBondContact ND1-ND2 3Å; H354-N358 WeakPolarHBondContact O-CA 3.44Å; H354-N358 WeakPolarHBondContact O-CB 3.48Å; H354-N358 PolarHBondContact O-N 3.47Å; N358-Y360 VanDerWaalsContact C-N 3.28Å; N358-Y360 PolarHBondContact O-N 2.82Å; N358-Y360 WeakPolarHBondContact OD1-CB 3.3Å; N358-Y360 PolarHBondContact OD1-N 3.26Å; N358-I361 HydrophobicContact CB-CB 4.11Å; N358-I361 HydrophobicContact CB-CD1 4.2Å; N358-I361 HydrophobicContact CB-CG1 4.42Å; N358-I361 PolarHBondContact O-N 3.07Å; N358-I361 PolarHBondContact OD1-N 3.33Å; N358-R362 WeakPolarHBondContact O-CB 3.26Å; N358-R362 WeakPolarHBondContact O-CG 3.41Å; N358-R362 PolarHBondContact O-N 3.03Å
359	P	89.2	Confident	91.7	Very high	73 Å²	73	50.4 Å²	50.4	47%	0.474	27%	0.27	S	S	.	.	H	α-helix	trans	-63.1	-33.8	-173.8	-23.1	35.2	0	0	0	113.2	E357 N363	E357-P359 WeakPolarHBondContact O-CD 3.44Å; P359-N363 WeakPolarHBondContact O-CB 3.41Å; P359-N363 PolarHBondContact O-N 2.92Å
360	Y	88	Confident	91.3	Very high	41 Å²	41	48.4 Å²	48.4	16%	0.161	25%	0.254	C	S	.	.	H	α-helix	trans	-67.9	-48.5	178.4	171.9	-101.4	0	0	0	111.5	L126 P130 L171 N358 R362 N363 L364	L126-Y360 HydrophobicContact CD2-CD1 3.93Å; L126-Y360 HydrophobicContact CD2-CE1 3.8Å; P130-Y360 HydrophobicContact CG-CD2 4.07Å; P130-Y360 HydrophobicContact CG-CG 4.46Å; L171-Y360 HydrophobicContact CD2-CD1 3.71Å; L171-Y360 HydrophobicContact CD2-CD2 3.49Å; L171-Y360 VanDerWaalsContact CD2-CD2 3.49Å; L171-Y360 HydrophobicContact CD2-CE1 3.54Å; L171-Y360 HydrophobicContact CD2-CE2 3.31Å; L171-Y360 HydrophobicContact CD2-CG 3.67Å; L171-Y360 HydrophobicContact CG-CE1 4.28Å; L171-Y360 HydrophobicContact CG-CE2 4.29Å; N358-Y360 VanDerWaalsContact C-N 3.28Å; N358-Y360 PolarHBondContact O-N 2.82Å; N358-Y360 WeakPolarHBondContact OD1-CB 3.3Å; N358-Y360 PolarHBondContact OD1-N 3.26Å; Y360-R362 VanDerWaalsContact C-N 3.28Å; Y360-R362 PolarHBondContact O-N 3.33Å; Y360-N363 WeakPolarHBondContact O-CB 3.23Å; Y360-N363 PolarHBondContact O-N 3.41Å; Y360-N363 VanDerWaalsContact O-N 3.17Å; Y360-L364 PolarHBondContact O-N 2.77Å
361	I	94	Very high	90.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65.3	-36.2	178.6	-70.3	169.3	0	0	0	110.5	L343 L347 L351 H354 L355 N358 L364 F365	L343-I361 HydrophobicContact CD1-CG1 4.32Å; L343-I361 HydrophobicContact CD1-CG2 3.96Å; L343-I361 HydrophobicContact CD2-CD1 4.3Å; L343-I361 HydrophobicContact CD2-CG1 4.34Å; L347-I361 HydrophobicContact CD1-CD1 3.47Å; L347-I361 VanDerWaalsContact CD1-CD1 3.47Å; L351-I361 HydrophobicContact CD1-CG2 4.36Å; H354-I361 HydrophobicContact CB-CD1 3.61Å; L355-I361 HydrophobicContact CD2-CG2 3.89Å; L355-I361 HydrophobicContact CG-CG2 4.33Å; N358-I361 HydrophobicContact CB-CB 4.11Å; N358-I361 HydrophobicContact CB-CD1 4.2Å; N358-I361 HydrophobicContact CB-CG1 4.42Å; N358-I361 PolarHBondContact O-N 3.07Å; N358-I361 PolarHBondContact OD1-N 3.33Å; I361-L364 WeakPolarHBondContact O-CB 3.3Å; I361-L364 PolarHBondContact O-N 3.19Å; I361-F365 HydrophobicContact CG2-CD2 4.42Å; I361-F365 HydrophobicContact CG2-CE2 4.25Å; I361-F365 VanDerWaalsContact O-CD2 3.25Å; I361-F365 WeakPolarHBondContact O-CD2 3.46Å
362	R	93.8	Very high	88.5	Confident	1 Å²	1	58.1 Å²	58.1	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-63.6	-41.5	172.9	-72.5	-172.9	72	93.1	-3.6	112.8	E327 L355 R356 N358 Y360 L364 F365 D366 L367 G368 L369	E327-R362 IonicContact OE1-CZ 3.06Å; E327-R362 IonicContact OE1-NH1 3.86Å; E327-R362 IonicContact OE1-NH2 2.74Å; E327-R362 PolarHBondContact OE1-NH2 2.77Å; E327-R362 IonicContact OE2-CZ 3.02Å; E327-R362 IonicContact OE2-NH1 2.88Å; E327-R362 PolarHBondContact OE2-NH1 2.78Å; E327-R362 IonicContact OE2-NH2 3.18Å; E327-R362 PolarHBondContact OE2-NH2 3.28Å; L355-R362 WeakPolarHBondContact O-CD 3.27Å; L355-R362 WeakPolarHBondContact O-CG 3.49Å; L355-R362 PolarHBondContact O-NH1 3.38Å; R356-R362 PolarHBondContact O-NH1 3.38Å; N358-R362 WeakPolarHBondContact O-CB 3.26Å; N358-R362 WeakPolarHBondContact O-CG 3.41Å; N358-R362 PolarHBondContact O-N 3.03Å; Y360-R362 VanDerWaalsContact C-N 3.28Å; Y360-R362 PolarHBondContact O-N 3.33Å; R362-L364 VanDerWaalsContact C-N 3.33Å; R362-F365 CarbonylContact O-C 3.58Å; R362-F365 PolarHBondContact O-N 3.45Å; R362-D366 PolarHBondContact O-N 3.37Å; R362-D366 VanDerWaalsContact O-N 3.14Å; R362-L367 HydrophobicContact CB-CB 4.07Å; R362-L367 HydrophobicContact CG-CB 4.27Å; R362-L367 HydrophobicContact CG-CD1 4.4Å; R362-L367 PolarHBondContact NH2-O 3.15Å; R362-L367 PolarHBondContact O-N 3.05Å; R362-G368 WeakPolarHBondContact CB-O 3.19Å; R362-G368 PolarHBondContact NE-O 3.15Å; R362-L369 PolarHBondContact NE-O 2.95Å; R362-L369 PolarHBondContact NH2-O 3.17Å; R362-L369 VanDerWaalsContact NH2-O 3.17Å
363	N	91.7	Very high	86.7	Confident	113 Å²	113	59.3 Å²	59.3	60%	0.604	32%	0.321	S	S	*	.	H	α-helix	trans	-62.3	-40.4	176.4	-170.6	-9.5	0	0	0	111.5	P359 Y360 F365 D366	P359-N363 WeakPolarHBondContact O-CB 3.41Å; P359-N363 PolarHBondContact O-N 2.92Å; Y360-N363 WeakPolarHBondContact O-CB 3.23Å; Y360-N363 PolarHBondContact O-N 3.41Å; Y360-N363 VanDerWaalsContact O-N 3.17Å; N363-F365 PolarHBondContact O-N 3.05Å; N363-D366 PolarHBondContact O-N 2.83Å
364	L	92.5	Very high	84.5	Confident	30 Å²	30	65.5 Å²	65.5	16%	0.157	35%	0.35	C	S	.	.	H	α-helix	trans	-56.3	-24.4	177.6	-167.8	65.4	0	0	0	114	F219 Y339 L343 Y360 I361 R362	F219-L364 HydrophobicContact CE1-CD1 4.47Å; F219-L364 HydrophobicContact CZ-CD1 3.79Å; Y339-L364 HydrophobicContact CD1-CD1 4.28Å; Y339-L364 HydrophobicContact CD1-CD2 4.25Å; Y339-L364 HydrophobicContact CD2-CD1 3.62Å; Y339-L364 HydrophobicContact CD2-CD2 4.02Å; Y339-L364 HydrophobicContact CD2-CG 3.55Å; Y339-L364 HydrophobicContact CE1-CD1 4.15Å; Y339-L364 HydrophobicContact CE2-CD1 3.45Å; Y339-L364 VanDerWaalsContact CE2-CD1 3.45Å; Y339-L364 HydrophobicContact CE2-CG 3.93Å; Y339-L364 HydrophobicContact CG-CD1 4.03Å; Y339-L364 HydrophobicContact CG-CD2 3.79Å; Y339-L364 HydrophobicContact CG-CG 3.87Å; L343-L364 HydrophobicContact CD1-CD2 3.87Å; Y360-L364 PolarHBondContact O-N 2.77Å; I361-L364 WeakPolarHBondContact O-CB 3.3Å; I361-L364 PolarHBondContact O-N 3.19Å; R362-L364 VanDerWaalsContact C-N 3.33Å
365	F	95.4	Very high	82.1	Confident	23 Å²	23	68.9 Å²	68.9	10%	0.101	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.9	13.8	179.8	-62.6	-70.7	0	0	0	113.5	L329 L331 L343 L355 I361 R362 N363 L367	L329-F365 HydrophobicContact CD1-CB 3.65Å; L329-F365 HydrophobicContact CD1-CD1 3.84Å; L329-F365 HydrophobicContact CD1-CG 3.81Å; L329-F365 HydrophobicContact CD2-CD1 4.06Å; L329-F365 HydrophobicContact CD2-CD2 4.25Å; L329-F365 HydrophobicContact CD2-CE1 4.17Å; L329-F365 HydrophobicContact CD2-CE2 4.36Å; L329-F365 HydrophobicContact CD2-CG 4.11Å; L329-F365 HydrophobicContact CD2-CZ 4.32Å; L331-F365 HydrophobicContact CD2-CD1 3.93Å; L331-F365 HydrophobicContact CD2-CE1 3.82Å; L343-F365 HydrophobicContact CD1-CE2 3.64Å; L343-F365 HydrophobicContact CD1-CZ 3.97Å; L355-F365 HydrophobicContact CD2-CD2 3.66Å; L355-F365 HydrophobicContact CD2-CE2 3.84Å; I361-F365 HydrophobicContact CG2-CD2 4.42Å; I361-F365 HydrophobicContact CG2-CE2 4.25Å; I361-F365 VanDerWaalsContact O-CD2 3.25Å; I361-F365 WeakPolarHBondContact O-CD2 3.46Å; R362-F365 CarbonylContact O-C 3.58Å; R362-F365 PolarHBondContact O-N 3.45Å; N363-F365 PolarHBondContact O-N 3.05Å; F365-L367 HydrophobicContact CB-CD1 4.06Å; F365-L367 HydrophobicContact CB-CG 3.88Å; F365-L367 PolarHBondContact O-N 2.87Å; F365-L367 VanDerWaalsContact O-N 3.14Å
366	D	93.1	Very high	79.8	Confident	147 Å²	147	74.1 Å²	74.1	79%	0.786	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	32.5	-178.1	-61.2	-51.6	0	0	0	114.5	R362 N363 G368	R362-D366 PolarHBondContact O-N 3.37Å; R362-D366 VanDerWaalsContact O-N 3.14Å; N363-D366 PolarHBondContact O-N 2.83Å; D366-G368 PolarHBondContact O-N 2.92Å
367	L	92.5	Very high	77.7	Confident	34 Å²	34	75.7 Å²	75.7	18%	0.178	40%	0.4	C	S	.	.			trans	-77.7	-6	-178	-66	172.3	0	0	0	113.6	F324 L329 L355 R362 F365	F324-L367 HydrophobicContact CE1-CD1 4.23Å; F324-L367 HydrophobicContact CE1-CD2 4.38Å; F324-L367 HydrophobicContact CZ-CD1 3.83Å; F324-L367 HydrophobicContact CZ-CD2 4.16Å; L329-L367 HydrophobicContact CD1-CD2 4.14Å; L355-L367 HydrophobicContact CD2-CD1 3.78Å; R362-L367 HydrophobicContact CB-CB 4.07Å; R362-L367 HydrophobicContact CG-CB 4.27Å; R362-L367 HydrophobicContact CG-CD1 4.4Å; R362-L367 PolarHBondContact NH2-O 3.15Å; R362-L367 PolarHBondContact O-N 3.05Å; F365-L367 HydrophobicContact CB-CD1 4.06Å; F365-L367 HydrophobicContact CB-CG 3.88Å; F365-L367 PolarHBondContact O-N 2.87Å; F365-L367 VanDerWaalsContact O-N 3.14Å
368	G	89.7	Confident	75.9	Confident	48 Å²	48	77.2 Å²	77.2	50%	0.495	42%	0.423	S	S	.	.			trans	69.4	-164.1	-175.1	0	0	0	0	0	113.6	R362 D366	R362-G368 WeakPolarHBondContact CB-O 3.19Å; R362-G368 PolarHBondContact NE-O 3.15Å; D366-G368 PolarHBondContact O-N 2.92Å
369	L	85	Confident	74.2	Confident	151 Å²	151	81.6 Å²	81.6	79%	0.791	45%	0.446	S	S	*	.	S	Bend	trans	-66.7	150.7	-179.5	-67.7	173.4	0	0	0	111.7	R362 S371	R362-L369 PolarHBondContact NE-O 2.95Å; R362-L369 PolarHBondContact NH2-O 3.17Å; R362-L369 VanDerWaalsContact NH2-O 3.17Å; L369-S371 PolarHBondContact O-N 3.02Å
370	P	82	Confident	72.6	Confident	44 Å²	44	84.6 Å²	84.6	29%	0.286	45%	0.454	S	S	.	.			trans	-47.8	124.6	171.5	-29.8	37.1	0	0	0	111.2	R356 E357 L372	R356-P370 WeakPolarHBondContact O-CB 3.29Å; E357-P370 WeakPolarHBondContact O-CG 3.38Å; P370-L372 PolarHBondContact O-N 3.11Å
371	S	70.6	Confident	71.2	Confident	51 Å²	51	93.5 Å²	93.5	36%	0.357	49%	0.487	S	S	.	.			trans	-64.5	113.4	177.6	66	0	0	0	0	108.7	L369 L373	L369-S371 PolarHBondContact O-N 3.02Å; S371-L373 PolarHBondContact O-N 2.85Å
372	L	59.1	Low	69.6	Low	164 Å²	164	98 Å²	98	86%	0.859	51%	0.514	S	S	*	.			trans	-60.3	114.6	167.4	-64.8	176.9	0	0	0	106.7	P370 Q374	P370-L372 PolarHBondContact O-N 3.11Å; L372-Q374 VanDerWaalsContact C-N 3.31Å; L372-Q374 PolarHBondContact O-N 3.49Å
373	L	55.2	Low	68.4	Low	123 Å²	123	103.6 Å²	103.6	64%	0.644	54%	0.543	S	S	*	.			trans	-56	92.7	178.8	-87	159.5	0	0	0	109.8	S371 Q375	S371-L373 PolarHBondContact O-N 2.85Å; L373-Q375 PolarHBondContact O-N 3.32Å
374	Q	44.8	Very low	67.4	Low	167 Å²	167	105.5 Å²	105.5	78%	0.78	55%	0.546	S	S	*	.			trans	-70.9	89.5	159.8	-91.6	-174.5	-5.9	0	0	107.1	L372 N376	L372-Q374 VanDerWaalsContact C-N 3.31Å; L372-Q374 PolarHBondContact O-N 3.49Å; Q374-N376 PolarHBondContact O-N 2.93Å
375	Q	43.1	Very low	66.7	Low	72 Å²	72	110.2 Å²	110.2	34%	0.336	57%	0.568	S	S	.	*			trans	-64.5	73.8	164.3	-69.1	-170.9	21.3	0	0	109.9	D41 L373 R377	D41-Q375 PolarHBondContact OD1-NE2 2.73Å; D41-Q375 PolarHBondContact OD2-NE2 2.79Å; L373-Q375 PolarHBondContact O-N 3.32Å; Q375-R377 HydrophobicContact CB-CG 4.36Å; Q375-R377 PolarHBondContact O-N 2.9Å; Q375-R377 VanDerWaalsContact OE1-CZ 3.24Å
376	N	45.1	Very low	65.7	Low	109 Å²	109	114.7 Å²	114.7	58%	0.583	59%	0.589	S	S	*	*			trans	-77.6	72.5	162.9	-86.3	-26.9	0	0	0	109	Q374 A378 N379	Q374-N376 PolarHBondContact O-N 2.93Å; N376-A378 PolarHBondContact O-N 3.32Å; N376-N379 PolarHBondContact O-N 3.03Å
377	R	46.7	Very low	64.9	Low	137 Å²	137	114.6 Å²	114.6	52%	0.517	58%	0.581	S	S	.	*	G	3₁₀ helix	trans	-53.6	-22	172.3	-65	-173.5	-175	178.3	3.3	112.2	Q375 N379	Q375-R377 HydrophobicContact CB-CG 4.36Å; Q375-R377 PolarHBondContact O-N 2.9Å; Q375-R377 VanDerWaalsContact OE1-CZ 3.24Å; R377-N379 VanDerWaalsContact C-N 3.34Å; R377-N379 PolarHBondContact O-N 2.9Å
378	A	51.8	Low	64.3	Low	91 Å²	91	122.4 Å²	122.4	75%	0.752	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-68.4	-21.8	-176.8	0	0	0	0	0	115.1	N376	N376-A378 PolarHBondContact O-N 3.32Å
379	N	54.6	Low	64	Low	95 Å²	95	124.3 Å²	124.3	51%	0.508	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-103.8	5.1	-173.4	-79	-16.2	0	0	0	115.2	N376 R377 R381 V382 L383	N376-N379 PolarHBondContact O-N 3.03Å; R377-N379 VanDerWaalsContact C-N 3.34Å; R377-N379 PolarHBondContact O-N 2.9Å; N379-R381 VanDerWaalsContact C-N 3.35Å; N379-R381 PolarHBondContact O-N 2.85Å; N379-V382 PolarHBondContact O-N 2.95Å; N379-L383 VanDerWaalsContact O-CB 3.24Å; N379-L383 WeakPolarHBondContact O-CB 3.3Å; N379-L383 PolarHBondContact O-N 3.49Å
380	H	55.8	Low	63.8	Low	136 Å²	136	120.7 Å²	120.7	63%	0.63	59%	0.591	S	S	*	*	H	α-helix	trans	-63	-35.5	-170.1	-161.8	-36.2	0	0	0	113.8	K384	H380-K384 VanDerWaalsContact O-CB 3.27Å; H380-K384 WeakPolarHBondContact O-CB 3.48Å; H380-K384 PolarHBondContact O-N 3.37Å
381	R	58.9	Low	63.8	Low	227 Å²	227	122.7 Å²	122.7	86%	0.857	60%	0.599	S	S	*	*	H	α-helix	trans	-70.3	-46.9	176.7	-76.2	-172.6	-178.3	-177.4	1.9	112	N379 L383 K384 E385	N379-R381 VanDerWaalsContact C-N 3.35Å; N379-R381 PolarHBondContact O-N 2.85Å; R381-L383 VanDerWaalsContact C-N 3.31Å; R381-L383 PolarHBondContact O-N 3.27Å; R381-K384 PolarHBondContact O-N 3.06Å; R381-E385 PolarHBondContact O-N 3.36Å
382	V	61.3	Low	64.5	Low	95 Å²	95	123 Å²	123	58%	0.576	61%	0.605	S	S	*	*	H	α-helix	trans	-61.2	-42.5	176.7	179.1	0	0	0	0	110.2	N379 K384 E385 Q386	N379-V382 PolarHBondContact O-N 2.95Å; V382-K384 PolarHBondContact O-N 3.46Å; V382-E385 PolarHBondContact O-N 3.21Å; V382-Q386 VanDerWaalsContact O-CB 3.24Å; V382-Q386 WeakPolarHBondContact O-CB 3.23Å; V382-Q386 PolarHBondContact O-N 2.81Å
383	L	67.9	Low	65.7	Low	118 Å²	118	120.6 Å²	120.6	62%	0.618	59%	0.592	S	S	*	*	H	α-helix	trans	-66.3	-37.4	177.1	-165.2	71.9	0	0	0	112.3	N379 R381 K387	N379-L383 VanDerWaalsContact O-CB 3.24Å; N379-L383 WeakPolarHBondContact O-CB 3.3Å; N379-L383 PolarHBondContact O-N 3.49Å; R381-L383 VanDerWaalsContact C-N 3.31Å; R381-L383 PolarHBondContact O-N 3.27Å; L383-K387 VanDerWaalsContact O-CB 3.22Å; L383-K387 WeakPolarHBondContact O-CB 3.26Å; L383-K387 PolarHBondContact O-N 3.25Å
384	K	71.3	Confident	66.8	Low	153 Å²	153	116.2 Å²	116.2	67%	0.665	57%	0.574	S	S	*	*	H	α-helix	trans	-66.2	-43.9	176.2	-175.3	175.8	-177	173.8	0	111.5	H380 R381 V382 R388	H380-K384 VanDerWaalsContact O-CB 3.27Å; H380-K384 WeakPolarHBondContact O-CB 3.48Å; H380-K384 PolarHBondContact O-N 3.37Å; R381-K384 PolarHBondContact O-N 3.06Å; V382-K384 PolarHBondContact O-N 3.46Å; K384-R388 WeakPolarHBondContact O-CB 3.27Å; K384-R388 PolarHBondContact O-N 2.81Å
385	E	76.8	Confident	68.6	Low	129 Å²	129	111.3 Å²	111.3	60%	0.603	56%	0.558	S	S	*	*	H	α-helix	trans	-65.9	-48.3	175.8	-173.7	161.7	-157.4	0	0	111	R381 V382 K387 R388 L389	R381-E385 PolarHBondContact O-N 3.36Å; V382-E385 PolarHBondContact O-N 3.21Å; E385-K387 VanDerWaalsContact C-N 3.34Å; E385-K387 PolarHBondContact O-N 2.94Å; E385-R388 WeakPolarHBondContact O-CA 3.24Å; E385-R388 WeakPolarHBondContact O-CB 3.43Å; E385-R388 PolarHBondContact O-N 2.97Å; E385-R388 VanDerWaalsContact O-N 3.07Å; E385-L389 HydrophobicContact CG-CD1 3.52Å; E385-L389 WeakPolarHBondContact O-CD1 3.31Å; E385-L389 PolarHBondContact O-N 3.07Å
386	Q	75.2	Confident	70.8	Confident	118 Å²	118	114.4 Å²	114.4	55%	0.551	57%	0.57	S	S	*	*	H	α-helix	trans	-52.7	-50.1	173.6	-169.9	75.2	8.3	0	0	111.4	V382 R388 L389 T390	V382-Q386 VanDerWaalsContact O-CB 3.24Å; V382-Q386 WeakPolarHBondContact O-CB 3.23Å; V382-Q386 PolarHBondContact O-N 2.81Å; Q386-R388 VanDerWaalsContact C-N 3.33Å; Q386-R388 PolarHBondContact O-N 3.44Å; Q386-L389 PolarHBondContact O-N 3.37Å; Q386-T390 WeakPolarHBondContact O-CB 3.34Å; Q386-T390 PolarHBondContact O-N 2.97Å; Q386-T390 PolarHBondContact O-OG1 3.29Å
387	K	75.4	Confident	72.6	Confident	144 Å²	144	111.5 Å²	111.5	63%	0.626	56%	0.558	S	S	*	*	H	α-helix	trans	-60.3	-41.2	177.7	-172.1	174.9	-177.8	177.8	0	111.8	L383 E385 N391	L383-K387 VanDerWaalsContact O-CB 3.22Å; L383-K387 WeakPolarHBondContact O-CB 3.26Å; L383-K387 PolarHBondContact O-N 3.25Å; E385-K387 VanDerWaalsContact C-N 3.34Å; E385-K387 PolarHBondContact O-N 2.94Å; K387-N391 VanDerWaalsContact O-CB 3.26Å; K387-N391 WeakPolarHBondContact O-CB 3.22Å; K387-N391 PolarHBondContact O-N 2.79Å
388	R	80.4	Confident	74.3	Confident	198 Å²	198	109.4 Å²	109.4	75%	0.747	55%	0.551	S	S	*	*	H	α-helix	trans	-62.5	-45.2	175.2	-175.5	-175.9	177.4	-168.4	0.2	111.4	K384 E385 Q386 A392	K384-R388 WeakPolarHBondContact O-CB 3.27Å; K384-R388 PolarHBondContact O-N 2.81Å; E385-R388 WeakPolarHBondContact O-CA 3.24Å; E385-R388 WeakPolarHBondContact O-CB 3.43Å; E385-R388 PolarHBondContact O-N 2.97Å; E385-R388 VanDerWaalsContact O-N 3.07Å; Q386-R388 VanDerWaalsContact C-N 3.33Å; Q386-R388 PolarHBondContact O-N 3.44Å; R388-A392 VanDerWaalsContact O-CB 3.28Å; R388-A392 WeakPolarHBondContact O-CB 3.17Å; R388-A392 PolarHBondContact O-N 3.25Å
389	L	83.9	Confident	75.9	Confident	88 Å²	88	108.5 Å²	108.5	46%	0.461	54%	0.536	S	S	.	.	H	α-helix	trans	-64.4	-47.4	177.1	-86.6	110	0	0	0	111.5	E385 Q386 N391 A392 I393	E385-L389 HydrophobicContact CG-CD1 3.52Å; E385-L389 WeakPolarHBondContact O-CD1 3.31Å; E385-L389 PolarHBondContact O-N 3.07Å; Q386-L389 PolarHBondContact O-N 3.37Å; L389-N391 VanDerWaalsContact C-N 3.34Å; L389-N391 PolarHBondContact O-N 3.25Å; L389-A392 PolarHBondContact O-N 3.11Å; L389-I393 VanDerWaalsContact O-CG1 3.29Å; L389-I393 WeakPolarHBondContact O-CG1 3.46Å; L389-I393 PolarHBondContact O-N 3.41Å
390	T	79.7	Confident	77.4	Confident	75 Å²	75	109.9 Å²	109.9	46%	0.46	54%	0.539	S	S	.	.	H	α-helix	trans	-59.2	-44.9	176.9	-57.2	0	0	0	0	111.3	Q386 I393 A394	Q386-T390 WeakPolarHBondContact O-CB 3.34Å; Q386-T390 PolarHBondContact O-N 2.97Å; Q386-T390 PolarHBondContact O-OG1 3.29Å; T390-I393 PolarHBondContact O-N 3.41Å; T390-A394 WeakPolarHBondContact O-CB 3.5Å; T390-A394 PolarHBondContact O-N 2.89Å
391	N	82.6	Confident	78.7	Confident	86 Å²	86	110.2 Å²	110.2	46%	0.46	54%	0.539	S	S	.	.	H	α-helix	trans	-65.5	-39.2	176.6	-73	-7.3	0	0	0	112.2	K387 L389 A394 S395	K387-N391 VanDerWaalsContact O-CB 3.26Å; K387-N391 WeakPolarHBondContact O-CB 3.22Å; K387-N391 PolarHBondContact O-N 2.79Å; L389-N391 VanDerWaalsContact C-N 3.34Å; L389-N391 PolarHBondContact O-N 3.25Å; N391-A394 PolarHBondContact O-N 3.08Å; N391-S395 WeakPolarHBondContact O-CB 3.43Å; N391-S395 PolarHBondContact O-N 3.32Å
392	A	84.2	Confident	79.9	Confident	58 Å²	58	103 Å²	103	48%	0.479	52%	0.517	S	S	.	.	H	α-helix	trans	-64.4	-43.1	176.5	0	0	0	0	0	111.6	R388 L389 S395 K396	R388-A392 VanDerWaalsContact O-CB 3.28Å; R388-A392 WeakPolarHBondContact O-CB 3.17Å; R388-A392 PolarHBondContact O-N 3.25Å; L389-A392 PolarHBondContact O-N 3.11Å; A392-S395 PolarHBondContact O-N 2.83Å; A392-K396 VanDerWaalsContact O-CB 3.3Å; A392-K396 WeakPolarHBondContact O-CB 3.41Å; A392-K396 PolarHBondContact O-N 3.37Å
393	I	85.5	Confident	81	Confident	114 Å²	114	99.9 Å²	99.9	59%	0.585	50%	0.504	S	S	*	.	H	α-helix	trans	-63.2	-47.4	174.8	-66.6	165	0	0	0	110.4	L389 T390 S395 K396 S397	L389-I393 VanDerWaalsContact O-CG1 3.29Å; L389-I393 WeakPolarHBondContact O-CG1 3.46Å; L389-I393 PolarHBondContact O-N 3.41Å; T390-I393 PolarHBondContact O-N 3.41Å; I393-S395 PolarHBondContact O-N 2.94Å; I393-K396 PolarHBondContact O-N 3.49Å; I393-S397 WeakPolarHBondContact O-CB 3.46Å; I393-S397 PolarHBondContact O-N 2.89Å
394	A	78.6	Confident	81.6	Confident	31 Å²	31	101.6 Å²	101.6	26%	0.256	51%	0.51	S	S	.	.	H	α-helix	trans	-62.9	-40.2	178.4	0	0	0	0	0	112.3	Y28 T390 N391 R398	Y28-A394 HydrophobicContact CE1-CB 4.08Å; T390-A394 WeakPolarHBondContact O-CB 3.5Å; T390-A394 PolarHBondContact O-N 2.89Å; N391-A394 PolarHBondContact O-N 3.08Å; A394-R398 VanDerWaalsContact O-CB 3.23Å; A394-R398 WeakPolarHBondContact O-CB 3.26Å; A394-R398 PolarHBondContact O-N 3.43Å
395	S	82.8	Confident	81.9	Confident	63 Å²	63	101.3 Å²	101.3	44%	0.441	51%	0.506	S	S	.	.	H	α-helix	trans	-66.1	-43.3	175.8	-178.2	0	0	0	0	111.7	N391 A392 I393 R398 T399	N391-S395 WeakPolarHBondContact O-CB 3.43Å; N391-S395 PolarHBondContact O-N 3.32Å; A392-S395 PolarHBondContact O-N 2.83Å; I393-S395 PolarHBondContact O-N 2.94Å; S395-R398 PolarHBondContact O-N 3.38Å; S395-T399 WeakPolarHBondContact O-CB 3.46Å; S395-T399 PolarHBondContact O-N 3.02Å; S395-T399 PolarHBondContact O-OG1 3.35Å
396	K	88.3	Confident	82.1	Confident	138 Å²	138	102.8 Å²	102.8	60%	0.6	51%	0.506	S	S	*	.	H	α-helix	trans	-63.1	-48.1	175.1	-173.2	178	-179.7	-178.5	0	111.3	A392 I393 R398 T399 Q400	A392-K396 VanDerWaalsContact O-CB 3.3Å; A392-K396 WeakPolarHBondContact O-CB 3.41Å; A392-K396 PolarHBondContact O-N 3.37Å; I393-K396 PolarHBondContact O-N 3.49Å; K396-R398 PolarHBondContact O-N 3.43Å; K396-T399 PolarHBondContact O-N 2.84Å; K396-Q400 WeakPolarHBondContact O-CG 3.46Å; K396-Q400 PolarHBondContact O-N 3.4Å
397	S	82.9	Confident	81.9	Confident	48 Å²	48	101.1 Å²	101.1	34%	0.336	50%	0.501	S	S	.	.	H	α-helix	trans	-60.3	-44.8	177.2	-175.9	0	0	0	0	111.7	I393 T399 Q400 K401	I393-S397 WeakPolarHBondContact O-CB 3.46Å; I393-S397 PolarHBondContact O-N 2.89Å; S397-T399 PolarHBondContact O-N 3.48Å; S397-Q400 PolarHBondContact O-N 3.46Å; S397-K401 WeakPolarHBondContact O-CG 3.37Å; S397-K401 PolarHBondContact O-N 2.88Å
398	R	83.2	Confident	81.7	Confident	93 Å²	93	100.2 Å²	100.2	35%	0.351	50%	0.497	S	S	.	.	H	α-helix	trans	-60.9	-44.5	174.6	177.4	-177.5	-101.4	-161.7	-9.9	111.7	Y28 A394 S395 K396 K401 L402	Y28-R398 HydrophobicContact CE1-CB 4.19Å; Y28-R398 VanDerWaalsContact CE2-NE 3.3Å; Y28-R398 VanDerWaalsContact CZ-NE 3.33Å; A394-R398 VanDerWaalsContact O-CB 3.23Å; A394-R398 WeakPolarHBondContact O-CB 3.26Å; A394-R398 PolarHBondContact O-N 3.43Å; S395-R398 PolarHBondContact O-N 3.38Å; K396-R398 PolarHBondContact O-N 3.43Å; R398-K401 PolarHBondContact O-N 3.2Å; R398-L402 HydrophobicContact CG-CD1 3.72Å; R398-L402 HydrophobicContact CG-CG 4.22Å; R398-L402 WeakPolarHBondContact O-CB 3.33Å; R398-L402 VanDerWaalsContact O-CG 3.3Å; R398-L402 WeakPolarHBondContact O-CG 3.5Å; R398-L402 PolarHBondContact O-N 3.45Å
399	T	85.3	Confident	81	Confident	72 Å²	72	101.3 Å²	101.3	44%	0.442	50%	0.501	S	S	.	.	H	α-helix	trans	-63.6	-42	179.3	-59.6	0	0	0	0	111.3	S395 K396 S397 G403	S395-T399 WeakPolarHBondContact O-CB 3.46Å; S395-T399 PolarHBondContact O-N 3.02Å; S395-T399 PolarHBondContact O-OG1 3.35Å; K396-T399 PolarHBondContact O-N 2.84Å; S397-T399 PolarHBondContact O-N 3.48Å; T399-G403 PolarHBondContact O-N 3.41Å
400	Q	85.2	Confident	79.9	Confident	124 Å²	124	106.1 Å²	106.1	58%	0.579	51%	0.513	S	S	*	.	H	α-helix	trans	-62.3	-48.8	174.6	-73.2	175.2	-10.1	0	0	111.8	K396 S397 L402 G403	K396-Q400 WeakPolarHBondContact O-CG 3.46Å; K396-Q400 PolarHBondContact O-N 3.4Å; S397-Q400 PolarHBondContact O-N 3.46Å; Q400-L402 PolarHBondContact O-N 2.84Å; Q400-G403 PolarHBondContact O-N 3.15Å
401	K	83.9	Confident	78.9	Confident	143 Å²	143	108.3 Å²	108.3	62%	0.622	52%	0.518	S	S	*	.	H	α-helix	trans	-60.3	-46.6	177.2	-75.2	-176	179.4	-175.9	0	112.2	S397 R398 G403 Y405	S397-K401 WeakPolarHBondContact O-CG 3.37Å; S397-K401 PolarHBondContact O-N 2.88Å; R398-K401 PolarHBondContact O-N 3.2Å; K401-G403 VanDerWaalsContact C-N 3.33Å; K401-Y405 VanDerWaalsContact O-CD2 3.26Å; K401-Y405 WeakPolarHBondContact O-CD2 3.24Å
402	L	83.9	Confident	77.7	Confident	76 Å²	76	110.5 Å²	110.5	40%	0.398	53%	0.527	S	S	.	.	H	α-helix	trans	-71.2	-28.7	179.8	-69.3	177.4	0	0	0	112.5	R398 Q400 M404 Y405 R406	R398-L402 HydrophobicContact CG-CD1 3.72Å; R398-L402 HydrophobicContact CG-CG 4.22Å; R398-L402 WeakPolarHBondContact O-CB 3.33Å; R398-L402 VanDerWaalsContact O-CG 3.3Å; R398-L402 WeakPolarHBondContact O-CG 3.5Å; R398-L402 PolarHBondContact O-N 3.45Å; Q400-L402 PolarHBondContact O-N 2.84Å; L402-M404 PolarHBondContact O-N 3Å; L402-Y405 PolarHBondContact O-N 3.31Å; L402-R406 VanDerWaalsContact O-CG 3.31Å; L402-R406 WeakPolarHBondContact O-CG 3.33Å; L402-R406 PolarHBondContact O-N 2.84Å
403	G	84.3	Confident	76.4	Confident	29 Å²	29	113.6 Å²	113.6	30%	0.299	54%	0.535	S	S	.	.	H	α-helix	trans	-52.3	-43.8	175.6	0	0	0	0	0	112	T399 Q400 K401 Y405 R406	T399-G403 PolarHBondContact O-N 3.41Å; Q400-G403 PolarHBondContact O-N 3.15Å; K401-G403 VanDerWaalsContact C-N 3.33Å; G403-Y405 PolarHBondContact O-N 3.31Å; G403-Y405 VanDerWaalsContact O-N 3.15Å; G403-R406 PolarHBondContact O-N 3.5Å
404	M	80.6	Confident	75.1	Confident	154 Å²	154	111.9 Å²	111.9	76%	0.759	53%	0.533	S	S	*	.	H	α-helix	trans	-61.6	-22.7	177.6	-59.2	-177.8	70.1	0	0	114.3	L402	L402-M404 PolarHBondContact O-N 3Å
405	Y	77.9	Confident	73.9	Confident	146 Å²	146	117.9 Å²	117.9	57%	0.573	56%	0.556	S	S	*	*	H	α-helix	trans	-108.3	-16.2	-176.8	-63.2	-75.8	0	0	0	113.6	K401 L402 G403 D407 K408	K401-Y405 VanDerWaalsContact O-CD2 3.26Å; K401-Y405 WeakPolarHBondContact O-CD2 3.24Å; L402-Y405 PolarHBondContact O-N 3.31Å; G403-Y405 PolarHBondContact O-N 3.31Å; G403-Y405 VanDerWaalsContact O-N 3.15Å; Y405-D407 VanDerWaalsContact C-N 3.27Å; Y405-D407 PolarHBondContact O-N 2.86Å; Y405-K408 HydrophobicContact CD1-CD 4.25Å; Y405-K408 WeakPolarHBondContact O-CB 3.37Å; Y405-K408 PolarHBondContact O-N 3.38Å
406	R	80.3	Confident	72.6	Confident	160 Å²	160	122 Å²	122	60%	0.604	57%	0.572	S	S	*	*	H	α-helix	trans	-68	-29.5	-179.6	-81.8	172.7	174.4	-179.1	-1	112.1	L402 G403 K408	L402-R406 VanDerWaalsContact O-CG 3.31Å; L402-R406 WeakPolarHBondContact O-CG 3.33Å; L402-R406 PolarHBondContact O-N 2.84Å; G403-R406 PolarHBondContact O-N 3.5Å; R406-K408 VanDerWaalsContact C-N 3.31Å; R406-K408 PolarHBondContact O-N 2.9Å
407	D	71.9	Confident	70.5	Confident	83 Å²	83	126.6 Å²	126.6	44%	0.444	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.5	-8.8	179.7	-65.9	-31.3	0	0	0	113.9	Y405 R409 R410 E411	Y405-D407 VanDerWaalsContact C-N 3.27Å; Y405-D407 PolarHBondContact O-N 2.86Å; D407-R409 PolarHBondContact O-N 3.22Å; D407-R410 WeakPolarHBondContact O-CA 3.3Å; D407-R410 WeakPolarHBondContact O-CB 3.28Å; D407-R410 PolarHBondContact O-N 2.86Å; D407-E411 PolarHBondContact O-N 2.85Å; D407-E411 VanDerWaalsContact O-N 3.08Å
408	K	70	Confident	69.8	Low	126 Å²	126	130.5 Å²	130.5	55%	0.548	61%	0.609	S	S	.	*	H	α-helix	trans	-56.9	-26.4	175.8	-78.7	-171.8	170.5	-174.9	0	114.2	Y405 R406 M412	Y405-K408 HydrophobicContact CD1-CD 4.25Å; Y405-K408 WeakPolarHBondContact O-CB 3.37Å; Y405-K408 PolarHBondContact O-N 3.38Å; R406-K408 VanDerWaalsContact C-N 3.31Å; R406-K408 PolarHBondContact O-N 2.9Å; K408-M412 WeakPolarHBondContact O-CG 3.29Å
409	R	66.3	Low	69.1	Low	221 Å²	221	132.5 Å²	132.5	83%	0.834	62%	0.622	S	S	*	*	H	α-helix	trans	-84.1	-19.4	173.8	-83.5	-172.2	-179	-179	0.7	113.6	D407	D407-R409 PolarHBondContact O-N 3.22Å
410	R	61.4	Low	68.2	Low	189 Å²	189	135.8 Å²	135.8	71%	0.713	63%	0.632	S	S	*	*	H	α-helix	trans	-80.7	-40.3	175	-74.1	-176.2	178.2	-152.1	-0.6	111.1	D407 M412 L413 S414	D407-R410 WeakPolarHBondContact O-CA 3.3Å; D407-R410 WeakPolarHBondContact O-CB 3.28Å; D407-R410 PolarHBondContact O-N 2.86Å; R410-M412 VanDerWaalsContact C-N 3.32Å; R410-M412 PolarHBondContact O-N 2.89Å; R410-L413 PolarHBondContact O-N 3.46Å; R410-L413 VanDerWaalsContact O-N 3.11Å; R410-S414 PolarHBondContact O-N 2.9Å
411	E	58.7	Low	67.2	Low	120 Å²	120	136.5 Å²	136.5	56%	0.561	64%	0.636	S	S	*	*	H	α-helix	trans	-62.4	-36.9	177.5	-70.9	174.8	165.1	0	0	112.5	D407 L413 S414 E415	D407-E411 PolarHBondContact O-N 2.85Å; D407-E411 VanDerWaalsContact O-N 3.08Å; E411-L413 PolarHBondContact O-N 3.47Å; E411-S414 WeakPolarHBondContact CA-OG 3.19Å; E411-S414 PolarHBondContact O-N 3.2Å; E411-S414 PolarHBondContact O-OG 3.32Å; E411-E415 PolarHBondContact O-N 2.89Å
412	M	56.2	Low	66.2	Low	133 Å²	133	136.1 Å²	136.1	66%	0.655	64%	0.636	S	S	*	*	H	α-helix	trans	-66.5	-18.5	175.3	-73	-92.6	-77.3	0	0	114.3	K408 R410 L416	K408-M412 WeakPolarHBondContact O-CG 3.29Å; R410-M412 VanDerWaalsContact C-N 3.32Å; R410-M412 PolarHBondContact O-N 2.89Å; M412-L416 WeakPolarHBondContact O-CD1 3.47Å
413	L	56.4	Low	65	Low	123 Å²	123	140.1 Å²	140.1	64%	0.644	65%	0.652	S	S	*	*	H	α-helix	trans	-90.1	-28.9	175.6	-78.6	163.2	0	0	0	111.9	R410 E411 E415 L416	R410-L413 PolarHBondContact O-N 3.46Å; R410-L413 VanDerWaalsContact O-N 3.11Å; E411-L413 PolarHBondContact O-N 3.47Å; L413-E415 VanDerWaalsContact C-N 3.33Å; L413-L416 PolarHBondContact O-N 2.87Å
414	S	58.7	Low	63.7	Low	78 Å²	78	148.1 Å²	148.1	55%	0.545	68%	0.678	S	S	.	*	H	α-helix	trans	-78.7	-12.8	175.4	52.8	0	0	0	0	114.3	R410 E411 L416	R410-S414 PolarHBondContact O-N 2.9Å; E411-S414 WeakPolarHBondContact CA-OG 3.19Å; E411-S414 PolarHBondContact O-N 3.2Å; E411-S414 PolarHBondContact O-OG 3.32Å; S414-L416 VanDerWaalsContact C-N 3.34Å
415	E	54.8	Low	62.4	Low	156 Å²	156	147.6 Å²	147.6	73%	0.729	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-1.5	171.1	-71.4	-177.3	165.9	0	0	112.9	E411 L413	E411-E415 PolarHBondContact O-N 2.89Å; L413-E415 VanDerWaalsContact C-N 3.33Å
416	L	53.7	Low	61.1	Low	149 Å²	149	147.8 Å²	147.8	78%	0.78	68%	0.68	S	S	*	*			trans	-112.5	3.7	179.3	-73.2	169.8	0	0	0	113.6	M412 L413 S414	M412-L416 WeakPolarHBondContact O-CD1 3.47Å; L413-L416 PolarHBondContact O-N 2.87Å; S414-L416 VanDerWaalsContact C-N 3.34Å
417	E	44.3	Very low	59.3	Low	235 Å²	235	146.6 Å²	146.6	100%	1.098	69%	0.686	S	S	*	*			trans	-107	0	165.9	-72.9	-177.5	165.2	0	0	109.6

Retrieved 417 of 417 residues in 84.5 ms (Link to these results)

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