A0A087Y146_POEFO Loading...

Tetratricopeptide repeat protein 39B

AlphaFold DB , UniProt , Accession A0A087Y146, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 586 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	L	26	Very low	24.6	Very low	172 Å²	172	158.4 Å²	158.4	90%	0.901	75%	0.748	S	S	*	*				0	-50.6	0	-116.3	70.4	0	0	0	112.7	F3 I4 L5	L1-F3 VanDerWaalsContact C-N 3.29Å; L1-F3 PolarHBondContact O-N 3.01Å; L1-I4 PolarHBondContact O-N 2.64Å; L1-L5 PolarHBondContact O-N 3.24Å
2	F	22.2	Very low	24.9	Very low	186 Å²	186	162.7 Å²	162.7	82%	0.816	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-27.2	176.7	-158.3	-103.1	0	0	0	114.5
3	F	21.6	Very low	25.7	Very low	187 Å²	187	157.9 Å²	157.9	82%	0.82	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-14.9	177	-123.5	-93.4	0	0	0	114.6	L1	L1-F3 VanDerWaalsContact C-N 3.29Å; L1-F3 PolarHBondContact O-N 3.01Å
4	I	22.2	Very low	26.2	Very low	114 Å²	114	153.4 Å²	153.4	59%	0.585	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-29.5	-177.4	-64.4	175.2	0	0	0	110.6	L1 N6 I8	L1-I4 PolarHBondContact O-N 2.64Å; I4-N6 VanDerWaalsContact C-N 3.28Å; I4-N6 PolarHBondContact O-N 3.12Å; I4-I8 HydrophobicContact CG2-CD1 4.43Å
5	L	25	Very low	26.4	Very low	123 Å²	123	154.3 Å²	154.3	64%	0.644	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-69.7	-23.8	174.2	-74.1	164.1	0	0	0	113.2	L1 Q7	L1-L5 PolarHBondContact O-N 3.24Å; L5-Q7 VanDerWaalsContact C-N 3.34Å; L5-Q7 PolarHBondContact O-N 3.31Å
6	N	26	Very low	26.6	Very low	129 Å²	129	153.4 Å²	153.4	69%	0.69	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-81.4	-6.8	-179.2	-115.6	-19.3	0	0	0	114.6	I4	I4-N6 VanDerWaalsContact C-N 3.28Å; I4-N6 PolarHBondContact O-N 3.12Å
7	Q	23.7	Very low	27.2	Very low	172 Å²	172	152.2 Å²	152.2	80%	0.804	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-101.9	-11.3	175.4	-76.3	-152	-15.9	0	0	114.4	L5	L5-Q7 VanDerWaalsContact C-N 3.34Å; L5-Q7 PolarHBondContact O-N 3.31Å
8	I	25.8	Very low	27.4	Very low	124 Å²	124	153.6 Å²	153.6	64%	0.636	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-15.1	-173.3	-61.3	174.2	0	0	0	112.3	I4	I4-I8 HydrophobicContact CG2-CD1 4.43Å
9	Y	26.5	Very low	27.4	Very low	216 Å²	216	153.4 Å²	153.4	85%	0.847	75%	0.748	S	S	*	*			trans	-120.4	49.4	178.3	-95	-90.9	0	0	0	113.5	P11	Y9-P11 WeakPolarHBondContact O-CD 3.48Å
10	R	24	Very low	27.9	Very low	216 Å²	216	152.2 Å²	152.2	82%	0.815	74%	0.744	S	S	*	*			trans	-92	111.1	159	-94	-170.6	-178.7	-175	1.3	109.2	K12	R10-K12 PolarHBondContact O-N 3.02Å; R10-K12 VanDerWaalsContact O-N 3.17Å
11	P	27.3	Very low	28.6	Very low	103 Å²	103	152.8 Å²	152.8	67%	0.669	75%	0.745	S	S	*	*			trans	-63.9	117.4	160.5	24.9	-28.2	0	0	0	108.1	Y9 T13	Y9-P11 WeakPolarHBondContact O-CD 3.48Å; P11-T13 PolarHBondContact O-N 3.25Å
12	K	28.3	Very low	29	Very low	210 Å²	210	153.6 Å²	153.6	91%	0.913	74%	0.744	S	S	*	*	S	Bend	trans	-67.7	82.9	168.5	-78.1	-177.4	174.4	-179.7	0	108.9	R10	R10-K12 PolarHBondContact O-N 3.02Å; R10-K12 VanDerWaalsContact O-N 3.17Å
13	T	35.5	Very low	29.4	Very low	101 Å²	101	152.1 Å²	152.1	62%	0.62	75%	0.745	S	S	*	*			trans	-140.9	2	170.4	32	0	0	0	0	114.6	P11	P11-T13 PolarHBondContact O-N 3.25Å
14	S	32.9	Very low	29.9	Very low	94 Å²	94	148 Å²	148	66%	0.657	74%	0.739	S	S	*	*	S	Bend	trans	-90.8	-6.4	-178.4	70.3	0	0	0	0	116.2
15	E	29.5	Very low	30.5	Very low	168 Å²	168	146.9 Å²	146.9	79%	0.785	76%	0.756	S	S	*	*	S	Bend	trans	-95	-19.5	-178.9	-98.8	174.1	164.7	0	0	114.5
16	N	28.7	Very low	31.1	Very low	140 Å²	140	147.4 Å²	147.4	75%	0.749	76%	0.758	S	S	*	*	S	Bend	trans	-88.8	-11.1	178.6	-77.8	-15.4	0	0	0	114.3
17	L	37.3	Very low	31.9	Very low	132 Å²	132	148.3 Å²	148.3	69%	0.691	76%	0.761	S	S	*	*	S	Bend	trans	-86.8	-11.6	178.2	-86.2	150	0	0	0	113.9
18	K	30.2	Very low	33.3	Very low	178 Å²	178	147.4 Å²	147.4	77%	0.774	76%	0.761	S	S	*	*	S	Bend	trans	-89.7	-14.7	-179.6	-75.9	-175.9	175.9	-179.1	0	114.6
19	N	27.5	Very low	35.2	Very low	149 Å²	149	149 Å²	149	80%	0.797	77%	0.765	S	S	*	*	S	Bend	trans	-101	9.6	-174	-84	-15.4	0	0	0	115.4
20	I	38.2	Very low	37.8	Very low	130 Å²	130	140.5 Å²	140.5	67%	0.667	73%	0.734	S	S	*	*	S	Bend	trans	-99.3	-12.8	178.4	-59.9	177.3	0	0	0	112.5
21	H	41.3	Very low	40.9	Very low	165 Å²	165	134.1 Å²	134.1	76%	0.764	72%	0.716	S	S	*	*	S	Bend	trans	-104.3	40.1	-174.7	-72.2	-52.3	0	0	0	115.5
22	Q	34.5	Very low	43.9	Very low	189 Å²	189	130.2 Å²	130.2	88%	0.883	69%	0.69	S	S	*	*	S	Bend	trans	-141.1	69.8	160.2	-79.5	-170.1	-17.8	0	0	110.6
23	N	31.2	Very low	47	Very low	155 Å²	155	124.2 Å²	124.2	83%	0.829	67%	0.665	S	S	*	*	S	Bend	trans	-165.6	139.9	144.5	-110	-22.4	0	0	0	112.6
24	S	32.6	Very low	49.7	Very low	101 Å²	101	121.7 Å²	121.7	71%	0.706	65%	0.649	S	S	*	*			trans	65.1	113.7	166.9	48.5	0	0	0	0	118.8	I26	S24-I26 VanDerWaalsContact C-N 3.3Å; S24-I26 PolarHBondContact O-N 3.22Å
25	G	35.4	Very low	52.7	Low	90 Å²	90	117.3 Å²	117.3	93%	0.928	62%	0.619	S	S	*	*	S	Bend	trans	-70	75	172.6	0	0	0	0	0	113.9
26	I	36.9	Very low	55.9	Low	134 Å²	134	109.6 Å²	109.6	69%	0.687	58%	0.583	S	S	*	*			trans	-131.6	107.6	158.9	-58.2	175.6	0	0	0	105.1	S24 L28	S24-I26 VanDerWaalsContact C-N 3.3Å; S24-I26 PolarHBondContact O-N 3.22Å; I26-L28 VanDerWaalsContact C-N 3.29Å; I26-L28 PolarHBondContact O-N 3.44Å
27	I	43.6	Very low	59	Low	147 Å²	147	108.6 Å²	108.6	75%	0.754	57%	0.574	S	S	*	*			trans	-69.3	96.3	169.8	-60.1	172.8	0	0	0	105.5	Q29	I27-Q29 PolarHBondContact O-N 3.47Å
28	L	53.1	Low	61.8	Low	153 Å²	153	105.1 Å²	105.1	80%	0.801	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-54.8	124.4	168.3	-85.3	150.5	0	0	0	107.8	I26 L30	I26-L28 VanDerWaalsContact C-N 3.29Å; I26-L28 PolarHBondContact O-N 3.44Å; L28-L30 PolarHBondContact O-N 3.42Å; L28-L30 VanDerWaalsContact O-N 3.16Å
29	Q	64.1	Low	65	Low	157 Å²	157	97 Å²	97	73%	0.734	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-60.9	117.3	174.9	-171.1	171.8	-8.1	0	0	107.7	I27 D31	I27-Q29 PolarHBondContact O-N 3.47Å; Q29-D31 PolarHBondContact O-N 2.97Å
30	L	81.8	Confident	68.3	Low	38 Å²	38	92.6 Å²	92.6	20%	0.199	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-67.4	122.1	179	-178	67.6	0	0	0	108.8	L28 T34 A35	L28-L30 PolarHBondContact O-N 3.42Å; L28-L30 VanDerWaalsContact O-N 3.16Å; L30-T34 HydrophobicContact CD1-CG2 3.44Å; L30-T34 VanDerWaalsContact CD1-CG2 3.44Å; L30-A35 HydrophobicContact CD2-CB 3.78Å; L30-A35 HydrophobicContact CG-CB 4.21Å
31	D	89.5	Confident	71.1	Confident	82 Å²	82	90.4 Å²	90.4	44%	0.439	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-72.6	161.9	175.2	69.7	88.8	0	0	0	111.6	Q29 E33 T34 A35	Q29-D31 PolarHBondContact O-N 2.97Å; D31-E33 PolarHBondContact O-N 2.62Å; D31-E33 WeakPolarHBondContact OD1-CB 3.4Å; D31-E33 PolarHBondContact OD1-N 3.4Å; D31-E33 VanDerWaalsContact OD1-N 3.07Å; D31-T34 VanDerWaalsContact CG-OG1 3.32Å; D31-T34 PolarHBondContact OD1-N 3.11Å; D31-T34 PolarHBondContact OD1-OG1 2.72Å; D31-T34 WeakPolarHBondContact OD2-CB 3.4Å; D31-T34 PolarHBondContact OD2-OG1 2.66Å; D31-A35 WeakPolarHBondContact O-CB 3.34Å; D31-A35 PolarHBondContact O-N 3.3Å; D31-A35 VanDerWaalsContact O-N 3.08Å
32	L	91.1	Very high	73.8	Confident	21 Å²	21	82.7 Å²	82.7	11%	0.11	45%	0.454	C	S	.	.	H	α-helix	trans	-64.6	-36.8	-174.6	179.2	61.3	0	0	0	113.1	A35 L36 M66 Y67 E130 H134 T192	L32-A35 PolarHBondContact O-N 2.7Å; L32-L36 HydrophobicContact CD1-CD1 4.34Å; L32-L36 HydrophobicContact CD1-CG 4.5Å; L32-L36 HydrophobicContact CG-CD1 4.15Å; L32-L36 VanDerWaalsContact O-CG 3.32Å; L32-L36 WeakPolarHBondContact O-CG 3.43Å; L32-L36 PolarHBondContact O-N 3.08Å; L32-M66 HydrophobicContact CD1-CE 4.44Å; L32-Y67 HydrophobicContact CD1-CD2 3.94Å; L32-Y67 HydrophobicContact CD1-CE2 3.69Å; L32-E130 HydrophobicContact CD2-CB 4.21Å; L32-H134 HydrophobicContact CD1-CB 4.2Å; L32-H134 HydrophobicContact CD2-CB 4.4Å; L32-T192 HydrophobicContact CD2-CG2 4.1Å; L32-T192 HydrophobicContact CG-CG2 4.18Å
33	E	92.4	Very high	76.8	Confident	85 Å²	85	75.5 Å²	75.5	40%	0.397	42%	0.421	S	S	.	.	H	α-helix	trans	-68.1	-49.6	-178.5	-173.2	167.6	-151.1	0	0	109.9	D31 A35 L36 E37 N191 T192	D31-E33 PolarHBondContact O-N 2.62Å; D31-E33 WeakPolarHBondContact OD1-CB 3.4Å; D31-E33 PolarHBondContact OD1-N 3.4Å; D31-E33 VanDerWaalsContact OD1-N 3.07Å; E33-A35 VanDerWaalsContact C-N 3.27Å; E33-A35 PolarHBondContact O-N 3.34Å; E33-L36 WeakPolarHBondContact O-CB 3.29Å; E33-L36 PolarHBondContact O-N 3.18Å; E33-L36 VanDerWaalsContact O-N 3.1Å; E33-E37 WeakPolarHBondContact O-CG 3.46Å; E33-E37 PolarHBondContact O-N 2.85Å; E33-N191 PolarHBondContact OE1-ND2 3Å; E33-T192 HydrophobicContact CB-CG2 4.42Å
34	T	93.3	Very high	80	Confident	47 Å²	47	70.6 Å²	70.6	29%	0.288	39%	0.393	S	S	.	.	H	α-helix	trans	-58.5	-40.3	174.8	-54.6	0	0	0	0	111.4	L30 D31 L36 E37 E38	L30-T34 HydrophobicContact CD1-CG2 3.44Å; L30-T34 VanDerWaalsContact CD1-CG2 3.44Å; D31-T34 VanDerWaalsContact CG-OG1 3.32Å; D31-T34 PolarHBondContact OD1-N 3.11Å; D31-T34 PolarHBondContact OD1-OG1 2.72Å; D31-T34 WeakPolarHBondContact OD2-CB 3.4Å; D31-T34 PolarHBondContact OD2-OG1 2.66Å; T34-L36 VanDerWaalsContact C-N 3.33Å; T34-L36 PolarHBondContact O-N 2.97Å; T34-E37 PolarHBondContact O-N 3.35Å; T34-E38 HydrophobicContact CG2-CG 4.34Å; T34-E38 WeakPolarHBondContact O-CB 3.49Å; T34-E38 WeakPolarHBondContact O-CG 3.2Å; T34-E38 PolarHBondContact O-N 3.36Å
35	A	95.3	Very high	83.1	Confident	3 Å²	3	67.2 Å²	67.2	3%	0.025	37%	0.367	C	S	.	.	H	α-helix	trans	-62.8	-39	177.7	0	0	0	0	0	113.1	L30 D31 L32 E33 C39	L30-A35 HydrophobicContact CD2-CB 3.78Å; L30-A35 HydrophobicContact CG-CB 4.21Å; D31-A35 WeakPolarHBondContact O-CB 3.34Å; D31-A35 PolarHBondContact O-N 3.3Å; D31-A35 VanDerWaalsContact O-N 3.08Å; L32-A35 PolarHBondContact O-N 2.7Å; E33-A35 VanDerWaalsContact C-N 3.27Å; E33-A35 PolarHBondContact O-N 3.34Å; A35-C39 WeakPolarHBondContact O-CB 3.34Å; A35-C39 PolarHBondContact O-N 3.46Å; A35-C39 VanDerWaalsContact O-N 3.15Å; A35-C39 PolarHBondContact O-SG 3Å
36	L	95.5	Very high	86	Confident	6 Å²	6	63.7 Å²	63.7	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-67.8	-43.6	176.3	-77	165.2	0	0	0	111.7	L32 E33 T34 C39 N40 Y67 T192 H195	L32-L36 HydrophobicContact CD1-CD1 4.34Å; L32-L36 HydrophobicContact CD1-CG 4.5Å; L32-L36 HydrophobicContact CG-CD1 4.15Å; L32-L36 VanDerWaalsContact O-CG 3.32Å; L32-L36 WeakPolarHBondContact O-CG 3.43Å; L32-L36 PolarHBondContact O-N 3.08Å; E33-L36 WeakPolarHBondContact O-CB 3.29Å; E33-L36 PolarHBondContact O-N 3.18Å; E33-L36 VanDerWaalsContact O-N 3.1Å; T34-L36 VanDerWaalsContact C-N 3.33Å; T34-L36 PolarHBondContact O-N 2.97Å; L36-C39 PolarHBondContact O-N 3.15Å; L36-N40 WeakPolarHBondContact O-CB 3.37Å; L36-N40 PolarHBondContact O-N 3.32Å; L36-Y67 HydrophobicContact CD2-CD1 3.78Å; L36-Y67 HydrophobicContact CD2-CD2 4.21Å; L36-Y67 HydrophobicContact CD2-CE1 3.31Å; L36-Y67 HydrophobicContact CD2-CE2 3.84Å; L36-Y67 HydrophobicContact CD2-CG 4.19Å; L36-Y67 HydrophobicContact CG-CD2 4.48Å; L36-Y67 HydrophobicContact CG-CE1 4.48Å; L36-Y67 HydrophobicContact CG-CE2 4.29Å; L36-T192 HydrophobicContact CD1-CG2 4.06Å; L36-H195 HydrophobicContact CD1-CB 4.14Å; L36-H195 HydrophobicContact CD2-CB 3.78Å
37	E	94.6	Very high	88.9	Confident	118 Å²	118	57.6 Å²	57.6	55%	0.551	30%	0.295	S	S	*	.	H	α-helix	trans	-62.3	-49	177.4	-71.4	-175.3	165.6	0	0	111.9	E33 T34 C39 N40 V41	E33-E37 WeakPolarHBondContact O-CG 3.46Å; E33-E37 PolarHBondContact O-N 2.85Å; T34-E37 PolarHBondContact O-N 3.35Å; E37-C39 VanDerWaalsContact C-N 3.31Å; E37-C39 PolarHBondContact O-N 3.18Å; E37-N40 WeakPolarHBondContact O-CB 3.43Å; E37-N40 PolarHBondContact O-N 3.24Å; E37-N40 VanDerWaalsContact O-N 3.09Å; E37-V41 PolarHBondContact O-N 2.93Å
38	E	96.2	Very high	91.4	Very high	59 Å²	59	54.2 Å²	54.2	28%	0.276	28%	0.278	S	S	.	.	H	α-helix	trans	-59.1	-42.4	177	-73.6	-176.6	149	0	0	111.2	T34 N40 V41 A42 R61 H68	T34-E38 HydrophobicContact CG2-CG 4.34Å; T34-E38 WeakPolarHBondContact O-CB 3.49Å; T34-E38 WeakPolarHBondContact O-CG 3.2Å; T34-E38 PolarHBondContact O-N 3.36Å; E38-N40 VanDerWaalsContact C-N 3.33Å; E38-N40 PolarHBondContact O-N 3.49Å; E38-V41 WeakPolarHBondContact O-CB 3.23Å; E38-V41 PolarHBondContact O-N 3.13Å; E38-A42 PolarHBondContact O-N 3.43Å; E38-A42 VanDerWaalsContact O-N 3.07Å; E38-R61 IonicContact OE1-CZ 2.96Å; E38-R61 VanDerWaalsContact OE1-CZ 3.26Å; E38-R61 IonicContact OE1-NE 3.07Å; E38-R61 PolarHBondContact OE1-NE 3.05Å; E38-R61 IonicContact OE1-NH2 3.79Å; E38-R61 PolarHBondContact OE1-NH2 3.23Å; E38-R61 WeakPolarHBondContact OE2-CD 3.42Å; E38-R61 IonicContact OE2-CZ 3.52Å; E38-R61 VanDerWaalsContact OE2-CZ 3.27Å; E38-R61 IonicContact OE2-NE 2.67Å; E38-R61 PolarHBondContact OE2-NE 3.05Å; E38-R61 IonicContact OE2-NH1 3.86Å; E38-R61 IonicContact OE2-NH2 3.86Å; E38-H68 IonicContact OE2-CE1 2.89Å; E38-H68 PolarHBondContact OE2-CE1 2.98Å; E38-H68 IonicContact OE2-NE2 3.27Å; E38-H68 PolarHBondContact OE2-NE2 3.17Å
39	C	97.1	Very high	93.4	Very high	7 Å²	7	47.6 Å²	47.6	5%	0.047	24%	0.244	C	C	.	.	H	α-helix	trans	-67.8	-32	175.8	-71.2	0	0	0	0	113	A35 L36 E37 V41 A42 L43 L58 Y67 L247	A35-C39 WeakPolarHBondContact O-CB 3.34Å; A35-C39 PolarHBondContact O-N 3.46Å; A35-C39 VanDerWaalsContact O-N 3.15Å; A35-C39 PolarHBondContact O-SG 3Å; L36-C39 PolarHBondContact O-N 3.15Å; E37-C39 VanDerWaalsContact C-N 3.31Å; E37-C39 PolarHBondContact O-N 3.18Å; C39-V41 VanDerWaalsContact C-N 3.34Å; C39-A42 WeakPolarHBondContact O-CB 3.43Å; C39-A42 PolarHBondContact O-N 3.33Å; C39-L43 PolarHBondContact O-N 3.39Å; C39-L58 HydrophobicContact CB-CD2 4.47Å; C39-Y67 VanDerWaalsContact SG-C 3.59Å; C39-L247 HydrophobicContact CB-CD1 4.46Å; C39-L247 HydrophobicContact CB-CD2 4Å
40	N	96.3	Very high	95	Very high	57 Å²	57	46.1 Å²	46.1	31%	0.305	23%	0.231	S	C	.	.	H	α-helix	trans	-68	-35.3	173.9	-173.6	57.7	0	0	0	111.6	L36 E37 E38 L43 H44 L247	L36-N40 WeakPolarHBondContact O-CB 3.37Å; L36-N40 PolarHBondContact O-N 3.32Å; E37-N40 WeakPolarHBondContact O-CB 3.43Å; E37-N40 PolarHBondContact O-N 3.24Å; E37-N40 VanDerWaalsContact O-N 3.09Å; E38-N40 VanDerWaalsContact C-N 3.33Å; E38-N40 PolarHBondContact O-N 3.49Å; N40-L43 WeakPolarHBondContact O-CB 3.46Å; N40-L43 PolarHBondContact O-N 3.28Å; N40-H44 PolarHBondContact ND2-NE2 3.36Å; N40-H44 PolarHBondContact O-CD2 3.4Å; N40-H44 PolarHBondContact O-N 3.3Å; N40-L247 HydrophobicContact CB-CD1 4.06Å
41	V	97.4	Very high	95.7	Very high	84 Å²	84	44.4 Å²	44.4	51%	0.509	22%	0.222	S	C	.	.	H	α-helix	trans	-62.5	-44.8	170.5	175.8	0	0	0	0	110.9	E37 E38 C39 L43 H44 L45	E37-V41 PolarHBondContact O-N 2.93Å; E38-V41 WeakPolarHBondContact O-CB 3.23Å; E38-V41 PolarHBondContact O-N 3.13Å; C39-V41 VanDerWaalsContact C-N 3.34Å; V41-L43 VanDerWaalsContact C-N 3.29Å; V41-L43 PolarHBondContact O-N 3.25Å; V41-H44 WeakPolarHBondContact O-CB 3.35Å; V41-H44 PolarHBondContact O-N 2.96Å; V41-H44 VanDerWaalsContact O-N 3.14Å; V41-L45 WeakPolarHBondContact O-CG 3.29Å; V41-L45 PolarHBondContact O-N 3.02Å
42	A	98.2	Very high	96	Very high	3 Å²	3	42.7 Å²	42.7	3%	0.025	22%	0.22	C	C	.	.	H	α-helix	trans	-59.8	-40.2	175.3	0	0	0	0	0	112.1	E38 C39 H44 L45 F46 A54 S57 L58	E38-A42 PolarHBondContact O-N 3.43Å; E38-A42 VanDerWaalsContact O-N 3.07Å; C39-A42 WeakPolarHBondContact O-CB 3.43Å; C39-A42 PolarHBondContact O-N 3.33Å; A42-H44 PolarHBondContact O-N 3.01Å; A42-L45 WeakPolarHBondContact O-CB 3.44Å; A42-L45 PolarHBondContact O-N 3.15Å; A42-F46 WeakPolarHBondContact O-CB 3.34Å; A42-F46 PolarHBondContact O-N 3.31Å; A42-A54 WeakPolarHBondContact O-CB 3.43Å; A42-S57 WeakPolarHBondContact CB-OG 3.48Å; A42-L58 HydrophobicContact CB-CD1 3.85Å; A42-L58 HydrophobicContact CB-CD2 3.62Å; A42-L58 HydrophobicContact CB-CG 3.61Å
43	L	97.4	Very high	96.3	Very high	38 Å²	38	44.6 Å²	44.6	20%	0.199	23%	0.23	C	C	.	.	H	α-helix	trans	-62.3	-41.5	174.2	177.9	61.9	0	0	0	112	C39 N40 V41 L45 F46 L47 L247 I250	C39-L43 PolarHBondContact O-N 3.39Å; N40-L43 WeakPolarHBondContact O-CB 3.46Å; N40-L43 PolarHBondContact O-N 3.28Å; V41-L43 VanDerWaalsContact C-N 3.29Å; V41-L43 PolarHBondContact O-N 3.25Å; L43-L45 VanDerWaalsContact C-N 3.34Å; L43-L45 PolarHBondContact O-N 3.43Å; L43-F46 WeakPolarHBondContact O-CB 3.31Å; L43-F46 PolarHBondContact O-N 2.96Å; L43-L47 HydrophobicContact CD1-CD1 4.04Å; L43-L47 HydrophobicContact CD1-CG 4.05Å; L43-L47 HydrophobicContact CG-CD1 4.06Å; L43-L47 HydrophobicContact CG-CG 4.44Å; L43-L47 WeakPolarHBondContact O-CG 3.24Å; L43-L47 PolarHBondContact O-N 3.21Å; L43-L247 HydrophobicContact CB-CD1 4.23Å; L43-L247 HydrophobicContact CD2-CD1 3.88Å; L43-I250 HydrophobicContact CD1-CG2 3.97Å; L43-I250 HydrophobicContact CD2-CG2 3.84Å; L43-I250 HydrophobicContact CG-CG2 4.49Å
44	H	97.5	Very high	96.5	Very high	53 Å²	53	40.5 Å²	40.5	25%	0.245	21%	0.211	C	C	.	.	H	α-helix	trans	-61.7	-40.3	174.6	-77.9	-53.3	0	0	0	112.8	N40 V41 A42 N48 K287 Y288	N40-H44 PolarHBondContact ND2-NE2 3.36Å; N40-H44 PolarHBondContact O-CD2 3.4Å; N40-H44 PolarHBondContact O-N 3.3Å; V41-H44 WeakPolarHBondContact O-CB 3.35Å; V41-H44 PolarHBondContact O-N 2.96Å; V41-H44 VanDerWaalsContact O-N 3.14Å; A42-H44 PolarHBondContact O-N 3.01Å; H44-N48 PolarHBondContact O-N 3.16Å; H44-N48 PolarHBondContact O-ND2 2.88Å; H44-K287 PolarHBondContact CE1-NZ 2.85Å; H44-Y288 PolarHBondContact CE1-OH 3.03Å; H44-Y288 AromaticContact ND1-CE1 3.84Å; H44-Y288 AromaticContact ND1-CZ 3.67Å; H44-Y288 PolarHBondContact ND1-OH 3.27Å
45	L	98	Very high	96.7	Very high	30 Å²	30	39.5 Å²	39.5	16%	0.157	20%	0.204	C	C	.	.	H	α-helix	trans	-62.1	-47.6	174.2	-69.7	169.7	0	0	0	110.6	V41 A42 L43 L47 N48 N49 R50 D53 A54	V41-L45 WeakPolarHBondContact O-CG 3.29Å; V41-L45 PolarHBondContact O-N 3.02Å; A42-L45 WeakPolarHBondContact O-CB 3.44Å; A42-L45 PolarHBondContact O-N 3.15Å; L43-L45 VanDerWaalsContact C-N 3.34Å; L43-L45 PolarHBondContact O-N 3.43Å; L45-L47 PolarHBondContact O-N 3.25Å; L45-N48 CarbonylContact O-C 3.32Å; L45-N48 PolarHBondContact O-N 3.2Å; L45-N48 VanDerWaalsContact O-N 3.14Å; L45-N49 PolarHBondContact O-N 3.45Å; L45-R50 HydrophobicContact CB-CB 4.2Å; L45-R50 HydrophobicContact CD2-CB 4.2Å; L45-R50 WeakPolarHBondContact O-CB 3.45Å; L45-R50 PolarHBondContact O-N 3.01Å; L45-D53 HydrophobicContact CD1-CB 4.13Å; L45-D53 HydrophobicContact CD2-CB 4.37Å; L45-A54 HydrophobicContact CB-CB 3.95Å
46	F	97.2	Very high	96.9	Very high	16 Å²	16	42.7 Å²	42.7	7%	0.07	23%	0.226	C	C	.	.	H	α-helix	trans	-57.2	-49	178.4	-177	-87.8	0	0	0	112.4	A42 L43 N48 N49 F51 A54 I75 M78 L293 W325	A42-F46 WeakPolarHBondContact O-CB 3.34Å; A42-F46 PolarHBondContact O-N 3.31Å; L43-F46 WeakPolarHBondContact O-CB 3.31Å; L43-F46 PolarHBondContact O-N 2.96Å; F46-N48 PolarHBondContact O-N 3.42Å; F46-N49 PolarHBondContact O-N 2.76Å; F46-F51 AromaticContact CD2-CD1 3.52Å; F46-F51 HydrophobicContact CD2-CD1 3.52Å; F46-F51 HydrophobicContact CD2-CE1 4.05Å; F46-F51 HydrophobicContact CE1-CE1 4.35Å; F46-F51 AromaticContact CE2-CD1 3.5Å; F46-F51 HydrophobicContact CE2-CD1 3.5Å; F46-F51 VanDerWaalsContact CE2-CD1 3.5Å; F46-F51 AromaticContact CE2-CE1 3.82Å; F46-F51 HydrophobicContact CE2-CE1 3.82Å; F46-F51 HydrophobicContact CG-CD1 4.15Å; F46-F51 HydrophobicContact CG-CE1 4.37Å; F46-F51 HydrophobicContact CZ-CD1 4.13Å; F46-F51 AromaticContact CZ-CE1 3.96Å; F46-F51 HydrophobicContact CZ-CE1 3.96Å; F46-F51 WeakPolarHBondContact O-CE1 3.47Å; F46-A54 HydrophobicContact CB-CB 4.09Å; F46-I75 HydrophobicContact CD2-CD1 4.04Å; F46-I75 HydrophobicContact CD2-CG1 4.01Å; F46-I75 HydrophobicContact CD2-CG2 4.3Å; F46-I75 HydrophobicContact CE2-CG1 4.2Å; F46-I75 HydrophobicContact CE2-CG2 4.11Å; F46-M78 HydrophobicContact CE1-SD 4.32Å; F46-M78 HydrophobicContact CZ-CE 4.28Å; F46-M78 HydrophobicContact CZ-SD 3.62Å; F46-L293 HydrophobicContact CE1-CD1 3.89Å; F46-W325 AromaticContact CE2-CH2 3.46Å; F46-W325 HydrophobicContact CE2-CH2 3.46Å; F46-W325 VanDerWaalsContact CE2-CH2 3.46Å; F46-W325 HydrophobicContact CE2-CZ2 4.11Å; F46-W325 AromaticContact CE2-CZ3 3.69Å; F46-W325 HydrophobicContact CE2-CZ3 3.69Å; F46-W325 AromaticContact CZ-CH2 3.99Å; F46-W325 HydrophobicContact CZ-CH2 3.99Å; F46-W325 AromaticContact CZ-CZ3 3.78Å; F46-W325 HydrophobicContact CZ-CZ3 3.78Å
47	L	96.7	Very high	96.9	Very high	6 Å²	6	44.8 Å²	44.8	3%	0.031	24%	0.241	C	C	.	.	H	α-helix	trans	-69.2	-15.1	-179.6	-65.2	176.1	0	0	0	113.7	L43 L45 I250 Y288 G291 L293 M294	L43-L47 HydrophobicContact CD1-CD1 4.04Å; L43-L47 HydrophobicContact CD1-CG 4.05Å; L43-L47 HydrophobicContact CG-CD1 4.06Å; L43-L47 HydrophobicContact CG-CG 4.44Å; L43-L47 WeakPolarHBondContact O-CG 3.24Å; L43-L47 PolarHBondContact O-N 3.21Å; L45-L47 PolarHBondContact O-N 3.25Å; L47-I250 HydrophobicContact CD1-CG1 4.38Å; L47-I250 HydrophobicContact CD2-CG1 4.17Å; L47-Y288 HydrophobicContact CB-CD1 4.08Å; L47-Y288 HydrophobicContact CB-CD2 4.06Å; L47-Y288 HydrophobicContact CB-CE1 4.01Å; L47-Y288 HydrophobicContact CB-CE2 4Å; L47-Y288 HydrophobicContact CB-CG 4.09Å; L47-Y288 HydrophobicContact CD1-CD2 4.21Å; L47-Y288 HydrophobicContact CD1-CE2 3.53Å; L47-Y288 HydrophobicContact CG-CE2 4.39Å; L47-G291 VanDerWaalsContact O-CA 3.32Å; L47-G291 WeakPolarHBondContact O-CA 3.34Å; L47-L293 HydrophobicContact CD2-CD1 4.28Å; L47-M294 HydrophobicContact CD2-CE 3.87Å
48	N	96.4	Very high	97.1	Very high	75 Å²	75	39.3 Å²	39.3	40%	0.401	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	21.9	171.8	-76	-69	0	0	0	113	H44 L45 F46 R50 Y288	H44-N48 PolarHBondContact O-N 3.16Å; H44-N48 PolarHBondContact O-ND2 2.88Å; L45-N48 CarbonylContact O-C 3.32Å; L45-N48 PolarHBondContact O-N 3.2Å; L45-N48 VanDerWaalsContact O-N 3.14Å; F46-N48 PolarHBondContact O-N 3.42Å; N48-R50 PolarHBondContact O-N 3.36Å; N48-Y288 VanDerWaalsContact ND2-CD1 3.33Å; N48-Y288 WeakPolarHBondContact ND2-CD1 3.49Å; N48-Y288 WeakPolarHBondContact ND2-CE1 3.4Å
49	N	96.6	Very high	97.1	Very high	15 Å²	15	40.9 Å²	40.9	8%	0.08	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	14.9	177.5	-41.5	-40.3	0	0	0	115.5	L45 F46 F51 N290 A292 T321 Q322	L45-N49 PolarHBondContact O-N 3.45Å; F46-N49 PolarHBondContact O-N 2.76Å; N49-F51 VanDerWaalsContact C-N 3.28Å; N49-F51 HydrophobicContact CB-CE2 4.08Å; N49-F51 HydrophobicContact CB-CZ 4.15Å; N49-F51 PolarHBondContact O-N 2.98Å; N49-N290 PolarHBondContact ND2-O 3.26Å; N49-A292 WeakPolarHBondContact OD1-CB 3.45Å; N49-A292 PolarHBondContact OD1-N 3.38Å; N49-T321 WeakPolarHBondContact ND2-CG2 3.37Å; N49-T321 PolarHBondContact ND2-OG1 3.08Å; N49-Q322 HydrophobicContact CB-CB 3.78Å
50	R	96.8	Very high	97.1	Very high	125 Å²	125	45.1 Å²	45.1	47%	0.472	25%	0.25	S	C	.	.			trans	-92.1	62.9	175.4	-62.5	-176.7	63.6	-171.2	-1.8	109.4	L45 N48 D53 A54	L45-R50 HydrophobicContact CB-CB 4.2Å; L45-R50 HydrophobicContact CD2-CB 4.2Å; L45-R50 WeakPolarHBondContact O-CB 3.45Å; L45-R50 PolarHBondContact O-N 3.01Å; N48-R50 PolarHBondContact O-N 3.36Å; R50-D53 HydrophobicContact CB-CB 4.08Å; R50-D53 IonicContact CZ-OD2 3.96Å; R50-D53 IonicContact NE-OD2 3.54Å; R50-D53 PolarHBondContact NE-OD2 3.45Å; R50-D53 VanDerWaalsContact NH2-CG 3.26Å; R50-D53 IonicContact NH2-OD1 3.25Å; R50-D53 IonicContact NH2-OD2 3.62Å; R50-D53 PolarHBondContact NH2-OD2 3.23Å; R50-D53 PolarHBondContact O-N 3.04Å; R50-A54 PolarHBondContact O-N 3.31Å
51	F	95.5	Very high	97	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.009	25%	0.25	C	C	.	.	H	α-helix	trans	-67.5	-43.3	-169.3	-52.7	-65.9	0	0	0	112	F46 N49 D53 A54 L55 Q322 E324 W325 I328	F46-F51 AromaticContact CD2-CD1 3.52Å; F46-F51 HydrophobicContact CD2-CD1 3.52Å; F46-F51 HydrophobicContact CD2-CE1 4.05Å; F46-F51 HydrophobicContact CE1-CE1 4.35Å; F46-F51 AromaticContact CE2-CD1 3.5Å; F46-F51 HydrophobicContact CE2-CD1 3.5Å; F46-F51 VanDerWaalsContact CE2-CD1 3.5Å; F46-F51 AromaticContact CE2-CE1 3.82Å; F46-F51 HydrophobicContact CE2-CE1 3.82Å; F46-F51 HydrophobicContact CG-CD1 4.15Å; F46-F51 HydrophobicContact CG-CE1 4.37Å; F46-F51 HydrophobicContact CZ-CD1 4.13Å; F46-F51 AromaticContact CZ-CE1 3.96Å; F46-F51 HydrophobicContact CZ-CE1 3.96Å; F46-F51 WeakPolarHBondContact O-CE1 3.47Å; N49-F51 VanDerWaalsContact C-N 3.28Å; N49-F51 HydrophobicContact CB-CE2 4.08Å; N49-F51 HydrophobicContact CB-CZ 4.15Å; N49-F51 PolarHBondContact O-N 2.98Å; F51-D53 VanDerWaalsContact C-N 3.33Å; F51-D53 PolarHBondContact O-N 3.15Å; F51-A54 WeakPolarHBondContact O-CB 3.39Å; F51-A54 PolarHBondContact O-N 3.47Å; F51-L55 PolarHBondContact O-N 3.32Å; F51-Q322 HydrophobicContact CE2-CB 4.48Å; F51-Q322 HydrophobicContact CE2-CG 4.37Å; F51-E324 WeakPolarHBondContact CB-OE2 3.42Å; F51-E324 HydrophobicContact CD2-CB 3.97Å; F51-E324 PolarHBondContact N-OE2 3.29Å; F51-E324 VanDerWaalsContact N-OE2 3.15Å; F51-W325 HydrophobicContact CB-CD2 4.24Å; F51-W325 HydrophobicContact CB-CG 4.4Å; F51-W325 HydrophobicContact CB-CZ2 4.2Å; F51-W325 HydrophobicContact CD1-CD2 4.04Å; F51-W325 HydrophobicContact CD1-CE3 4.18Å; F51-W325 HydrophobicContact CD1-CZ2 4.39Å; F51-W325 HydrophobicContact CD1-CZ3 4.44Å; F51-W325 HydrophobicContact CD2-CB 3.99Å; F51-W325 AromaticContact CD2-CD1 3.66Å; F51-W325 AromaticContact CD2-CD2 3.83Å; F51-W325 HydrophobicContact CD2-CD2 3.83Å; F51-W325 AromaticContact CD2-CG 3.53Å; F51-W325 HydrophobicContact CD2-CG 3.53Å; F51-W325 HydrophobicContact CE1-CD2 4.33Å; F51-W325 HydrophobicContact CE1-CE3 4.14Å; F51-W325 HydrophobicContact CE2-CB 3.87Å; F51-W325 HydrophobicContact CE2-CD2 4.14Å; F51-W325 HydrophobicContact CE2-CE3 4.48Å; F51-W325 AromaticContact CE2-CG 3.85Å; F51-W325 HydrophobicContact CE2-CG 3.85Å; F51-W325 AromaticContact CG-CD1 3.93Å; F51-W325 AromaticContact CG-CD2 3.78Å; F51-W325 HydrophobicContact CG-CD2 3.78Å; F51-W325 AromaticContact CG-CE2 3.75Å; F51-W325 HydrophobicContact CG-CE3 4.37Å; F51-W325 AromaticContact CG-CG 3.94Å; F51-W325 HydrophobicContact CG-CG 3.94Å; F51-W325 HydrophobicContact CG-CZ2 4.37Å; F51-W325 AromaticContact CG-NE1 3.79Å; F51-W325 HydrophobicContact CZ-CD2 4.38Å; F51-W325 HydrophobicContact CZ-CE3 4.29Å; F51-I328 HydrophobicContact CE2-CD1 4.21Å; F51-I328 HydrophobicContact CZ-CD1 3.69Å
52	A	96.1	Very high	96.9	Very high	46 Å²	46	44.4 Å²	44.4	38%	0.38	24%	0.235	S	C	.	.	H	α-helix	trans	-62.8	-39.7	176.4	0	0	0	0	0	112.1	L55 S56 E324	A52-L55 PolarHBondContact O-N 2.93Å; A52-S56 VanDerWaalsContact O-CB 3.3Å; A52-S56 WeakPolarHBondContact O-CB 3.43Å; A52-S56 PolarHBondContact O-N 3.43Å; A52-S56 PolarHBondContact O-OG 2.88Å; A52-E324 WeakPolarHBondContact CB-OE2 3.32Å; A52-E324 PolarHBondContact N-OE2 3.1Å
53	D	97.6	Very high	96.7	Very high	61 Å²	61	46.8 Å²	46.8	33%	0.326	25%	0.252	S	S	.	.	H	α-helix	trans	-67.7	-39	176.2	-65.6	-48	0	0	0	111.6	L45 R50 F51 S56 S57	L45-D53 HydrophobicContact CD1-CB 4.13Å; L45-D53 HydrophobicContact CD2-CB 4.37Å; R50-D53 HydrophobicContact CB-CB 4.08Å; R50-D53 IonicContact CZ-OD2 3.96Å; R50-D53 IonicContact NE-OD2 3.54Å; R50-D53 PolarHBondContact NE-OD2 3.45Å; R50-D53 VanDerWaalsContact NH2-CG 3.26Å; R50-D53 IonicContact NH2-OD1 3.25Å; R50-D53 IonicContact NH2-OD2 3.62Å; R50-D53 PolarHBondContact NH2-OD2 3.23Å; R50-D53 PolarHBondContact O-N 3.04Å; F51-D53 VanDerWaalsContact C-N 3.33Å; F51-D53 PolarHBondContact O-N 3.15Å; D53-S56 PolarHBondContact O-N 3.22Å; D53-S57 WeakPolarHBondContact O-CB 3.12Å; D53-S57 PolarHBondContact O-N 3.18Å; D53-S57 PolarHBondContact O-OG 3.46Å
54	A	97.9	Very high	96.5	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.2	-50.1	174	0	0	0	0	0	111	A42 L45 F46 R50 F51 S56 S57 L58 I75	A42-A54 WeakPolarHBondContact O-CB 3.43Å; L45-A54 HydrophobicContact CB-CB 3.95Å; F46-A54 HydrophobicContact CB-CB 4.09Å; R50-A54 PolarHBondContact O-N 3.31Å; F51-A54 WeakPolarHBondContact O-CB 3.39Å; F51-A54 PolarHBondContact O-N 3.47Å; A54-S56 PolarHBondContact O-N 3.42Å; A54-S57 PolarHBondContact O-N 2.77Å; A54-S57 PolarHBondContact O-OG 3.39Å; A54-L58 WeakPolarHBondContact O-CG 3.5Å; A54-L58 PolarHBondContact O-N 3.42Å; A54-I75 HydrophobicContact CB-CD1 4.19Å
55	L	97.4	Very high	96.4	Very high	26 Å²	26	47.8 Å²	47.8	14%	0.136	26%	0.256	C	S	.	.	H	α-helix	trans	-60.1	-45.7	176	-75.4	169.6	0	0	0	112.3	F51 A52 S57 L58 E59 Y72 I75 L76	F51-L55 PolarHBondContact O-N 3.32Å; A52-L55 PolarHBondContact O-N 2.93Å; L55-S57 VanDerWaalsContact C-N 3.26Å; L55-S57 PolarHBondContact O-N 2.87Å; L55-L58 PolarHBondContact O-N 2.94Å; L55-L58 VanDerWaalsContact O-N 3.1Å; L55-E59 WeakPolarHBondContact O-CB 3.41Å; L55-E59 PolarHBondContact O-N 3.16Å; L55-Y72 HydrophobicContact CB-CD2 4.48Å; L55-Y72 HydrophobicContact CB-CE2 4.21Å; L55-Y72 HydrophobicContact CD2-CD2 3.68Å; L55-Y72 HydrophobicContact CD2-CE2 3.76Å; L55-Y72 HydrophobicContact CD2-CG 4.26Å; L55-I75 HydrophobicContact CD1-CG2 4.11Å; L55-I75 HydrophobicContact CD2-CB 3.84Å; L55-I75 HydrophobicContact CD2-CD1 4.36Å; L55-I75 HydrophobicContact CD2-CG2 3.61Å; L55-I75 HydrophobicContact CG-CG2 3.79Å; L55-L76 HydrophobicContact CD1-CD2 4.28Å; L55-L76 HydrophobicContact CD2-CD2 4.23Å; L55-L76 HydrophobicContact CD2-CG 4.24Å
56	S	97.6	Very high	96.3	Very high	70 Å²	70	46.7 Å²	46.7	49%	0.49	25%	0.25	S	S	.	.	H	α-helix	trans	-63.4	-33.1	-180	-59.1	0	0	0	0	112.3	A52 D53 A54 L58 P60	A52-S56 VanDerWaalsContact O-CB 3.3Å; A52-S56 WeakPolarHBondContact O-CB 3.43Å; A52-S56 PolarHBondContact O-N 3.43Å; A52-S56 PolarHBondContact O-OG 2.88Å; D53-S56 PolarHBondContact O-N 3.22Å; A54-S56 PolarHBondContact O-N 3.42Å; S56-L58 VanDerWaalsContact C-N 3.35Å; S56-P60 VanDerWaalsContact O-CD 3.27Å; S56-P60 WeakPolarHBondContact O-CD 3.31Å
57	S	97.4	Very high	96.3	Very high	49 Å²	49	46 Å²	46	34%	0.343	25%	0.247	S	C	.	.	H	α-helix	trans	-71.2	-30.9	175.6	71.9	0	0	0	0	112.7	A42 D53 A54 L55	A42-S57 WeakPolarHBondContact CB-OG 3.48Å; D53-S57 WeakPolarHBondContact O-CB 3.12Å; D53-S57 PolarHBondContact O-N 3.18Å; D53-S57 PolarHBondContact O-OG 3.46Å; A54-S57 PolarHBondContact O-N 2.77Å; A54-S57 PolarHBondContact O-OG 3.39Å; L55-S57 VanDerWaalsContact C-N 3.26Å; L55-S57 PolarHBondContact O-N 2.87Å
58	L	97.8	Very high	96.4	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-85.9	-32.6	-177.8	-65	168.2	0	0	0	113.5	C39 A42 A54 L55 S56 R61 K62 Y72 I75	C39-L58 HydrophobicContact CB-CD2 4.47Å; A42-L58 HydrophobicContact CB-CD1 3.85Å; A42-L58 HydrophobicContact CB-CD2 3.62Å; A42-L58 HydrophobicContact CB-CG 3.61Å; A54-L58 WeakPolarHBondContact O-CG 3.5Å; A54-L58 PolarHBondContact O-N 3.42Å; L55-L58 PolarHBondContact O-N 2.94Å; L55-L58 VanDerWaalsContact O-N 3.1Å; S56-L58 VanDerWaalsContact C-N 3.35Å; L58-R61 PolarHBondContact O-N 2.94Å; L58-K62 PolarHBondContact O-N 3.03Å; L58-Y72 HydrophobicContact CB-CD2 4.11Å; L58-I75 HydrophobicContact CD1-CD1 3.8Å
59	E	96.9	Very high	96.5	Very high	92 Å²	92	42.4 Å²	42.4	43%	0.43	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-55.4	-45.8	-171.1	-178.7	164.9	-136.7	0	0	115.4	L55 R61 K62 Y72	L55-E59 WeakPolarHBondContact O-CB 3.41Å; L55-E59 PolarHBondContact O-N 3.16Å; E59-R61 PolarHBondContact O-N 3.26Å; E59-K62 HydrophobicContact CG-CD 4.4Å; E59-K62 WeakPolarHBondContact O-CG 3.4Å; E59-K62 PolarHBondContact O-N 3.33Å; E59-K62 IonicContact OE1-NZ 3.35Å; E59-Y72 HydrophobicContact CB-CD2 4.2Å; E59-Y72 HydrophobicContact CB-CE2 3.76Å; E59-Y72 HydrophobicContact CG-CE2 4.23Å; E59-Y72 PolarHBondContact OE1-OH 3.31Å
60	P	96.3	Very high	96.5	Very high	95 Å²	95	42 Å²	42	62%	0.617	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-60.7	-25.5	-174.4	-25.1	35.4	0	0	0	113.9	S56	S56-P60 VanDerWaalsContact O-CD 3.27Å; S56-P60 WeakPolarHBondContact O-CD 3.31Å
61	R	94.3	Very high	96.5	Very high	81 Å²	81	36.9 Å²	36.9	31%	0.306	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-110	-2.1	-173.9	-63.5	176	-176.8	-98.9	22.1	113.4	E38 L58 E59 S63 H64 S65 H68	E38-R61 IonicContact OE1-CZ 2.96Å; E38-R61 VanDerWaalsContact OE1-CZ 3.26Å; E38-R61 IonicContact OE1-NE 3.07Å; E38-R61 PolarHBondContact OE1-NE 3.05Å; E38-R61 IonicContact OE1-NH2 3.79Å; E38-R61 PolarHBondContact OE1-NH2 3.23Å; E38-R61 WeakPolarHBondContact OE2-CD 3.42Å; E38-R61 IonicContact OE2-CZ 3.52Å; E38-R61 VanDerWaalsContact OE2-CZ 3.27Å; E38-R61 IonicContact OE2-NE 2.67Å; E38-R61 PolarHBondContact OE2-NE 3.05Å; E38-R61 IonicContact OE2-NH1 3.86Å; E38-R61 IonicContact OE2-NH2 3.86Å; L58-R61 PolarHBondContact O-N 2.94Å; E59-R61 PolarHBondContact O-N 3.26Å; R61-S63 PolarHBondContact O-N 3.2Å; R61-S63 VanDerWaalsContact O-N 3.09Å; R61-H64 CarbonylContact O-C 3.58Å; R61-H64 PolarHBondContact O-N 3.36Å; R61-S65 PolarHBondContact O-N 3.26Å; R61-H68 HydrophobicContact CB-CB 3.96Å
62	K	95.3	Very high	96.7	Very high	46 Å²	46	38.1 Å²	38.1	20%	0.2	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-23.7	-175.3	79.6	-177	178.1	-176.6	0	114.8	L58 E59 A69 Y72 T102	L58-K62 PolarHBondContact O-N 3.03Å; E59-K62 HydrophobicContact CG-CD 4.4Å; E59-K62 WeakPolarHBondContact O-CG 3.4Å; E59-K62 PolarHBondContact O-N 3.33Å; E59-K62 IonicContact OE1-NZ 3.35Å; K62-A69 WeakPolarHBondContact O-CB 3.31Å; K62-Y72 HydrophobicContact CD-CD1 3.73Å; K62-Y72 HydrophobicContact CD-CD2 4.45Å; K62-Y72 HydrophobicContact CD-CE1 3.78Å; K62-Y72 HydrophobicContact CD-CG 4.08Å; K62-Y72 PolarHBondContact NZ-OH 3.5Å; K62-T102 PolarHBondContact O-OG1 3Å
63	S	94	Very high	96.8	Very high	53 Å²	53	36 Å²	36	37%	0.371	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-7.9	176.8	50.8	0	0	0	0	114.2	R61 R105	R61-S63 PolarHBondContact O-N 3.2Å; R61-S63 VanDerWaalsContact O-N 3.09Å; S63-R105 PolarHBondContact O-NH1 2.89Å
64	H	92.9	Very high	96.7	Very high	104 Å²	104	34.2 Å²	34.2	48%	0.481	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.7	-5.7	-171.8	-58.8	101.2	0	0	0	113.9	R61 F106	R61-H64 CarbonylContact O-C 3.58Å; R61-H64 PolarHBondContact O-N 3.36Å; H64-F106 VanDerWaalsContact O-CZ 3.31Å; H64-F106 WeakPolarHBondContact O-CZ 3.4Å
65	S	95.9	Very high	96.6	Very high	8 Å²	8	35 Å²	35	6%	0.056	20%	0.196	C	C	.	.			trans	-139.4	127.6	178.4	171.2	0	0	0	0	110.4	R61 Y67 H68 A69	R61-S65 PolarHBondContact O-N 3.26Å; S65-Y67 VanDerWaalsContact C-N 3.28Å; S65-Y67 PolarHBondContact O-N 2.98Å; S65-H68 VanDerWaalsContact CB-ND1 3.3Å; S65-H68 WeakPolarHBondContact CB-ND1 3.47Å; S65-H68 PolarHBondContact O-N 2.67Å; S65-H68 PolarHBondContact OG-ND1 2.98Å; S65-A69 WeakPolarHBondContact O-CB 3.43Å; S65-A69 PolarHBondContact O-N 3.3Å
66	M	96	Very high	96.5	Very high	7 Å²	7	34.6 Å²	34.6	3%	0.034	19%	0.193	C	C	.	.	H	α-helix	trans	-58.7	-38.6	-178.4	69.7	-171.5	98.3	0	0	112.8	L32 M70 F106 E131 H134 A135 C138	L32-M66 HydrophobicContact CD1-CE 4.44Å; M66-M70 VanDerWaalsContact O-CB 3.32Å; M66-M70 WeakPolarHBondContact O-CB 3.43Å; M66-M70 PolarHBondContact O-N 3.49Å; M66-F106 HydrophobicContact CB-CD2 4.26Å; M66-F106 HydrophobicContact CE-CB 4.08Å; M66-F106 HydrophobicContact CE-CD1 4.06Å; M66-F106 HydrophobicContact CE-CG 4.01Å; M66-E131 HydrophobicContact CE-CG 3.48Å; M66-E131 VanDerWaalsContact CE-CG 3.48Å; M66-H134 VanDerWaalsContact SD-C 3.55Å; M66-H134 HydrophobicContact SD-CB 3.92Å; M66-A135 HydrophobicContact CE-CB 4.38Å; M66-A135 VanDerWaalsContact SD-CA 3.51Å; M66-A135 HydrophobicContact SD-CB 3.86Å; M66-A135 PolarHBondContact SD-N 3.12Å; M66-A135 VanDerWaalsContact SD-N 3.37Å; M66-C138 HydrophobicContact CB-CB 4.41Å; M66-C138 HydrophobicContact CG-CB 4.5Å
67	Y	97.3	Very high	96.3	Very high	1 Å²	1	32.5 Å²	32.5	0%	0.004	18%	0.176	C	C	.	.	H	α-helix	trans	-72.3	-43.6	-178.7	-90.3	-83.1	0	0	0	112.3	L32 L36 C39 S65 A69 M70 G71 H134 L247 R248	L32-Y67 HydrophobicContact CD1-CD2 3.94Å; L32-Y67 HydrophobicContact CD1-CE2 3.69Å; L36-Y67 HydrophobicContact CD2-CD1 3.78Å; L36-Y67 HydrophobicContact CD2-CD2 4.21Å; L36-Y67 HydrophobicContact CD2-CE1 3.31Å; L36-Y67 HydrophobicContact CD2-CE2 3.84Å; L36-Y67 HydrophobicContact CD2-CG 4.19Å; L36-Y67 HydrophobicContact CG-CD2 4.48Å; L36-Y67 HydrophobicContact CG-CE1 4.48Å; L36-Y67 HydrophobicContact CG-CE2 4.29Å; C39-Y67 VanDerWaalsContact SG-C 3.59Å; S65-Y67 VanDerWaalsContact C-N 3.28Å; S65-Y67 PolarHBondContact O-N 2.98Å; Y67-A69 VanDerWaalsContact C-N 3.32Å; Y67-A69 PolarHBondContact O-N 3.25Å; Y67-M70 HydrophobicContact CD1-CE 4.22Å; Y67-M70 HydrophobicContact CE1-CE 4.47Å; Y67-M70 PolarHBondContact O-N 2.93Å; Y67-G71 PolarHBondContact O-N 3.11Å; Y67-H134 HydrophobicContact CE2-CB 4.05Å; Y67-H134 AromaticContact CE2-ND1 3.46Å; Y67-H134 WeakPolarHBondContact CE2-ND1 3.33Å; Y67-H134 AromaticContact CZ-ND1 3.5Å; Y67-H134 PolarHBondContact OH-CE1 3.24Å; Y67-H134 PolarHBondContact OH-ND1 3.4Å; Y67-L247 HydrophobicContact CD1-CD2 3.82Å; Y67-L247 HydrophobicContact CE1-CD2 3.95Å; Y67-R248 PolarHBondContact OH-NH1 2.82Å
68	H	98.3	Very high	96	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.009	17%	0.173	C	C	.	.	H	α-helix	trans	-62.9	-42.4	174.9	-69.9	85.9	0	0	0	111.3	E38 R61 S65 Y72	E38-H68 IonicContact OE2-CE1 2.89Å; E38-H68 PolarHBondContact OE2-CE1 2.98Å; E38-H68 IonicContact OE2-NE2 3.27Å; E38-H68 PolarHBondContact OE2-NE2 3.17Å; R61-H68 HydrophobicContact CB-CB 3.96Å; S65-H68 VanDerWaalsContact CB-ND1 3.3Å; S65-H68 WeakPolarHBondContact CB-ND1 3.47Å; S65-H68 PolarHBondContact O-N 2.67Å; S65-H68 PolarHBondContact OG-ND1 2.98Å; H68-Y72 WeakPolarHBondContact O-CB 3.48Å; H68-Y72 PolarHBondContact O-N 3.41Å
69	A	98.1	Very high	95.5	Very high	3 Å²	3	34.7 Å²	34.7	3%	0.025	18%	0.182	C	C	.	.	H	α-helix	trans	-59	-52.5	176.5	0	0	0	0	0	111.4	K62 S65 Y67 S73 A99 T102	K62-A69 WeakPolarHBondContact O-CB 3.31Å; S65-A69 WeakPolarHBondContact O-CB 3.43Å; S65-A69 PolarHBondContact O-N 3.3Å; Y67-A69 VanDerWaalsContact C-N 3.32Å; Y67-A69 PolarHBondContact O-N 3.25Å; A69-S73 WeakPolarHBondContact O-CB 3.45Å; A69-S73 PolarHBondContact O-N 2.81Å; A69-S73 PolarHBondContact O-OG 3.02Å; A69-S73 VanDerWaalsContact O-OG 3.1Å; A69-A99 HydrophobicContact CB-CB 3.9Å; A69-T102 HydrophobicContact CB-CG2 3.99Å
70	M	97.5	Very high	95.1	Very high	8 Å²	8	30.3 Å²	30.3	4%	0.039	16%	0.161	C	C	.	.	H	α-helix	trans	-63.1	-48	179.7	-178.4	-162.6	75.1	0	0	111.8	M66 Y67 Y72 S73 S74 C138 E141 V142 R248	M66-M70 VanDerWaalsContact O-CB 3.32Å; M66-M70 WeakPolarHBondContact O-CB 3.43Å; M66-M70 PolarHBondContact O-N 3.49Å; Y67-M70 HydrophobicContact CD1-CE 4.22Å; Y67-M70 HydrophobicContact CE1-CE 4.47Å; Y67-M70 PolarHBondContact O-N 2.93Å; M70-Y72 PolarHBondContact O-N 3.44Å; M70-S73 PolarHBondContact O-N 3.16Å; M70-S73 PolarHBondContact O-OG 3.01Å; M70-S74 VanDerWaalsContact O-CB 3.26Å; M70-S74 WeakPolarHBondContact O-CB 3.46Å; M70-S74 PolarHBondContact O-N 3.38Å; M70-S74 PolarHBondContact O-OG 2.86Å; M70-C138 HydrophobicContact SD-CB 4.16Å; M70-E141 HydrophobicContact SD-CB 4.17Å; M70-E141 HydrophobicContact SD-CG 4.14Å; M70-V142 HydrophobicContact CB-CG2 3.87Å; M70-V142 HydrophobicContact CG-CG2 3.67Å; M70-R248 PolarHBondContact SD-NH2 2.58Å
71	G	97.5	Very high	94.5	Very high	17 Å²	17	27.7 Å²	27.7	18%	0.175	15%	0.148	C	C	.	.	H	α-helix	trans	-60.1	-47.3	-179.8	0	0	0	0	0	111.6	Y67 S74 I75	Y67-G71 PolarHBondContact O-N 3.11Å; G71-S74 PolarHBondContact O-N 3.43Å; G71-I75 WeakPolarHBondContact O-CG1 3.5Å; G71-I75 PolarHBondContact O-N 2.8Å; G71-I75 VanDerWaalsContact O-N 3.1Å
72	Y	98.4	Very high	93.9	Very high	28 Å²	28	25 Å²	25	11%	0.11	14%	0.139	C	C	.	.	H	α-helix	trans	-61.1	-48.3	178.1	-175	-90	0	0	0	111.3	L55 L58 E59 K62 H68 M70 S74 I75 L76 S95	L55-Y72 HydrophobicContact CB-CD2 4.48Å; L55-Y72 HydrophobicContact CB-CE2 4.21Å; L55-Y72 HydrophobicContact CD2-CD2 3.68Å; L55-Y72 HydrophobicContact CD2-CE2 3.76Å; L55-Y72 HydrophobicContact CD2-CG 4.26Å; L58-Y72 HydrophobicContact CB-CD2 4.11Å; E59-Y72 HydrophobicContact CB-CD2 4.2Å; E59-Y72 HydrophobicContact CB-CE2 3.76Å; E59-Y72 HydrophobicContact CG-CE2 4.23Å; E59-Y72 PolarHBondContact OE1-OH 3.31Å; K62-Y72 HydrophobicContact CD-CD1 3.73Å; K62-Y72 HydrophobicContact CD-CD2 4.45Å; K62-Y72 HydrophobicContact CD-CE1 3.78Å; K62-Y72 HydrophobicContact CD-CG 4.08Å; K62-Y72 PolarHBondContact NZ-OH 3.5Å; H68-Y72 WeakPolarHBondContact O-CB 3.48Å; H68-Y72 PolarHBondContact O-N 3.41Å; M70-Y72 PolarHBondContact O-N 3.44Å; Y72-S74 VanDerWaalsContact C-N 3.31Å; Y72-S74 PolarHBondContact O-N 3.39Å; Y72-I75 PolarHBondContact O-N 3.38Å; Y72-L76 HydrophobicContact CD1-CD1 3.84Å; Y72-L76 HydrophobicContact CE1-CD1 3.35Å; Y72-L76 HydrophobicContact CE1-CG 4.27Å; Y72-L76 PolarHBondContact O-N 3.32Å; Y72-S95 WeakPolarHBondContact CD1-OG 3.44Å
73	S	97.9	Very high	92.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-66.6	-32.4	178.8	65.1	0	0	0	0	113	A69 M70 L76 L77 S95	A69-S73 WeakPolarHBondContact O-CB 3.45Å; A69-S73 PolarHBondContact O-N 2.81Å; A69-S73 PolarHBondContact O-OG 3.02Å; A69-S73 VanDerWaalsContact O-OG 3.1Å; M70-S73 PolarHBondContact O-N 3.16Å; M70-S73 PolarHBondContact O-OG 3.01Å; S73-L76 PolarHBondContact O-N 2.73Å; S73-L77 WeakPolarHBondContact O-CB 3.47Å; S73-L77 PolarHBondContact O-N 3.21Å; S73-S95 WeakPolarHBondContact CA-OG 3.47Å; S73-S95 WeakPolarHBondContact CB-OG 3.36Å
74	S	96.1	Very high	91.9	Very high	24 Å²	24	22.9 Å²	22.9	17%	0.168	12%	0.124	C	C	.	.	H	α-helix	trans	-66.8	-41.2	178	-59.8	0	0	0	0	111.9	M70 G71 Y72 L77 M78 Q145	M70-S74 VanDerWaalsContact O-CB 3.26Å; M70-S74 WeakPolarHBondContact O-CB 3.46Å; M70-S74 PolarHBondContact O-N 3.38Å; M70-S74 PolarHBondContact O-OG 2.86Å; G71-S74 PolarHBondContact O-N 3.43Å; Y72-S74 VanDerWaalsContact C-N 3.31Å; Y72-S74 PolarHBondContact O-N 3.39Å; S74-L77 PolarHBondContact O-N 3.28Å; S74-M78 PolarHBondContact O-N 2.69Å; S74-Q145 PolarHBondContact OG-NE2 3.5Å; S74-Q145 PolarHBondContact OG-OE1 3.04Å
75	I	95.6	Very high	91.4	Very high	18 Å²	18	19.4 Å²	19.4	9%	0.092	11%	0.11	C	C	.	.	H	α-helix	trans	-64.5	-45.7	176.8	-67.6	172.5	0	0	0	110.2	F46 A54 L55 L58 G71 Y72 L77 M78 Q79 W325	F46-I75 HydrophobicContact CD2-CD1 4.04Å; F46-I75 HydrophobicContact CD2-CG1 4.01Å; F46-I75 HydrophobicContact CD2-CG2 4.3Å; F46-I75 HydrophobicContact CE2-CG1 4.2Å; F46-I75 HydrophobicContact CE2-CG2 4.11Å; A54-I75 HydrophobicContact CB-CD1 4.19Å; L55-I75 HydrophobicContact CD1-CG2 4.11Å; L55-I75 HydrophobicContact CD2-CB 3.84Å; L55-I75 HydrophobicContact CD2-CD1 4.36Å; L55-I75 HydrophobicContact CD2-CG2 3.61Å; L55-I75 HydrophobicContact CG-CG2 3.79Å; L58-I75 HydrophobicContact CD1-CD1 3.8Å; G71-I75 WeakPolarHBondContact O-CG1 3.5Å; G71-I75 PolarHBondContact O-N 2.8Å; G71-I75 VanDerWaalsContact O-N 3.1Å; Y72-I75 PolarHBondContact O-N 3.38Å; I75-L77 PolarHBondContact O-N 3.49Å; I75-M78 PolarHBondContact O-N 3.2Å; I75-Q79 PolarHBondContact O-N 3.47Å; I75-Q79 VanDerWaalsContact O-N 3.1Å; I75-W325 HydrophobicContact CG2-CH2 3.73Å; I75-W325 HydrophobicContact CG2-CZ2 3.53Å
76	L	95	Very high	90.8	Very high	17 Å²	17	23 Å²	23	9%	0.089	13%	0.133	C	C	.	.	H	α-helix	trans	-63.5	-39.5	176.8	-67.7	179	0	0	0	112.5	L55 Y72 S73 M78 Q79 A80 V91 A92	L55-L76 HydrophobicContact CD1-CD2 4.28Å; L55-L76 HydrophobicContact CD2-CD2 4.23Å; L55-L76 HydrophobicContact CD2-CG 4.24Å; Y72-L76 HydrophobicContact CD1-CD1 3.84Å; Y72-L76 HydrophobicContact CE1-CD1 3.35Å; Y72-L76 HydrophobicContact CE1-CG 4.27Å; Y72-L76 PolarHBondContact O-N 3.32Å; S73-L76 PolarHBondContact O-N 2.73Å; L76-M78 VanDerWaalsContact C-N 3.34Å; L76-M78 PolarHBondContact O-N 3.24Å; L76-Q79 PolarHBondContact O-N 2.95Å; L76-A80 WeakPolarHBondContact O-CB 3.19Å; L76-A80 PolarHBondContact O-N 3.31Å; L76-V91 HydrophobicContact CD1-CG1 4.08Å; L76-A92 HydrophobicContact CB-CB 4.35Å
77	L	94.1	Very high	90.4	Very high	25 Å²	25	30.3 Å²	30.3	13%	0.131	16%	0.164	C	C	.	.	H	α-helix	trans	-58.9	-46.1	173.2	173.3	72.3	0	0	0	111.4	S73 S74 I75 Q79 A80 A81 L96 Q145 L149	S73-L77 WeakPolarHBondContact O-CB 3.47Å; S73-L77 PolarHBondContact O-N 3.21Å; S74-L77 PolarHBondContact O-N 3.28Å; I75-L77 PolarHBondContact O-N 3.49Å; L77-Q79 VanDerWaalsContact C-N 3.29Å; L77-Q79 PolarHBondContact O-N 3.35Å; L77-A80 PolarHBondContact O-N 3.31Å; L77-A81 VanDerWaalsContact O-CB 3.27Å; L77-A81 WeakPolarHBondContact O-CB 3.43Å; L77-A81 PolarHBondContact O-N 3.03Å; L77-L96 HydrophobicContact CD1-CD1 4.14Å; L77-Q145 HydrophobicContact CD2-CB 3.54Å; L77-Q145 HydrophobicContact CD2-CG 3.47Å; L77-Q145 VanDerWaalsContact CD2-CG 3.47Å; L77-L149 HydrophobicContact CD1-CB 3.92Å; L77-L149 HydrophobicContact CD1-CD1 3.85Å; L77-L149 HydrophobicContact CD1-CD2 4.06Å; L77-L149 HydrophobicContact CD1-CG 4.18Å
78	M	91.1	Very high	89.9	Confident	57 Å²	57	32.3 Å²	32.3	28%	0.281	18%	0.175	S	C	.	.	H	α-helix	trans	-60	-42.7	179.8	-173.5	173.3	174.7	0	0	111	F46 S74 I75 L76 M82 L293 W325	F46-M78 HydrophobicContact CE1-SD 4.32Å; F46-M78 HydrophobicContact CZ-CE 4.28Å; F46-M78 HydrophobicContact CZ-SD 3.62Å; S74-M78 PolarHBondContact O-N 2.69Å; I75-M78 PolarHBondContact O-N 3.2Å; L76-M78 VanDerWaalsContact C-N 3.34Å; L76-M78 PolarHBondContact O-N 3.24Å; M78-M82 HydrophobicContact CE-CE 4.42Å; M78-M82 HydrophobicContact CE-SD 4.48Å; M78-M82 HydrophobicContact CG-CE 4.03Å; M78-M82 WeakPolarHBondContact O-CE 3.31Å; M78-M82 WeakPolarHBondContact O-CG 3.27Å; M78-M82 PolarHBondContact O-N 3.06Å; M78-L293 HydrophobicContact CE-CD1 4.35Å; M78-L293 HydrophobicContact CE-CD2 3.95Å; M78-W325 HydrophobicContact CB-CH2 4.33Å; M78-W325 HydrophobicContact CB-CZ3 4.46Å; M78-W325 HydrophobicContact CE-CZ3 4.47Å; M78-W325 HydrophobicContact CG-CH2 4.46Å; M78-W325 HydrophobicContact CG-CZ3 4.11Å; M78-W325 HydrophobicContact SD-CZ3 4.13Å
79	Q	87.3	Confident	89.5	Confident	43 Å²	43	33.4 Å²	33.4	20%	0.201	18%	0.18	C	C	.	.	H	α-helix	trans	-60.1	-50.2	174.7	-176.8	179.6	-10.7	0	0	111.9	I75 L76 L77 A81 M82 T83 W325	I75-Q79 PolarHBondContact O-N 3.47Å; I75-Q79 VanDerWaalsContact O-N 3.1Å; L76-Q79 PolarHBondContact O-N 2.95Å; L77-Q79 VanDerWaalsContact C-N 3.29Å; L77-Q79 PolarHBondContact O-N 3.35Å; Q79-A81 PolarHBondContact O-N 2.92Å; Q79-M82 PolarHBondContact O-N 3.41Å; Q79-T83 PolarHBondContact O-N 2.93Å; Q79-W325 HydrophobicContact CB-CH2 4.29Å; Q79-W325 HydrophobicContact CB-CZ2 4.15Å
80	A	87.8	Confident	89.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.5	-41.9	-179.4	0	0	0	0	0	112.7	L76 L77 M82 T83 F84 D88 M89 A92	L76-A80 WeakPolarHBondContact O-CB 3.19Å; L76-A80 PolarHBondContact O-N 3.31Å; L77-A80 PolarHBondContact O-N 3.31Å; A80-M82 PolarHBondContact O-N 2.72Å; A80-T83 PolarHBondContact O-N 3.22Å; A80-T83 PolarHBondContact O-OG1 3.14Å; A80-F84 PolarHBondContact O-N 3.5Å; A80-D88 HydrophobicContact CB-CB 3.98Å; A80-D88 WeakPolarHBondContact CB-O 3.39Å; A80-M89 HydrophobicContact CB-CG 4.4Å; A80-M89 HydrophobicContact CB-SD 3.83Å; A80-A92 HydrophobicContact CB-CB 3.75Å
81	A	83.5	Confident	89.1	Confident	40 Å²	40	42.3 Å²	42.3	33%	0.331	23%	0.23	S	C	.	.	H	α-helix	trans	-66.8	-16.5	179	0	0	0	0	0	113.6	L77 Q79 W362	L77-A81 VanDerWaalsContact O-CB 3.27Å; L77-A81 WeakPolarHBondContact O-CB 3.43Å; L77-A81 PolarHBondContact O-N 3.03Å; Q79-A81 PolarHBondContact O-N 2.92Å; A81-W362 WeakPolarHBondContact O-CZ3 3.39Å
82	M	82.4	Confident	89	Confident	25 Å²	25	41.5 Å²	41.5	12%	0.123	22%	0.222	C	C	.	.	H	α-helix	trans	-95.9	-22.5	175.9	-66	-176.2	-68.6	0	0	113.9	M78 Q79 A80 W325 Q327 I328 L331	M78-M82 HydrophobicContact CE-CE 4.42Å; M78-M82 HydrophobicContact CE-SD 4.48Å; M78-M82 HydrophobicContact CG-CE 4.03Å; M78-M82 WeakPolarHBondContact O-CE 3.31Å; M78-M82 WeakPolarHBondContact O-CG 3.27Å; M78-M82 PolarHBondContact O-N 3.06Å; Q79-M82 PolarHBondContact O-N 3.41Å; A80-M82 PolarHBondContact O-N 2.72Å; M82-W325 HydrophobicContact CE-CE3 3.65Å; M82-W325 HydrophobicContact CE-CZ3 3.67Å; M82-Q327 HydrophobicContact CB-CB 3.64Å; M82-Q327 HydrophobicContact CB-CG 3.89Å; M82-Q327 HydrophobicContact CE-CB 3.77Å; M82-Q327 HydrophobicContact CE-CG 4.43Å; M82-Q327 HydrophobicContact CG-CB 4.47Å; M82-Q327 HydrophobicContact SD-CB 4.08Å; M82-I328 HydrophobicContact CE-CG1 4.45Å; M82-I328 HydrophobicContact SD-CG1 4.42Å; M82-L331 HydrophobicContact SD-CD1 3.86Å
83	T	72.9	Confident	88.8	Confident	17 Å²	17	41.8 Å²	41.8	10%	0.104	23%	0.225	C	C	.	.	H	α-helix	trans	-95.5	-36.1	178.3	53.8	0	0	0	0	114.2	Q79 A80 D85 D88 Q327	Q79-T83 PolarHBondContact O-N 2.93Å; A80-T83 PolarHBondContact O-N 3.22Å; A80-T83 PolarHBondContact O-OG1 3.14Å; T83-D85 PolarHBondContact O-N 2.95Å; T83-D85 PolarHBondContact OG1-N 3.39Å; T83-D88 WeakPolarHBondContact CG2-OD2 3.43Å; T83-D88 PolarHBondContact OG1-OD2 3.44Å; T83-Q327 HydrophobicContact CG2-CG 3.24Å
84	F	75.3	Confident	88.8	Confident	36 Å²	36	44 Å²	44	16%	0.158	24%	0.243	C	C	.	.			trans	55.1	22.8	-159.8	-138.5	-112.3	0	0	0	113.8	A80 P86 M89 L152 W362 L402	A80-F84 PolarHBondContact O-N 3.5Å; F84-P86 WeakPolarHBondContact O-CD 3.35Å; F84-M89 HydrophobicContact CD2-CE 4.36Å; F84-M89 HydrophobicContact CE2-CE 4.28Å; F84-L152 HydrophobicContact CD2-CD1 4.39Å; F84-L152 HydrophobicContact CE2-CB 3.65Å; F84-L152 HydrophobicContact CE2-CD1 3.91Å; F84-L152 HydrophobicContact CE2-CD2 4Å; F84-L152 HydrophobicContact CE2-CG 4.02Å; F84-L152 HydrophobicContact CZ-CB 4.01Å; F84-L152 WeakPolarHBondContact CZ-O 3.5Å; F84-W362 HydrophobicContact CB-CB 4.4Å; F84-W362 HydrophobicContact CB-CD2 4.33Å; F84-W362 HydrophobicContact CB-CE3 3.6Å; F84-W362 HydrophobicContact CB-CZ3 4.19Å; F84-W362 HydrophobicContact CD2-CD2 4.41Å; F84-W362 AromaticContact CD2-CE3 3.54Å; F84-W362 HydrophobicContact CD2-CE3 3.54Å; F84-W362 AromaticContact CD2-CH2 3.94Å; F84-W362 HydrophobicContact CD2-CH2 3.94Å; F84-W362 AromaticContact CD2-CZ3 3.26Å; F84-W362 HydrophobicContact CD2-CZ3 3.26Å; F84-W362 HydrophobicContact CE2-CE3 4.48Å; F84-W362 HydrophobicContact CE2-CH2 4.15Å; F84-W362 AromaticContact CE2-CZ3 3.92Å; F84-W362 HydrophobicContact CE2-CZ3 3.92Å; F84-W362 AromaticContact CG-CE3 3.93Å; F84-W362 HydrophobicContact CG-CE3 3.93Å; F84-W362 HydrophobicContact CG-CZ3 4.12Å; F84-L402 HydrophobicContact CD1-CD1 4.35Å; F84-L402 HydrophobicContact CE1-CD1 4.4Å
85	D	80.9	Confident	88.9	Confident	32 Å²	32	43.3 Å²	43.3	17%	0.171	24%	0.238	C	C	.	.			trans	-74.2	126.6	176.2	-168.4	-79.2	0	0	0	109.2	T83 K87 D88 M89 K361	T83-D85 PolarHBondContact O-N 2.95Å; T83-D85 PolarHBondContact OG1-N 3.39Å; D85-K87 PolarHBondContact O-N 3.01Å; D85-K87 WeakPolarHBondContact OD1-CB 3.41Å; D85-K87 PolarHBondContact OD1-N 3.4Å; D85-D88 HydrophobicContact CB-CB 4.38Å; D85-D88 PolarHBondContact O-N 3.14Å; D85-M89 WeakPolarHBondContact O-CG 3.15Å; D85-M89 PolarHBondContact O-N 2.91Å; D85-K361 IonicContact OD2-NZ 3.89Å; D85-K361 PolarHBondContact OD2-NZ 3.06Å
86	P	83.3	Confident	89	Confident	84 Å²	84	42.4 Å²	42.4	55%	0.545	23%	0.234	S	C	.	.	H	α-helix	trans	-53.2	-34.3	-177.4	-29	35.7	0	0	0	113.8	F84 M89 D90	F84-P86 WeakPolarHBondContact O-CD 3.35Å; P86-M89 PolarHBondContact O-N 3.39Å; P86-D90 WeakPolarHBondContact O-CB 3.24Å; P86-D90 VanDerWaalsContact O-CG 3.31Å; P86-D90 PolarHBondContact O-N 3.24Å
87	K	87.5	Confident	89.1	Confident	160 Å²	160	47 Å²	47	70%	0.696	25%	0.253	S	S	*	.	H	α-helix	trans	-68.5	-44.2	179.1	-63.5	-179.9	179.6	178.9	0	111.8	D85 M89 D90 V91	D85-K87 PolarHBondContact O-N 3.01Å; D85-K87 WeakPolarHBondContact OD1-CB 3.41Å; D85-K87 PolarHBondContact OD1-N 3.4Å; K87-M89 VanDerWaalsContact C-N 3.31Å; K87-D90 PolarHBondContact O-N 2.86Å; K87-V91 VanDerWaalsContact O-CG2 3.29Å; K87-V91 WeakPolarHBondContact O-CG2 3.49Å; K87-V91 PolarHBondContact O-N 3.4Å
88	D	88.4	Confident	89.3	Confident	42 Å²	42	51 Å²	51	23%	0.225	27%	0.271	C	S	.	.	H	α-helix	trans	-64.3	-41.3	177.5	-65.7	-22.2	0	0	0	110.3	A80 T83 D85 V91 A92	A80-D88 HydrophobicContact CB-CB 3.98Å; A80-D88 WeakPolarHBondContact CB-O 3.39Å; T83-D88 WeakPolarHBondContact CG2-OD2 3.43Å; T83-D88 PolarHBondContact OG1-OD2 3.44Å; D85-D88 HydrophobicContact CB-CB 4.38Å; D85-D88 PolarHBondContact O-N 3.14Å; D88-V91 PolarHBondContact O-N 3.33Å; D88-A92 WeakPolarHBondContact O-CB 3.3Å; D88-A92 PolarHBondContact O-N 3Å
89	M	89.1	Confident	89.7	Confident	25 Å²	25	48.3 Å²	48.3	12%	0.123	26%	0.258	C	S	.	.	H	α-helix	trans	-62	-43.7	177.6	-62.7	-73.2	-72.2	0	0	111.9	A80 F84 D85 P86 K87 M93 L149 L152	A80-M89 HydrophobicContact CB-CG 4.4Å; A80-M89 HydrophobicContact CB-SD 3.83Å; F84-M89 HydrophobicContact CD2-CE 4.36Å; F84-M89 HydrophobicContact CE2-CE 4.28Å; D85-M89 WeakPolarHBondContact O-CG 3.15Å; D85-M89 PolarHBondContact O-N 2.91Å; P86-M89 PolarHBondContact O-N 3.39Å; K87-M89 VanDerWaalsContact C-N 3.31Å; M89-M93 VanDerWaalsContact O-CB 3.24Å; M89-M93 WeakPolarHBondContact O-CB 3.31Å; M89-M93 PolarHBondContact O-N 3.2Å; M89-L149 HydrophobicContact CE-CD1 3.28Å; M89-L149 HydrophobicContact CE-CG 4.2Å; M89-L149 HydrophobicContact SD-CD1 3.51Å; M89-L149 VanDerWaalsContact SD-CD1 3.51Å; M89-L152 HydrophobicContact CE-CB 3.68Å; M89-L152 HydrophobicContact CE-CD1 3.75Å; M89-L152 HydrophobicContact CE-CG 4.34Å
90	D	92.1	Very high	90.2	Very high	117 Å²	117	46.9 Å²	46.9	63%	0.626	25%	0.252	S	S	*	.	H	α-helix	trans	-65.1	-44.4	176.8	-77.7	-24.6	0	0	0	111.9	P86 K87 M93 A94	P86-D90 WeakPolarHBondContact O-CB 3.24Å; P86-D90 VanDerWaalsContact O-CG 3.31Å; P86-D90 PolarHBondContact O-N 3.24Å; K87-D90 PolarHBondContact O-N 2.86Å; D90-M93 PolarHBondContact O-N 3.45Å; D90-A94 WeakPolarHBondContact O-CB 3.46Å; D90-A94 PolarHBondContact O-N 3.06Å
91	V	94.3	Very high	90.6	Very high	81 Å²	81	52.9 Å²	52.9	49%	0.491	28%	0.28	S	S	.	.	H	α-helix	trans	-61.7	-47.3	176.9	168.9	0	0	0	0	110.9	L76 K87 D88 A94 S95	L76-V91 HydrophobicContact CD1-CG1 4.08Å; K87-V91 VanDerWaalsContact O-CG2 3.29Å; K87-V91 WeakPolarHBondContact O-CG2 3.49Å; K87-V91 PolarHBondContact O-N 3.4Å; D88-V91 PolarHBondContact O-N 3.33Å; V91-A94 PolarHBondContact O-N 3.29Å; V91-S95 WeakPolarHBondContact O-CB 3.46Å; V91-S95 PolarHBondContact O-N 3.23Å
92	A	95.4	Very high	91.2	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.9	-45	176.5	0	0	0	0	0	111.6	L76 A80 D88 A94 S95 L96 L149	L76-A92 HydrophobicContact CB-CB 4.35Å; A80-A92 HydrophobicContact CB-CB 3.75Å; D88-A92 WeakPolarHBondContact O-CB 3.3Å; D88-A92 PolarHBondContact O-N 3Å; A92-A94 PolarHBondContact O-N 2.85Å; A92-S95 PolarHBondContact O-N 3.49Å; A92-L96 WeakPolarHBondContact O-CB 3.42Å; A92-L96 WeakPolarHBondContact O-CD1 3.37Å; A92-L96 VanDerWaalsContact O-CG 3.23Å; A92-L96 WeakPolarHBondContact O-CG 3.49Å; A92-L96 PolarHBondContact O-N 3.06Å; A92-L149 HydrophobicContact CB-CD2 3.96Å
93	M	95.6	Very high	91.9	Very high	35 Å²	35	50.1 Å²	50.1	17%	0.172	26%	0.26	C	S	.	.	H	α-helix	trans	-62.6	-40.9	178.4	-178.8	60.5	71.3	0	0	112.3	M89 D90 K97 K146 L149	M89-M93 VanDerWaalsContact O-CB 3.24Å; M89-M93 WeakPolarHBondContact O-CB 3.31Å; M89-M93 PolarHBondContact O-N 3.2Å; D90-M93 PolarHBondContact O-N 3.45Å; M93-K97 WeakPolarHBondContact O-CG 3.25Å; M93-K97 PolarHBondContact O-N 3.22Å; M93-K97 VanDerWaalsContact O-N 3.15Å; M93-K146 HydrophobicContact SD-CG 3.89Å; M93-L149 HydrophobicContact CB-CD2 3.89Å; M93-L149 HydrophobicContact CE-CB 4.02Å; M93-L149 HydrophobicContact CE-CD2 3.84Å; M93-L149 HydrophobicContact CE-CG 3.86Å
94	A	97	Very high	92.9	Very high	46 Å²	46	53.2 Å²	53.2	38%	0.38	27%	0.273	S	S	.	.	H	α-helix	trans	-62.9	-49.4	174.5	0	0	0	0	0	110.9	D90 V91 A92 L96 K97 E98	D90-A94 WeakPolarHBondContact O-CB 3.46Å; D90-A94 PolarHBondContact O-N 3.06Å; V91-A94 PolarHBondContact O-N 3.29Å; A92-A94 PolarHBondContact O-N 2.85Å; A94-L96 VanDerWaalsContact C-N 3.32Å; A94-L96 PolarHBondContact O-N 3.31Å; A94-K97 WeakPolarHBondContact O-CB 3.33Å; A94-K97 PolarHBondContact O-N 3.43Å; A94-K97 VanDerWaalsContact O-N 3.12Å; A94-E98 PolarHBondContact O-N 3.11Å
95	S	98.1	Very high	93.8	Very high	9 Å²	9	58.5 Å²	58.5	6%	0.063	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-38.4	178.7	-173.1	0	0	0	0	112.7	Y72 S73 V91 A92 E98 A99	Y72-S95 WeakPolarHBondContact CD1-OG 3.44Å; S73-S95 WeakPolarHBondContact CA-OG 3.47Å; S73-S95 WeakPolarHBondContact CB-OG 3.36Å; V91-S95 WeakPolarHBondContact O-CB 3.46Å; V91-S95 PolarHBondContact O-N 3.23Å; A92-S95 PolarHBondContact O-N 3.49Å; S95-E98 PolarHBondContact O-N 2.93Å; S95-A99 WeakPolarHBondContact O-CB 3.47Å; S95-A99 PolarHBondContact O-N 2.97Å
96	L	98.1	Very high	94.3	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-66.3	-37.4	176.3	-72.3	163.7	0	0	0	111.9	L77 A92 A94 A99 L100 V142 Q145 K146 L149	L77-L96 HydrophobicContact CD1-CD1 4.14Å; A92-L96 WeakPolarHBondContact O-CB 3.42Å; A92-L96 WeakPolarHBondContact O-CD1 3.37Å; A92-L96 VanDerWaalsContact O-CG 3.23Å; A92-L96 WeakPolarHBondContact O-CG 3.49Å; A92-L96 PolarHBondContact O-N 3.06Å; A94-L96 VanDerWaalsContact C-N 3.32Å; A94-L96 PolarHBondContact O-N 3.31Å; L96-A99 PolarHBondContact O-N 2.95Å; L96-L100 WeakPolarHBondContact O-CG 3.4Å; L96-L100 PolarHBondContact O-N 3.35Å; L96-V142 HydrophobicContact CB-CG1 4.32Å; L96-V142 HydrophobicContact CD2-CG1 3.8Å; L96-V142 VanDerWaalsContact O-CG1 3.3Å; L96-V142 WeakPolarHBondContact O-CG1 3.33Å; L96-Q145 HydrophobicContact CD2-CB 3.73Å; L96-K146 HydrophobicContact CB-CB 4.26Å; L96-K146 HydrophobicContact CD1-CB 4.36Å; L96-L149 HydrophobicContact CD1-CD2 3.78Å
97	K	97.8	Very high	94.6	Very high	114 Å²	114	57 Å²	57	50%	0.496	27%	0.274	S	S	.	.	H	α-helix	trans	-65.9	-42.8	174.8	-72.1	170.2	-175.2	169.9	0	111.5	M93 A94 L100 H101	M93-K97 WeakPolarHBondContact O-CG 3.25Å; M93-K97 PolarHBondContact O-N 3.22Å; M93-K97 VanDerWaalsContact O-N 3.15Å; A94-K97 WeakPolarHBondContact O-CB 3.33Å; A94-K97 PolarHBondContact O-N 3.43Å; A94-K97 VanDerWaalsContact O-N 3.12Å; K97-L100 PolarHBondContact O-N 2.87Å; K97-H101 PolarHBondContact O-N 2.72Å; K97-H101 VanDerWaalsContact O-N 3.09Å
98	E	97.9	Very high	94.4	Very high	107 Å²	107	53.8 Å²	53.8	50%	0.5	26%	0.258	S	S	.	.	H	α-helix	trans	-61.9	-45.1	174.4	-71.2	178.1	-173.7	0	0	111.3	A94 S95 L100 H101 T102	A94-E98 PolarHBondContact O-N 3.11Å; S95-E98 PolarHBondContact O-N 2.93Å; E98-L100 VanDerWaalsContact C-N 3.35Å; E98-L100 PolarHBondContact O-N 2.61Å; E98-H101 WeakPolarHBondContact O-CB 3.43Å; E98-H101 PolarHBondContact O-N 2.89Å; E98-H101 VanDerWaalsContact O-N 3.11Å; E98-T102 PolarHBondContact O-N 2.98Å; E98-T102 PolarHBondContact O-OG1 3.39Å
99	A	98.3	Very high	93.6	Very high	2 Å²	2	60.7 Å²	60.7	2%	0.017	29%	0.286	C	S	.	.	H	α-helix	trans	-62.2	-39.7	178	0	0	0	0	0	112.6	A69 S95 L96 H101 T102 C103 V142	A69-A99 HydrophobicContact CB-CB 3.9Å; S95-A99 WeakPolarHBondContact O-CB 3.47Å; S95-A99 PolarHBondContact O-N 2.97Å; L96-A99 PolarHBondContact O-N 2.95Å; A99-H101 VanDerWaalsContact C-N 3.34Å; A99-H101 PolarHBondContact O-N 2.7Å; A99-T102 PolarHBondContact O-N 3.19Å; A99-C103 PolarHBondContact O-N 2.84Å; A99-C103 PolarHBondContact O-SG 3.39Å; A99-V142 HydrophobicContact CB-CG1 3.84Å; A99-V142 HydrophobicContact CB-CG2 4.17Å
100	L	97.9	Very high	92.1	Very high	12 Å²	12	62.8 Å²	62.8	6%	0.063	30%	0.3	C	S	.	.	H	α-helix	trans	-60.2	-44.4	172	-75	173.3	0	0	0	111.8	L96 K97 E98 C103 Q104 Y139 V142 L143 K146	L96-L100 WeakPolarHBondContact O-CG 3.4Å; L96-L100 PolarHBondContact O-N 3.35Å; K97-L100 PolarHBondContact O-N 2.87Å; E98-L100 VanDerWaalsContact C-N 3.35Å; E98-L100 PolarHBondContact O-N 2.61Å; L100-C103 PolarHBondContact O-N 3.22Å; L100-Q104 VanDerWaalsContact O-CB 3.27Å; L100-Q104 WeakPolarHBondContact O-CB 3.42Å; L100-Q104 PolarHBondContact O-N 3.25Å; L100-Y139 HydrophobicContact CB-CE2 4.17Å; L100-Y139 HydrophobicContact CD2-CD1 4.41Å; L100-Y139 HydrophobicContact CD2-CD2 3.75Å; L100-Y139 HydrophobicContact CD2-CE1 4.34Å; L100-Y139 HydrophobicContact CD2-CE2 3.66Å; L100-Y139 HydrophobicContact CD2-CG 4.12Å; L100-Y139 HydrophobicContact CG-CE2 4.48Å; L100-V142 HydrophobicContact CD2-CB 3.86Å; L100-V142 HydrophobicContact CD2-CG1 3.81Å; L100-V142 HydrophobicContact CG-CB 4.27Å; L100-V142 HydrophobicContact CG-CG1 3.63Å; L100-L143 HydrophobicContact CD1-CD1 4.36Å; L100-L143 HydrophobicContact CD2-CB 4.01Å; L100-K146 HydrophobicContact CD1-CD 3.47Å; L100-K146 VanDerWaalsContact CD1-CD 3.47Å
101	H	97.1	Very high	90.2	Very high	127 Å²	127	59 Å²	59	59%	0.588	29%	0.289	S	S	*	.	H	α-helix	trans	-63.2	-42.9	177.5	179.7	-87.9	0	0	0	111.4	K97 E98 A99 Q104 R105	K97-H101 PolarHBondContact O-N 2.72Å; K97-H101 VanDerWaalsContact O-N 3.09Å; E98-H101 WeakPolarHBondContact O-CB 3.43Å; E98-H101 PolarHBondContact O-N 2.89Å; E98-H101 VanDerWaalsContact O-N 3.11Å; A99-H101 VanDerWaalsContact C-N 3.34Å; A99-H101 PolarHBondContact O-N 2.7Å; H101-Q104 PolarHBondContact O-N 3.08Å; H101-R105 PolarHBondContact O-N 3.42Å
102	T	96.4	Very high	88.1	Confident	7 Å²	7	62.3 Å²	62.3	4%	0.043	30%	0.302	C	S	.	.	H	α-helix	trans	-59.6	-52.8	174.4	-60.4	0	0	0	0	110.8	K62 A69 E98 A99 Q104 R105 F106	K62-T102 PolarHBondContact O-OG1 3Å; A69-T102 HydrophobicContact CB-CG2 3.99Å; E98-T102 PolarHBondContact O-N 2.98Å; E98-T102 PolarHBondContact O-OG1 3.39Å; A99-T102 PolarHBondContact O-N 3.19Å; T102-Q104 VanDerWaalsContact C-N 3.29Å; T102-Q104 PolarHBondContact O-N 3.12Å; T102-R105 WeakPolarHBondContact O-CB 3.45Å; T102-R105 PolarHBondContact O-N 3.01Å; T102-R105 VanDerWaalsContact O-N 3.13Å; T102-F106 HydrophobicContact CG2-CE2 4.08Å; T102-F106 VanDerWaalsContact O-CD2 3.24Å; T102-F106 WeakPolarHBondContact O-CD2 3.33Å
103	C	96.2	Very high	85.6	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-58.4	-40.9	179.1	-63.1	0	0	0	0	111.9	A99 L100 R105 F106 R107 Y139	A99-C103 PolarHBondContact O-N 2.84Å; A99-C103 PolarHBondContact O-SG 3.39Å; L100-C103 PolarHBondContact O-N 3.22Å; C103-R105 PolarHBondContact O-N 2.58Å; C103-R105 VanDerWaalsContact O-N 3.16Å; C103-F106 PolarHBondContact O-N 3.2Å; C103-R107 PolarHBondContact O-N 3.25Å; C103-Y139 HydrophobicContact CB-CD2 4.07Å
104	Q	94.8	Very high	83.5	Confident	81 Å²	81	73.9 Å²	73.9	38%	0.379	36%	0.358	S	S	.	.	H	α-helix	trans	-60	-26.3	179.8	-172.9	61.1	44.2	0	0	113.5	L100 H101 T102 F106 Y139	L100-Q104 VanDerWaalsContact O-CB 3.27Å; L100-Q104 WeakPolarHBondContact O-CB 3.42Å; L100-Q104 PolarHBondContact O-N 3.25Å; H101-Q104 PolarHBondContact O-N 3.08Å; T102-Q104 VanDerWaalsContact C-N 3.29Å; T102-Q104 PolarHBondContact O-N 3.12Å; Q104-F106 VanDerWaalsContact C-N 3.31Å; Q104-Y139 HydrophobicContact CB-CD2 4.46Å; Q104-Y139 HydrophobicContact CB-CE2 4.24Å
105	R	93.4	Very high	81.3	Confident	147 Å²	147	74.3 Å²	74.3	56%	0.555	36%	0.358	S	S	*	.	H	α-helix	trans	-70.6	-27.2	176.5	-68.1	170.5	62	-172.9	0.1	113.2	S63 H101 T102 C103	S63-R105 PolarHBondContact O-NH1 2.89Å; H101-R105 PolarHBondContact O-N 3.42Å; T102-R105 WeakPolarHBondContact O-CB 3.45Å; T102-R105 PolarHBondContact O-N 3.01Å; T102-R105 VanDerWaalsContact O-N 3.13Å; C103-R105 PolarHBondContact O-N 2.58Å; C103-R105 VanDerWaalsContact O-N 3.16Å
106	F	91.4	Very high	78.7	Confident	40 Å²	40	79.1 Å²	79.1	18%	0.175	38%	0.383	C	S	.	.	H	α-helix	trans	-93.3	-17.5	179.2	-65.4	-84.6	0	0	0	112.9	H64 M66 T102 C103 Q104 E131 E132 A135	H64-F106 VanDerWaalsContact O-CZ 3.31Å; H64-F106 WeakPolarHBondContact O-CZ 3.4Å; M66-F106 HydrophobicContact CB-CD2 4.26Å; M66-F106 HydrophobicContact CE-CB 4.08Å; M66-F106 HydrophobicContact CE-CD1 4.06Å; M66-F106 HydrophobicContact CE-CG 4.01Å; T102-F106 HydrophobicContact CG2-CE2 4.08Å; T102-F106 VanDerWaalsContact O-CD2 3.24Å; T102-F106 WeakPolarHBondContact O-CD2 3.33Å; C103-F106 PolarHBondContact O-N 3.2Å; Q104-F106 VanDerWaalsContact C-N 3.31Å; F106-E131 HydrophobicContact CD1-CG 4.05Å; F106-E131 WeakPolarHBondContact CD1-OE1 3.19Å; F106-E131 VanDerWaalsContact CE1-OE1 3.25Å; F106-E131 WeakPolarHBondContact CE1-OE1 3.48Å; F106-E132 WeakPolarHBondContact O-CG 3.39Å; F106-A135 HydrophobicContact CB-CB 3.55Å
107	R	90.1	Very high	76.1	Confident	44 Å²	44	81.6 Å²	81.6	17%	0.166	40%	0.403	C	S	.	.	S	Bend	trans	-67.9	148.5	174.7	-69.7	178.1	68.7	-164.7	11.2	110.9	C103 K109 A135 E136	C103-R107 PolarHBondContact O-N 3.25Å; R107-K109 PolarHBondContact O-N 3.26Å; R107-A135 HydrophobicContact CG-CB 3.84Å; R107-E136 IonicContact CZ-OE1 3.45Å; R107-E136 IonicContact CZ-OE2 3.45Å; R107-E136 IonicContact NE-OE1 2.98Å; R107-E136 PolarHBondContact NE-OE1 3.49Å; R107-E136 IonicContact NE-OE2 3.92Å; R107-E136 PolarHBondContact NE-OE2 3Å; R107-E136 VanDerWaalsContact NH2-CD 3.33Å; R107-E136 IonicContact NH2-OE1 2.81Å; R107-E136 PolarHBondContact NH2-OE1 2.76Å; R107-E136 VanDerWaalsContact NH2-OE1 3.1Å; R107-E136 IonicContact NH2-OE2 2.83Å; R107-E136 PolarHBondContact NH2-OE2 2.87Å
108	R	82.6	Confident	73.9	Confident	93 Å²	93	79 Å²	79	35%	0.351	40%	0.4	S	S	.	.			trans	-54.8	127.1	175.4	-173.1	173.7	129.4	-171.4	-2.6	110.3	T110 L128 E132	R108-T110 PolarHBondContact O-N 2.93Å; R108-T110 VanDerWaalsContact O-N 3.08Å; R108-L128 HydrophobicContact CB-CD2 4.02Å; R108-E132 WeakPolarHBondContact CA-OE1 3.46Å; R108-E132 HydrophobicContact CB-CG 4.34Å; R108-E132 VanDerWaalsContact CB-OE1 3.3Å; R108-E132 WeakPolarHBondContact CB-OE1 3.4Å; R108-E132 WeakPolarHBondContact CG-OE1 3.19Å
109	K	71.1	Confident	71.3	Confident	188 Å²	188	82.2 Å²	82.2	82%	0.817	41%	0.412	S	S	*	.			trans	-80.6	85.4	175.5	-64.7	-178.9	-174.8	173.9	0	109.3	R107	R107-K109 PolarHBondContact O-N 3.26Å
110	T	57.7	Low	68.5	Low	68 Å²	68	91.5 Å²	91.5	42%	0.417	45%	0.447	S	S	.	.			trans	-72.9	128.4	170.9	15.4	0	0	0	0	110.2	R108 E114	R108-T110 PolarHBondContact O-N 2.93Å; R108-T110 VanDerWaalsContact O-N 3.08Å; T110-E114 HydrophobicContact CG2-CB 4.23Å
111	G	53.8	Low	65.8	Low	39 Å²	39	98 Å²	98	40%	0.402	48%	0.477	S	S	.	.			trans	-65.6	152.4	169.3	0	0	0	0	0	111	M113 E114 S115	G111-M113 PolarHBondContact O-N 3.1Å; G111-E114 PolarHBondContact O-N 2.94Å; G111-S115 PolarHBondContact O-N 3.1Å
112	I	50.4	Low	63.3	Low	149 Å²	149	95.2 Å²	95.2	76%	0.764	48%	0.483	S	S	*	.	H	α-helix	trans	-53.6	-31.7	-179.2	-61.1	171.7	0	0	0	112
113	M	42.8	Very low	61	Low	168 Å²	168	101.6 Å²	101.6	83%	0.828	51%	0.512	S	S	*	.	H	α-helix	trans	-74.9	-35.1	179.1	-156.6	85.6	102.9	0	0	113.2	G111	G111-M113 PolarHBondContact O-N 3.1Å
114	E	51.5	Low	58.8	Low	110 Å²	110	105.3 Å²	105.3	51%	0.514	54%	0.536	S	S	.	.	H	α-helix	trans	-75.8	-32.1	179.6	-75.6	179	162.8	0	0	112.2	T110 G111 L116 A117 S118	T110-E114 HydrophobicContact CG2-CB 4.23Å; G111-E114 PolarHBondContact O-N 2.94Å; E114-L116 VanDerWaalsContact C-N 3.29Å; E114-L116 PolarHBondContact O-N 2.96Å; E114-A117 PolarHBondContact O-N 2.97Å; E114-S118 PolarHBondContact O-N 2.99Å; E114-S118 PolarHBondContact O-OG 3.44Å
115	S	49.7	Very low	56.9	Low	56 Å²	56	105 Å²	105	39%	0.392	53%	0.534	S	S	.	.	H	α-helix	trans	-68	-29.1	179.2	110.2	0	0	0	0	112.9	G111 S118 F119	G111-S115 PolarHBondContact O-N 3.1Å; S115-S118 WeakPolarHBondContact CA-OG 3.5Å; S115-S118 PolarHBondContact O-OG 3.15Å; S115-S118 VanDerWaalsContact O-OG 3.12Å; S115-F119 PolarHBondContact O-N 2.83Å
116	L	44.5	Very low	55	Low	109 Å²	109	104 Å²	104	57%	0.571	54%	0.539	S	S	*	.	H	α-helix	trans	-76.2	-36.1	175.5	-72.3	169.9	0	0	0	111.3	E114 W120	E114-L116 VanDerWaalsContact C-N 3.29Å; E114-L116 PolarHBondContact O-N 2.96Å; L116-W120 VanDerWaalsContact O-CD1 3.31Å
117	A	42.3	Very low	53.7	Low	52 Å²	52	108.8 Å²	108.8	43%	0.43	57%	0.566	S	S	.	*	H	α-helix	trans	-70.9	-39.7	175.5	0	0	0	0	0	112.5	E114 F119 W120 H121	E114-A117 PolarHBondContact O-N 2.97Å; A117-F119 VanDerWaalsContact C-N 3.31Å; A117-F119 PolarHBondContact O-N 2.92Å; A117-W120 PolarHBondContact O-N 3.4Å; A117-H121 PolarHBondContact O-N 3.35Å
118	S	51	Low	52.9	Low	60 Å²	60	108.5 Å²	108.5	42%	0.42	57%	0.568	S	S	.	*	H	α-helix	trans	-68.1	-28	179	63.7	0	0	0	0	113.6	E114 S115	E114-S118 PolarHBondContact O-N 2.99Å; E114-S118 PolarHBondContact O-OG 3.44Å; S115-S118 WeakPolarHBondContact CA-OG 3.5Å; S115-S118 PolarHBondContact O-OG 3.15Å; S115-S118 VanDerWaalsContact O-OG 3.12Å
119	F	43.5	Very low	53.1	Low	175 Å²	175	107.6 Å²	107.6	77%	0.768	57%	0.573	S	S	*	*	H	α-helix	trans	-73.1	-26.4	176.7	-173.2	-98.1	0	0	0	112.9	S115 A117	S115-F119 PolarHBondContact O-N 2.83Å; A117-F119 VanDerWaalsContact C-N 3.31Å; A117-F119 PolarHBondContact O-N 2.92Å
120	W	40.2	Very low	53.9	Low	197 Å²	197	101.1 Å²	101.1	75%	0.746	55%	0.546	S	S	*	.	H	α-helix	trans	-103.2	-27.2	-176.3	-77.2	74.4	0	0	0	114.2	L116 A117	L116-W120 VanDerWaalsContact O-CD1 3.31Å; A117-W120 PolarHBondContact O-N 3.4Å
121	H	40.6	Very low	55.4	Low	148 Å²	148	100.7 Å²	100.7	69%	0.685	54%	0.539	S	S	*	.	H	α-helix	trans	-134.4	32	-168.1	-73.9	-32.1	0	0	0	115.2	A117 Q123	A117-H121 PolarHBondContact O-N 3.35Å; H121-Q123 VanDerWaalsContact C-N 3.34Å; H121-Q123 PolarHBondContact O-N 3.27Å
122	G	44.6	Very low	57.2	Low	69 Å²	69	100.7 Å²	100.7	71%	0.711	53%	0.528	S	S	*	.			trans	31.9	63.3	162.9	0	0	0	0	0	114.2
123	Q	47.6	Very low	59.1	Low	141 Å²	141	94.7 Å²	94.7	66%	0.659	50%	0.497	S	S	*	.			trans	-65.8	140.1	176.9	-78.8	-80.5	-45.3	0	0	108.7	H121	H121-Q123 VanDerWaalsContact C-N 3.34Å; H121-Q123 PolarHBondContact O-N 3.27Å
124	P	50.9	Low	61.6	Low	78 Å²	78	86.8 Å²	86.8	51%	0.506	46%	0.458	S	S	.	.			trans	-63.9	149.4	-179.1	27.7	-33.2	0	0	0	110.5	D126	P124-D126 WeakPolarHBondContact CB-OD2 3.4Å; P124-D126 WeakPolarHBondContact CG-OD2 3.29Å; P124-D126 PolarHBondContact O-N 3.01Å
125	F	54.6	Low	63.7	Low	75 Å²	75	81.6 Å²	81.6	33%	0.329	43%	0.434	S	S	.	.	S	Bend	trans	-68.8	10.7	-177.5	-66	-81.9	0	0	0	113.8	N127 L128 A178 M179 V182	F125-N127 PolarHBondContact O-N 3.08Å; F125-L128 HydrophobicContact CD1-CD1 4.48Å; F125-A178 HydrophobicContact CE2-CB 3.85Å; F125-A178 HydrophobicContact CZ-CB 3.65Å; F125-M179 HydrophobicContact CD1-CB 4.42Å; F125-M179 HydrophobicContact CD1-CE 4.15Å; F125-M179 HydrophobicContact CD1-CG 3.3Å; F125-M179 HydrophobicContact CD1-SD 4.42Å; F125-M179 HydrophobicContact CE1-CE 3.89Å; F125-M179 HydrophobicContact CE1-CG 3.46Å; F125-M179 VanDerWaalsContact CE1-CG 3.46Å; F125-M179 HydrophobicContact CG-CG 4Å; F125-M179 HydrophobicContact CZ-CG 4.26Å; F125-V182 HydrophobicContact CB-CG2 4.15Å; F125-V182 HydrophobicContact CD2-CG2 3.92Å; F125-V182 HydrophobicContact CG-CG2 4.32Å
126	D	54	Low	65.9	Low	126 Å²	126	80 Å²	80	67%	0.674	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	7.7	-161.2	-67	-10.9	0	0	0	116.5	P124	P124-D126 WeakPolarHBondContact CB-OD2 3.4Å; P124-D126 WeakPolarHBondContact CG-OD2 3.29Å; P124-D126 PolarHBondContact O-N 3.01Å
127	N	64.8	Low	68.4	Low	139 Å²	139	74.8 Å²	74.8	74%	0.743	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.2	22.9	-173.4	-71.9	-53.3	0	0	0	115.3	F125	F125-N127 PolarHBondContact O-N 3.08Å
128	L	73.6	Confident	71	Confident	39 Å²	39	72.3 Å²	72.3	20%	0.204	37%	0.373	C	S	.	.			trans	-89.1	134	172	-78.5	163.1	0	0	0	110.8	R108 F125 E132 M133 M179	R108-L128 HydrophobicContact CB-CD2 4.02Å; F125-L128 HydrophobicContact CD1-CD1 4.48Å; L128-E132 HydrophobicContact CD2-CB 3.76Å; L128-M133 HydrophobicContact CB-CG 4.02Å; L128-M179 HydrophobicContact CD1-CE 3.8Å; L128-M179 HydrophobicContact CD1-CG 4.48Å; L128-M179 HydrophobicContact CD1-SD 3.8Å
129	T	86.3	Confident	73.3	Confident	73 Å²	73	71.6 Å²	71.6	45%	0.448	36%	0.361	S	S	.	.			trans	-73.6	156.5	167.7	62	0	0	0	0	110.7	E131 E132 M133	T129-E131 PolarHBondContact O-N 2.95Å; T129-E132 PolarHBondContact N-OE2 3.3Å; T129-E132 PolarHBondContact O-N 3.49Å; T129-E132 VanDerWaalsContact O-N 3.12Å; T129-E132 WeakPolarHBondContact OG1-CB 3.11Å; T129-E132 WeakPolarHBondContact OG1-CG 3.25Å; T129-E132 PolarHBondContact OG1-N 2.88Å; T129-E132 PolarHBondContact OG1-OE2 3.36Å; T129-M133 WeakPolarHBondContact O-CG 3.29Å; T129-M133 PolarHBondContact O-N 2.91Å
130	E	86.4	Confident	75.8	Confident	53 Å²	53	63.3 Å²	63.3	25%	0.248	33%	0.325	C	S	.	.	H	α-helix	trans	-55.8	-40.1	174	-71.2	-170.7	-175.2	0	0	112	L32 E132 M133 H134 R190 T192	L32-E130 HydrophobicContact CD2-CB 4.21Å; E130-E132 VanDerWaalsContact C-N 3.33Å; E130-E132 PolarHBondContact O-N 3.29Å; E130-M133 PolarHBondContact O-N 3.22Å; E130-H134 WeakPolarHBondContact O-CB 3.41Å; E130-H134 PolarHBondContact O-CD2 3.41Å; E130-H134 PolarHBondContact O-N 2.87Å; E130-R190 WeakPolarHBondContact OE1-CD 3.37Å; E130-R190 IonicContact OE1-CZ 2.73Å; E130-R190 IonicContact OE1-NE 3.1Å; E130-R190 IonicContact OE1-NH1 3.36Å; E130-R190 PolarHBondContact OE1-NH1 3.48Å; E130-T192 PolarHBondContact OE2-OG1 3.09Å
131	E	89.8	Confident	78.6	Confident	59 Å²	59	54 Å²	54	28%	0.276	29%	0.289	S	S	.	.	H	α-helix	trans	-60.5	-43.2	178.6	-166.8	176.1	-151.6	0	0	111.3	M66 F106 T129 H134 A135	M66-E131 HydrophobicContact CE-CG 3.48Å; M66-E131 VanDerWaalsContact CE-CG 3.48Å; F106-E131 HydrophobicContact CD1-CG 4.05Å; F106-E131 WeakPolarHBondContact CD1-OE1 3.19Å; F106-E131 VanDerWaalsContact CE1-OE1 3.25Å; F106-E131 WeakPolarHBondContact CE1-OE1 3.48Å; T129-E131 PolarHBondContact O-N 2.95Å; E131-H134 PolarHBondContact O-N 3.09Å; E131-A135 VanDerWaalsContact O-CB 3.31Å; E131-A135 WeakPolarHBondContact O-CB 3.27Å; E131-A135 PolarHBondContact O-N 3.18Å
132	E	91.3	Very high	81.3	Confident	39 Å²	39	46.9 Å²	46.9	18%	0.182	26%	0.257	C	S	.	.	H	α-helix	trans	-66.8	-39.3	176.4	-71.6	167.6	135.1	0	0	112.3	F106 R108 L128 T129 E130 A135 E136	F106-E132 WeakPolarHBondContact O-CG 3.39Å; R108-E132 WeakPolarHBondContact CA-OE1 3.46Å; R108-E132 HydrophobicContact CB-CG 4.34Å; R108-E132 VanDerWaalsContact CB-OE1 3.3Å; R108-E132 WeakPolarHBondContact CB-OE1 3.4Å; R108-E132 WeakPolarHBondContact CG-OE1 3.19Å; L128-E132 HydrophobicContact CD2-CB 3.76Å; T129-E132 PolarHBondContact N-OE2 3.3Å; T129-E132 PolarHBondContact O-N 3.49Å; T129-E132 VanDerWaalsContact O-N 3.12Å; T129-E132 WeakPolarHBondContact OG1-CB 3.11Å; T129-E132 WeakPolarHBondContact OG1-CG 3.25Å; T129-E132 PolarHBondContact OG1-N 2.88Å; T129-E132 PolarHBondContact OG1-OE2 3.36Å; E130-E132 VanDerWaalsContact C-N 3.33Å; E130-E132 PolarHBondContact O-N 3.29Å; E132-A135 WeakPolarHBondContact O-CB 3.31Å; E132-A135 PolarHBondContact O-N 3.15Å; E132-E136 WeakPolarHBondContact O-CG 3.42Å; E132-E136 PolarHBondContact O-N 3.44Å
133	M	91.4	Very high	83.8	Confident	22 Å²	22	44.6 Å²	44.6	11%	0.108	23%	0.228	C	C	.	.	H	α-helix	trans	-61.7	-48.7	175.5	-68.8	172.3	58.6	0	0	111.4	L128 T129 E130 A135 E136 L137 M179 I183 F196	L128-M133 HydrophobicContact CB-CG 4.02Å; T129-M133 WeakPolarHBondContact O-CG 3.29Å; T129-M133 PolarHBondContact O-N 2.91Å; E130-M133 PolarHBondContact O-N 3.22Å; M133-A135 PolarHBondContact O-N 3.47Å; M133-E136 PolarHBondContact O-N 3.08Å; M133-L137 PolarHBondContact O-N 2.8Å; M133-L137 VanDerWaalsContact O-N 3.09Å; M133-M179 HydrophobicContact CE-CB 4.47Å; M133-M179 HydrophobicContact CG-SD 4.23Å; M133-I183 HydrophobicContact CE-CD1 3.53Å; M133-I183 HydrophobicContact CE-CG1 4.46Å; M133-F196 HydrophobicContact CB-CD2 4.19Å; M133-F196 HydrophobicContact CB-CE2 3.85Å; M133-F196 HydrophobicContact CB-CZ 4.28Å; M133-F196 HydrophobicContact CE-CD1 3.78Å; M133-F196 HydrophobicContact CE-CD2 4.43Å; M133-F196 HydrophobicContact CE-CE1 3.47Å; M133-F196 VanDerWaalsContact CE-CE1 3.47Å; M133-F196 HydrophobicContact CE-CE2 4.19Å; M133-F196 HydrophobicContact CE-CG 4.24Å; M133-F196 HydrophobicContact CE-CZ 3.7Å; M133-F196 WeakPolarHBondContact O-CE2 3.3Å
134	H	94.9	Very high	86.1	Confident	3 Å²	3	39.3 Å²	39.3	1%	0.014	20%	0.204	C	C	.	.	H	α-helix	trans	-63.4	-32.4	176.6	-80.8	-112.1	0	0	0	111.9	L32 M66 Y67 E130 E131 L137 C138 T192	L32-H134 HydrophobicContact CD1-CB 4.2Å; L32-H134 HydrophobicContact CD2-CB 4.4Å; M66-H134 VanDerWaalsContact SD-C 3.55Å; M66-H134 HydrophobicContact SD-CB 3.92Å; Y67-H134 HydrophobicContact CE2-CB 4.05Å; Y67-H134 AromaticContact CE2-ND1 3.46Å; Y67-H134 WeakPolarHBondContact CE2-ND1 3.33Å; Y67-H134 AromaticContact CZ-ND1 3.5Å; Y67-H134 PolarHBondContact OH-CE1 3.24Å; Y67-H134 PolarHBondContact OH-ND1 3.4Å; E130-H134 WeakPolarHBondContact O-CB 3.41Å; E130-H134 PolarHBondContact O-CD2 3.41Å; E130-H134 PolarHBondContact O-N 2.87Å; E131-H134 PolarHBondContact O-N 3.09Å; H134-L137 PolarHBondContact O-N 3.47Å; H134-C138 WeakPolarHBondContact O-CB 3.21Å; H134-C138 PolarHBondContact O-N 3.1Å; H134-C138 PolarHBondContact O-SG 2.99Å; H134-T192 PolarHBondContact CE1-O 2.7Å; H134-T192 VanDerWaalsContact CE1-O 3.29Å; H134-T192 PolarHBondContact NE2-O 2.84Å
135	A	95.7	Very high	88.2	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68.7	-39.9	175.2	0	0	0	0	0	112.6	M66 F106 R107 E131 E132 M133 L137 Y139	M66-A135 HydrophobicContact CE-CB 4.38Å; M66-A135 VanDerWaalsContact SD-CA 3.51Å; M66-A135 HydrophobicContact SD-CB 3.86Å; M66-A135 PolarHBondContact SD-N 3.12Å; M66-A135 VanDerWaalsContact SD-N 3.37Å; F106-A135 HydrophobicContact CB-CB 3.55Å; R107-A135 HydrophobicContact CG-CB 3.84Å; E131-A135 VanDerWaalsContact O-CB 3.31Å; E131-A135 WeakPolarHBondContact O-CB 3.27Å; E131-A135 PolarHBondContact O-N 3.18Å; E132-A135 WeakPolarHBondContact O-CB 3.31Å; E132-A135 PolarHBondContact O-N 3.15Å; M133-A135 PolarHBondContact O-N 3.47Å; A135-L137 VanDerWaalsContact C-N 3.35Å; A135-Y139 WeakPolarHBondContact O-CB 3.11Å; A135-Y139 PolarHBondContact O-N 3.11Å
136	E	95.6	Very high	90.2	Very high	23 Å²	23	35.7 Å²	35.7	11%	0.107	18%	0.18	C	C	.	.	H	α-helix	trans	-58.9	-47.2	171.4	-71	-63.1	145.5	0	0	110.9	R107 E132 M133 Y139 A140 I172	R107-E136 IonicContact CZ-OE1 3.45Å; R107-E136 IonicContact CZ-OE2 3.45Å; R107-E136 IonicContact NE-OE1 2.98Å; R107-E136 PolarHBondContact NE-OE1 3.49Å; R107-E136 IonicContact NE-OE2 3.92Å; R107-E136 PolarHBondContact NE-OE2 3Å; R107-E136 VanDerWaalsContact NH2-CD 3.33Å; R107-E136 IonicContact NH2-OE1 2.81Å; R107-E136 PolarHBondContact NH2-OE1 2.76Å; R107-E136 VanDerWaalsContact NH2-OE1 3.1Å; R107-E136 IonicContact NH2-OE2 2.83Å; R107-E136 PolarHBondContact NH2-OE2 2.87Å; E132-E136 WeakPolarHBondContact O-CG 3.42Å; E132-E136 PolarHBondContact O-N 3.44Å; M133-E136 PolarHBondContact O-N 3.08Å; E136-Y139 PolarHBondContact O-N 2.84Å; E136-A140 WeakPolarHBondContact O-CB 3.39Å; E136-A140 PolarHBondContact O-N 3.06Å; E136-I172 HydrophobicContact CB-CG2 4.18Å; E136-I172 WeakPolarHBondContact O-CG2 3.26Å; E136-I172 WeakPolarHBondContact OE2-CG2 3.39Å
137	L	96.6	Very high	92.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.6	-51.4	178.5	174.1	63.1	0	0	0	112.2	M133 H134 A135 Y139 A140 E141 Y173 F196 V200	M133-L137 PolarHBondContact O-N 2.8Å; M133-L137 VanDerWaalsContact O-N 3.09Å; H134-L137 PolarHBondContact O-N 3.47Å; A135-L137 VanDerWaalsContact C-N 3.35Å; L137-Y139 VanDerWaalsContact C-N 3.31Å; L137-Y139 PolarHBondContact O-N 3.29Å; L137-A140 PolarHBondContact O-N 3.05Å; L137-E141 PolarHBondContact O-N 2.97Å; L137-Y173 HydrophobicContact CD1-CD1 4.05Å; L137-Y173 HydrophobicContact CD1-CE1 3.46Å; L137-Y173 VanDerWaalsContact CD1-CE1 3.46Å; L137-F196 HydrophobicContact CB-CD2 4.12Å; L137-F196 HydrophobicContact CB-CE2 4.02Å; L137-F196 HydrophobicContact CD2-CD2 3.8Å; L137-F196 HydrophobicContact CD2-CE2 4.4Å; L137-F196 HydrophobicContact CD2-CG 4.46Å; L137-F196 WeakPolarHBondContact CD2-O 3.45Å; L137-V200 HydrophobicContact CD1-CG2 4.4Å
138	C	97.9	Very high	93.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63	-39.7	179.3	-66	0	0	0	0	111.1	M66 M70 H134 E141 V142	M66-C138 HydrophobicContact CB-CB 4.41Å; M66-C138 HydrophobicContact CG-CB 4.5Å; M70-C138 HydrophobicContact SD-CB 4.16Å; H134-C138 WeakPolarHBondContact O-CB 3.21Å; H134-C138 PolarHBondContact O-N 3.1Å; H134-C138 PolarHBondContact O-SG 2.99Å; C138-E141 PolarHBondContact O-N 3.2Å; C138-V142 VanDerWaalsContact O-CG2 3.28Å; C138-V142 WeakPolarHBondContact O-CG2 3.22Å; C138-V142 PolarHBondContact O-N 2.74Å
139	Y	98.1	Very high	94.1	Very high	45 Å²	45	23.9 Å²	23.9	18%	0.176	12%	0.124	C	C	.	.	H	α-helix	trans	-63	-43.7	176	-174.2	-85.1	0	0	0	111.9	L100 C103 Q104 A135 E136 L137 E141 L143 I172	L100-Y139 HydrophobicContact CB-CE2 4.17Å; L100-Y139 HydrophobicContact CD2-CD1 4.41Å; L100-Y139 HydrophobicContact CD2-CD2 3.75Å; L100-Y139 HydrophobicContact CD2-CE1 4.34Å; L100-Y139 HydrophobicContact CD2-CE2 3.66Å; L100-Y139 HydrophobicContact CD2-CG 4.12Å; L100-Y139 HydrophobicContact CG-CE2 4.48Å; C103-Y139 HydrophobicContact CB-CD2 4.07Å; Q104-Y139 HydrophobicContact CB-CD2 4.46Å; Q104-Y139 HydrophobicContact CB-CE2 4.24Å; A135-Y139 WeakPolarHBondContact O-CB 3.11Å; A135-Y139 PolarHBondContact O-N 3.11Å; E136-Y139 PolarHBondContact O-N 2.84Å; L137-Y139 VanDerWaalsContact C-N 3.31Å; L137-Y139 PolarHBondContact O-N 3.29Å; Y139-E141 VanDerWaalsContact C-N 3.3Å; Y139-E141 PolarHBondContact O-N 3.25Å; Y139-L143 HydrophobicContact CE1-CD2 4Å; Y139-L143 WeakPolarHBondContact O-CB 3.45Å; Y139-L143 PolarHBondContact O-N 3.46Å; Y139-I172 HydrophobicContact CD1-CD1 3.78Å; Y139-I172 HydrophobicContact CE1-CD1 3.99Å
140	A	97.6	Very high	94.2	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-59.3	-43	176.5	0	0	0	0	0	111.7	E136 L137 L143 M144 S169 I172 Y173	E136-A140 WeakPolarHBondContact O-CB 3.39Å; E136-A140 PolarHBondContact O-N 3.06Å; L137-A140 PolarHBondContact O-N 3.05Å; A140-L143 PolarHBondContact O-N 3.38Å; A140-M144 PolarHBondContact O-N 3.46Å; A140-S169 WeakPolarHBondContact O-CB 3.46Å; A140-S169 PolarHBondContact O-OG 3.5Å; A140-I172 HydrophobicContact CB-CB 3.87Å; A140-I172 HydrophobicContact CB-CG2 3.7Å; A140-Y173 HydrophobicContact CB-CD1 4.49Å; A140-Y173 HydrophobicContact CB-CD2 3.77Å; A140-Y173 HydrophobicContact CB-CE1 4.41Å; A140-Y173 HydrophobicContact CB-CE2 3.68Å; A140-Y173 HydrophobicContact CB-CG 4.19Å
141	E	97.6	Very high	94	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-65.4	-51.4	179.4	-169.2	170.4	152.6	0	0	112.2	M70 L137 C138 Y139 L143 M144 Q145 Y173 M202 R248	M70-E141 HydrophobicContact SD-CB 4.17Å; M70-E141 HydrophobicContact SD-CG 4.14Å; L137-E141 PolarHBondContact O-N 2.97Å; C138-E141 PolarHBondContact O-N 3.2Å; Y139-E141 VanDerWaalsContact C-N 3.3Å; Y139-E141 PolarHBondContact O-N 3.25Å; E141-L143 PolarHBondContact O-N 2.89Å; E141-M144 WeakPolarHBondContact O-CB 3.42Å; E141-M144 PolarHBondContact O-N 3.49Å; E141-M144 VanDerWaalsContact O-N 3.14Å; E141-Q145 WeakPolarHBondContact O-CB 3.36Å; E141-Q145 WeakPolarHBondContact O-CG 3.41Å; E141-Q145 PolarHBondContact O-N 2.82Å; E141-Y173 VanDerWaalsContact CA-OH 3.25Å; E141-Y173 WeakPolarHBondContact CA-OH 3.23Å; E141-Y173 VanDerWaalsContact CB-OH 3.24Å; E141-Y173 WeakPolarHBondContact CB-OH 3.42Å; E141-M202 HydrophobicContact CG-CE 4.33Å; E141-M202 WeakPolarHBondContact OE2-CE 3.27Å; E141-R248 IonicContact OE1-NE 3.16Å; E141-R248 IonicContact OE2-CZ 2.71Å; E141-R248 VanDerWaalsContact OE2-CZ 3.27Å; E141-R248 IonicContact OE2-NE 2.66Å; E141-R248 PolarHBondContact OE2-NE 3.05Å; E141-R248 IonicContact OE2-NH2 3.46Å; E141-R248 PolarHBondContact OE2-NH2 2.7Å
142	V	98.2	Very high	93.4	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.4	-34.5	177.7	-178.9	0	0	0	0	110.5	M70 L96 A99 L100 C138 Q145 K146	M70-V142 HydrophobicContact CB-CG2 3.87Å; M70-V142 HydrophobicContact CG-CG2 3.67Å; L96-V142 HydrophobicContact CB-CG1 4.32Å; L96-V142 HydrophobicContact CD2-CG1 3.8Å; L96-V142 VanDerWaalsContact O-CG1 3.3Å; L96-V142 WeakPolarHBondContact O-CG1 3.33Å; A99-V142 HydrophobicContact CB-CG1 3.84Å; A99-V142 HydrophobicContact CB-CG2 4.17Å; L100-V142 HydrophobicContact CD2-CB 3.86Å; L100-V142 HydrophobicContact CD2-CG1 3.81Å; L100-V142 HydrophobicContact CG-CB 4.27Å; L100-V142 HydrophobicContact CG-CG1 3.63Å; C138-V142 VanDerWaalsContact O-CG2 3.28Å; C138-V142 WeakPolarHBondContact O-CG2 3.22Å; C138-V142 PolarHBondContact O-N 2.74Å; V142-Q145 PolarHBondContact O-N 3.28Å; V142-K146 VanDerWaalsContact O-CB 3.31Å; V142-K146 WeakPolarHBondContact O-CB 3.29Å; V142-K146 PolarHBondContact O-N 3.17Å
143	L	97.4	Very high	92.7	Very high	20 Å²	20	22.1 Å²	22.1	11%	0.105	12%	0.115	C	C	.	.	H	α-helix	trans	-68.2	-40.7	176.4	-176.1	60.1	0	0	0	111.9	L100 Y139 A140 E141 A147 I172	L100-L143 HydrophobicContact CD1-CD1 4.36Å; L100-L143 HydrophobicContact CD2-CB 4.01Å; Y139-L143 HydrophobicContact CE1-CD2 4Å; Y139-L143 WeakPolarHBondContact O-CB 3.45Å; Y139-L143 PolarHBondContact O-N 3.46Å; A140-L143 PolarHBondContact O-N 3.38Å; E141-L143 PolarHBondContact O-N 2.89Å; L143-A147 VanDerWaalsContact O-CB 3.24Å; L143-A147 WeakPolarHBondContact O-CB 3.35Å; L143-A147 PolarHBondContact O-N 3.28Å; L143-I172 HydrophobicContact CD2-CD1 4.49Å
144	M	95.5	Very high	91.8	Very high	30 Å²	30	26 Å²	26	15%	0.148	13%	0.133	C	C	.	.	H	α-helix	trans	-59.6	-49.5	172.8	-178.1	179.7	65	0	0	110.6	A140 E141 K146 A147 A148 M166 S169 F207	A140-M144 PolarHBondContact O-N 3.46Å; E141-M144 WeakPolarHBondContact O-CB 3.42Å; E141-M144 PolarHBondContact O-N 3.49Å; E141-M144 VanDerWaalsContact O-N 3.14Å; M144-K146 PolarHBondContact O-N 3.3Å; M144-A147 PolarHBondContact O-N 2.86Å; M144-A148 WeakPolarHBondContact O-CB 3.24Å; M144-A148 PolarHBondContact O-N 3.28Å; M144-M166 HydrophobicContact CG-CE 4.21Å; M144-M166 HydrophobicContact CG-SD 3.99Å; M144-S169 WeakPolarHBondContact CB-OG 3.24Å; M144-F207 HydrophobicContact CB-CZ 4.43Å; M144-F207 HydrophobicContact CG-CE2 4.28Å; M144-F207 HydrophobicContact CG-CZ 4Å; M144-F207 HydrophobicContact SD-CD2 4.38Å; M144-F207 HydrophobicContact SD-CE2 3.7Å; M144-F207 HydrophobicContact SD-CZ 3.96Å
145	Q	95.8	Very high	91.2	Very high	21 Å²	21	27.9 Å²	27.9	10%	0.098	15%	0.146	C	C	.	.	H	α-helix	trans	-58.4	-47.1	178.6	-78	-177.3	0.8	0	0	112.5	S74 L77 L96 E141 V142 A147 A148 L149	S74-Q145 PolarHBondContact OG-NE2 3.5Å; S74-Q145 PolarHBondContact OG-OE1 3.04Å; L77-Q145 HydrophobicContact CD2-CB 3.54Å; L77-Q145 HydrophobicContact CD2-CG 3.47Å; L77-Q145 VanDerWaalsContact CD2-CG 3.47Å; L96-Q145 HydrophobicContact CD2-CB 3.73Å; E141-Q145 WeakPolarHBondContact O-CB 3.36Å; E141-Q145 WeakPolarHBondContact O-CG 3.41Å; E141-Q145 PolarHBondContact O-N 2.82Å; V142-Q145 PolarHBondContact O-N 3.28Å; Q145-A147 PolarHBondContact O-N 3.46Å; Q145-A148 PolarHBondContact O-N 3.03Å; Q145-L149 PolarHBondContact O-N 3.18Å
146	K	96	Very high	90.3	Very high	57 Å²	57	32.2 Å²	32.2	25%	0.248	17%	0.172	C	C	.	.	H	α-helix	trans	-62.4	-42.4	174.6	-178.6	-175.6	169.6	-171.1	0	112.2	M93 L96 L100 V142 M144 L149 T150	M93-K146 HydrophobicContact SD-CG 3.89Å; L96-K146 HydrophobicContact CB-CB 4.26Å; L96-K146 HydrophobicContact CD1-CB 4.36Å; L100-K146 HydrophobicContact CD1-CD 3.47Å; L100-K146 VanDerWaalsContact CD1-CD 3.47Å; V142-K146 VanDerWaalsContact O-CB 3.31Å; V142-K146 WeakPolarHBondContact O-CB 3.29Å; V142-K146 PolarHBondContact O-N 3.17Å; M144-K146 PolarHBondContact O-N 3.3Å; K146-L149 PolarHBondContact O-N 3.07Å; K146-T150 WeakPolarHBondContact O-CB 3.44Å; K146-T150 PolarHBondContact O-N 3.34Å; K146-T150 PolarHBondContact O-OG1 3.42Å
147	A	93.1	Very high	89.7	Confident	4 Å²	4	36.4 Å²	36.4	3%	0.033	19%	0.194	C	C	.	.	H	α-helix	trans	-64.2	-42.5	178.4	0	0	0	0	0	111.4	L143 M144 Q145 T150 F151 M166	L143-A147 VanDerWaalsContact O-CB 3.24Å; L143-A147 WeakPolarHBondContact O-CB 3.35Å; L143-A147 PolarHBondContact O-N 3.28Å; M144-A147 PolarHBondContact O-N 2.86Å; Q145-A147 PolarHBondContact O-N 3.46Å; A147-T150 WeakPolarHBondContact O-CB 3.33Å; A147-T150 PolarHBondContact O-N 3.06Å; A147-F151 WeakPolarHBondContact O-CD2 3.39Å; A147-F151 PolarHBondContact O-N 2.92Å; A147-F151 VanDerWaalsContact O-N 3.17Å; A147-M166 HydrophobicContact CB-CG 3.84Å; A147-M166 HydrophobicContact CB-SD 3.76Å
148	A	90.4	Very high	89.1	Confident	46 Å²	46	37.1 Å²	37.1	38%	0.38	20%	0.2	S	C	.	.	H	α-helix	trans	-58.3	-48.1	173.4	0	0	0	0	0	111.7	M144 Q145 T150 F151	M144-A148 WeakPolarHBondContact O-CB 3.24Å; M144-A148 PolarHBondContact O-N 3.28Å; Q145-A148 PolarHBondContact O-N 3.03Å; A148-T150 VanDerWaalsContact C-N 3.28Å; A148-T150 PolarHBondContact O-N 3.11Å; A148-F151 WeakPolarHBondContact O-CB 3.46Å; A148-F151 PolarHBondContact O-N 3.36Å
149	L	89.8	Confident	88.3	Confident	6 Å²	6	42.4 Å²	42.4	3%	0.031	22%	0.223	C	C	.	.	H	α-helix	trans	-63.1	-34	176.5	-166.9	62.7	0	0	0	112.4	L77 M89 A92 M93 L96 Q145 K146 F151 L152	L77-L149 HydrophobicContact CD1-CB 3.92Å; L77-L149 HydrophobicContact CD1-CD1 3.85Å; L77-L149 HydrophobicContact CD1-CD2 4.06Å; L77-L149 HydrophobicContact CD1-CG 4.18Å; M89-L149 HydrophobicContact CE-CD1 3.28Å; M89-L149 HydrophobicContact CE-CG 4.2Å; M89-L149 HydrophobicContact SD-CD1 3.51Å; M89-L149 VanDerWaalsContact SD-CD1 3.51Å; A92-L149 HydrophobicContact CB-CD2 3.96Å; M93-L149 HydrophobicContact CB-CD2 3.89Å; M93-L149 HydrophobicContact CE-CB 4.02Å; M93-L149 HydrophobicContact CE-CD2 3.84Å; M93-L149 HydrophobicContact CE-CG 3.86Å; L96-L149 HydrophobicContact CD1-CD2 3.78Å; Q145-L149 PolarHBondContact O-N 3.18Å; K146-L149 PolarHBondContact O-N 3.07Å; L149-F151 VanDerWaalsContact C-N 3.31Å; L149-F151 PolarHBondContact O-N 3.34Å; L149-L152 HydrophobicContact CD1-CD1 4.22Å; L149-L152 WeakPolarHBondContact O-CB 3.4Å; L149-L152 PolarHBondContact O-N 3.3Å
150	T	88.8	Confident	87.6	Confident	19 Å²	19	45 Å²	45	12%	0.117	24%	0.238	C	C	.	.	H	α-helix	trans	-67.7	-29.8	177.8	-54.7	0	0	0	0	112.1	K146 A147 A148 L152 D153 S158 K161	K146-T150 WeakPolarHBondContact O-CB 3.44Å; K146-T150 PolarHBondContact O-N 3.34Å; K146-T150 PolarHBondContact O-OG1 3.42Å; A147-T150 WeakPolarHBondContact O-CB 3.33Å; A147-T150 PolarHBondContact O-N 3.06Å; A148-T150 VanDerWaalsContact C-N 3.28Å; A148-T150 PolarHBondContact O-N 3.11Å; T150-L152 PolarHBondContact O-N 3.43Å; T150-D153 WeakPolarHBondContact O-CB 3.38Å; T150-D153 PolarHBondContact O-N 3.18Å; T150-S158 WeakPolarHBondContact CG2-O 3.47Å; T150-K161 HydrophobicContact CG2-CB 4.29Å
151	F	83.3	Confident	87.1	Confident	55 Å²	55	50.7 Å²	50.7	24%	0.241	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-18.4	174.5	-74.8	-56.3	0	0	0	113.6	A147 A148 L149 D153 F159 G163 M166 I404	A147-F151 WeakPolarHBondContact O-CD2 3.39Å; A147-F151 PolarHBondContact O-N 2.92Å; A147-F151 VanDerWaalsContact O-N 3.17Å; A148-F151 WeakPolarHBondContact O-CB 3.46Å; A148-F151 PolarHBondContact O-N 3.36Å; L149-F151 VanDerWaalsContact C-N 3.31Å; L149-F151 PolarHBondContact O-N 3.34Å; F151-D153 VanDerWaalsContact C-N 3.25Å; F151-F159 AromaticContact CD1-CD2 3.62Å; F151-F159 HydrophobicContact CD1-CD2 3.62Å; F151-F159 AromaticContact CD1-CE2 3.99Å; F151-F159 HydrophobicContact CD1-CE2 3.99Å; F151-F159 HydrophobicContact CD1-CG 4.34Å; F151-F159 AromaticContact CE1-CD2 3.79Å; F151-F159 HydrophobicContact CE1-CD2 3.79Å; F151-F159 AromaticContact CE1-CE2 3.88Å; F151-F159 HydrophobicContact CE1-CE2 3.88Å; F151-F159 HydrophobicContact CE1-CG 4.31Å; F151-F159 HydrophobicContact CE1-CZ 4.47Å; F151-F159 VanDerWaalsContact CE1-O 3.3Å; F151-F159 WeakPolarHBondContact CE1-O 3.41Å; F151-G163 VanDerWaalsContact CZ-N 3.3Å; F151-M166 HydrophobicContact CE2-CG 3.65Å; F151-M166 HydrophobicContact CZ-CG 4.15Å; F151-I404 WeakPolarHBondContact O-CG2 3.35Å
152	L	77.4	Confident	86.6	Confident	39 Å²	39	50.7 Å²	50.7	20%	0.204	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-7.6	179.4	-60.5	-176.8	0	0	0	112.6	F84 M89 L149 T150 W362	F84-L152 HydrophobicContact CD2-CD1 4.39Å; F84-L152 HydrophobicContact CE2-CB 3.65Å; F84-L152 HydrophobicContact CE2-CD1 3.91Å; F84-L152 HydrophobicContact CE2-CD2 4Å; F84-L152 HydrophobicContact CE2-CG 4.02Å; F84-L152 HydrophobicContact CZ-CB 4.01Å; F84-L152 WeakPolarHBondContact CZ-O 3.5Å; M89-L152 HydrophobicContact CE-CB 3.68Å; M89-L152 HydrophobicContact CE-CD1 3.75Å; M89-L152 HydrophobicContact CE-CG 4.34Å; L149-L152 HydrophobicContact CD1-CD1 4.22Å; L149-L152 WeakPolarHBondContact O-CB 3.4Å; L149-L152 PolarHBondContact O-N 3.3Å; T150-L152 PolarHBondContact O-N 3.43Å; L152-W362 HydrophobicContact CD1-CH2 4.4Å; L152-W362 HydrophobicContact CD2-CH2 4.41Å
153	D	76.3	Confident	86	Confident	73 Å²	73	52.1 Å²	52.1	39%	0.39	28%	0.278	S	S	.	.	S	Bend	trans	-74.2	148	170.6	-178.3	17.2	0	0	0	111.5	T150 F151 S155 S158 A405	T150-D153 WeakPolarHBondContact O-CB 3.38Å; T150-D153 PolarHBondContact O-N 3.18Å; F151-D153 VanDerWaalsContact C-N 3.25Å; D153-S155 PolarHBondContact O-N 2.88Å; D153-S155 PolarHBondContact OD1-N 3.47Å; D153-S155 PolarHBondContact OD2-OG 3.17Å; D153-S158 WeakPolarHBondContact OD2-CB 3.32Å; D153-S158 PolarHBondContact OD2-OG 3.07Å; D153-A405 PolarHBondContact O-N 2.95Å
154	E	72.8	Confident	85.5	Confident	104 Å²	104	56.3 Å²	56.3	49%	0.486	30%	0.298	S	S	.	.	S	Bend	trans	-71.9	-18.2	-178.8	-52.9	-152.1	149.3	0	0	112.6	R403 A405 G406	E154-R403 VanDerWaalsContact CG-O 3.3Å; E154-R403 WeakPolarHBondContact CG-O 3.42Å; E154-A405 CarbonylContact O-C 3.45Å; E154-A405 VanDerWaalsContact O-C 3.26Å; E154-A405 WeakPolarHBondContact O-CA 3.11Å; E154-A405 PolarHBondContact O-N 2.88Å; E154-G406 PolarHBondContact O-N 3.21Å
155	S	81.1	Confident	85.3	Confident	42 Å²	42	55.5 Å²	55.5	29%	0.294	30%	0.297	S	S	.	.			trans	-81.7	138.1	-171.3	80.2	0	0	0	0	114.3	D153 I157 S158 F159	D153-S155 PolarHBondContact O-N 2.88Å; D153-S155 PolarHBondContact OD1-N 3.47Å; D153-S155 PolarHBondContact OD2-OG 3.17Å; S155-I157 PolarHBondContact O-N 2.85Å; S155-S158 PolarHBondContact O-N 3.03Å; S155-S158 VanDerWaalsContact O-N 3.12Å; S155-S158 WeakPolarHBondContact OG-CB 3.17Å; S155-S158 PolarHBondContact OG-N 3.06Å; S155-S158 VanDerWaalsContact OG-N 3.12Å; S155-S158 PolarHBondContact OG-OG 3.28Å; S155-F159 PolarHBondContact O-N 2.9Å; S155-F159 VanDerWaalsContact O-N 3.08Å
156	V	76.8	Confident	85	Confident	92 Å²	92	56.2 Å²	56.2	56%	0.558	30%	0.301	S	S	*	.	H	α-helix	trans	-61.3	-33.1	173.9	177.8	0	0	0	0	111.4	S158 F159 I160	V156-S158 VanDerWaalsContact C-N 3.33Å; V156-F159 WeakPolarHBondContact O-CB 3.25Å; V156-F159 PolarHBondContact O-N 3.47Å; V156-I160 HydrophobicContact CG1-CD1 4.37Å; V156-I160 WeakPolarHBondContact O-CG1 3.29Å; V156-I160 PolarHBondContact O-N 2.85Å; V156-I160 VanDerWaalsContact O-N 3.08Å
157	I	83.3	Confident	84.6	Confident	110 Å²	110	58.3 Å²	58.3	56%	0.564	31%	0.307	S	S	*	.	H	α-helix	trans	-61.8	-44.2	175.7	-64.1	172.7	0	0	0	110.2	S155 I160 K161	S155-I157 PolarHBondContact O-N 2.85Å; I157-I160 PolarHBondContact O-N 3.31Å; I157-K161 HydrophobicContact CG2-CD 4.11Å; I157-K161 WeakPolarHBondContact O-CG 3.31Å; I157-K161 PolarHBondContact O-N 3.29Å
158	S	84	Confident	84.5	Confident	16 Å²	16	61 Å²	61	11%	0.112	33%	0.326	C	S	.	.	H	α-helix	trans	-66.4	-36.9	176.2	-70.8	0	0	0	0	112.2	T150 D153 S155 V156 I160 K161 G162	T150-S158 WeakPolarHBondContact CG2-O 3.47Å; D153-S158 WeakPolarHBondContact OD2-CB 3.32Å; D153-S158 PolarHBondContact OD2-OG 3.07Å; S155-S158 PolarHBondContact O-N 3.03Å; S155-S158 VanDerWaalsContact O-N 3.12Å; S155-S158 WeakPolarHBondContact OG-CB 3.17Å; S155-S158 PolarHBondContact OG-N 3.06Å; S155-S158 VanDerWaalsContact OG-N 3.12Å; S155-S158 PolarHBondContact OG-OG 3.28Å; V156-S158 VanDerWaalsContact C-N 3.33Å; S158-I160 VanDerWaalsContact C-N 3.35Å; S158-I160 PolarHBondContact O-N 3.44Å; S158-K161 PolarHBondContact O-N 3.43Å; S158-G162 PolarHBondContact O-N 3.47Å
159	F	80.7	Confident	84.7	Confident	111 Å²	111	58.8 Å²	58.8	49%	0.487	31%	0.308	S	S	.	.	H	α-helix	trans	-57.2	-46	171.7	-176.1	-94.2	0	0	0	112.5	F151 S155 V156 G162 G163 A405	F151-F159 AromaticContact CD1-CD2 3.62Å; F151-F159 HydrophobicContact CD1-CD2 3.62Å; F151-F159 AromaticContact CD1-CE2 3.99Å; F151-F159 HydrophobicContact CD1-CE2 3.99Å; F151-F159 HydrophobicContact CD1-CG 4.34Å; F151-F159 AromaticContact CE1-CD2 3.79Å; F151-F159 HydrophobicContact CE1-CD2 3.79Å; F151-F159 AromaticContact CE1-CE2 3.88Å; F151-F159 HydrophobicContact CE1-CE2 3.88Å; F151-F159 HydrophobicContact CE1-CG 4.31Å; F151-F159 HydrophobicContact CE1-CZ 4.47Å; F151-F159 VanDerWaalsContact CE1-O 3.3Å; F151-F159 WeakPolarHBondContact CE1-O 3.41Å; S155-F159 PolarHBondContact O-N 2.9Å; S155-F159 VanDerWaalsContact O-N 3.08Å; V156-F159 WeakPolarHBondContact O-CB 3.25Å; V156-F159 PolarHBondContact O-N 3.47Å; F159-G162 PolarHBondContact O-N 3.02Å; F159-G163 PolarHBondContact O-N 2.88Å; F159-A405 HydrophobicContact CB-CB 3.85Å; F159-A405 HydrophobicContact CD2-CB 4.01Å; F159-A405 HydrophobicContact CG-CB 4.09Å
160	I	83.1	Confident	84.7	Confident	98 Å²	98	59 Å²	59	50%	0.503	31%	0.308	S	S	.	.	H	α-helix	trans	-64.4	-44.5	177.1	-64	168.4	0	0	0	110.8	V156 I157 S158 G162 G163 M164	V156-I160 HydrophobicContact CG1-CD1 4.37Å; V156-I160 WeakPolarHBondContact O-CG1 3.29Å; V156-I160 PolarHBondContact O-N 2.85Å; V156-I160 VanDerWaalsContact O-N 3.08Å; I157-I160 PolarHBondContact O-N 3.31Å; S158-I160 VanDerWaalsContact C-N 3.35Å; S158-I160 PolarHBondContact O-N 3.44Å; I160-G162 PolarHBondContact O-N 3.29Å; I160-G163 PolarHBondContact O-N 3.23Å; I160-M164 HydrophobicContact CG2-CE 4.09Å; I160-M164 WeakPolarHBondContact O-CG 3.32Å; I160-M164 PolarHBondContact O-N 3.12Å
161	K	87.1	Confident	84.8	Confident	121 Å²	121	62 Å²	62	53%	0.526	32%	0.323	S	S	.	.	H	α-helix	trans	-61.2	-42.4	176.7	-73.8	175.1	179	174.7	0	112.1	T150 I157 S158 M164 G165	T150-K161 HydrophobicContact CG2-CB 4.29Å; I157-K161 HydrophobicContact CG2-CD 4.11Å; I157-K161 WeakPolarHBondContact O-CG 3.31Å; I157-K161 PolarHBondContact O-N 3.29Å; S158-K161 PolarHBondContact O-N 3.43Å; K161-M164 HydrophobicContact CG-CE 4.41Å; K161-M164 PolarHBondContact O-N 3.18Å; K161-G165 PolarHBondContact O-N 3.26Å
162	G	87.9	Confident	85.3	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.4	-48.2	174.2	0	0	0	0	0	111.1	S158 F159 I160 M164 G165 M166	S158-G162 PolarHBondContact O-N 3.47Å; F159-G162 PolarHBondContact O-N 3.02Å; I160-G162 PolarHBondContact O-N 3.29Å; G162-M164 PolarHBondContact O-N 3.28Å; G162-G165 PolarHBondContact O-N 3.32Å; G162-M166 WeakPolarHBondContact O-CG 3.32Å; G162-M166 PolarHBondContact O-N 2.91Å
163	G	85.6	Confident	86.1	Confident	30 Å²	30	58.4 Å²	58.4	31%	0.309	31%	0.306	S	S	.	.	H	α-helix	trans	-59.1	-44.8	176.3	0	0	0	0	0	113.6	F151 F159 I160 M166 R167	F151-G163 VanDerWaalsContact CZ-N 3.3Å; F159-G163 PolarHBondContact O-N 2.88Å; I160-G163 PolarHBondContact O-N 3.23Å; G163-M166 PolarHBondContact O-N 2.83Å; G163-R167 PolarHBondContact O-N 2.95Å
164	M	86.4	Confident	86.8	Confident	109 Å²	109	58.2 Å²	58.2	54%	0.537	30%	0.302	S	S	.	.	H	α-helix	trans	-65.1	-40.2	174.9	-68.7	-172.6	-60.3	0	0	112.2	I160 K161 G162 R167 S168	I160-M164 HydrophobicContact CG2-CE 4.09Å; I160-M164 WeakPolarHBondContact O-CG 3.32Å; I160-M164 PolarHBondContact O-N 3.12Å; K161-M164 HydrophobicContact CG-CE 4.41Å; K161-M164 PolarHBondContact O-N 3.18Å; G162-M164 PolarHBondContact O-N 3.28Å; M164-R167 VanDerWaalsContact O-CB 3.31Å; M164-R167 WeakPolarHBondContact O-CB 3.36Å; M164-R167 PolarHBondContact O-N 3.23Å; M164-S168 PolarHBondContact O-N 2.9Å; M164-S168 PolarHBondContact O-OG 3.14Å
165	G	91.1	Very high	87.7	Confident	12 Å²	12	57.3 Å²	57.3	12%	0.124	30%	0.3	C	S	.	.	H	α-helix	trans	-61.3	-45.2	175.7	0	0	0	0	0	112.5	K161 G162 R167 S168 S169	K161-G165 PolarHBondContact O-N 3.26Å; G162-G165 PolarHBondContact O-N 3.32Å; G165-R167 VanDerWaalsContact C-N 3.27Å; G165-R167 PolarHBondContact O-N 2.87Å; G165-S168 PolarHBondContact O-N 3.18Å; G165-S169 WeakPolarHBondContact O-CB 3.21Å; G165-S169 PolarHBondContact O-N 3.21Å
166	M	89.6	Confident	88.2	Confident	36 Å²	36	55.3 Å²	55.3	18%	0.177	29%	0.287	C	S	.	.	H	α-helix	trans	-59.2	-39.3	173.4	-70.2	-58.8	-84.3	0	0	111.6	M144 A147 F151 G162 G163 Y170 F207	M144-M166 HydrophobicContact CG-CE 4.21Å; M144-M166 HydrophobicContact CG-SD 3.99Å; A147-M166 HydrophobicContact CB-CG 3.84Å; A147-M166 HydrophobicContact CB-SD 3.76Å; F151-M166 HydrophobicContact CE2-CG 3.65Å; F151-M166 HydrophobicContact CZ-CG 4.15Å; G162-M166 WeakPolarHBondContact O-CG 3.32Å; G162-M166 PolarHBondContact O-N 2.91Å; G163-M166 PolarHBondContact O-N 2.83Å; M166-Y170 WeakPolarHBondContact O-CB 3.4Å; M166-Y170 PolarHBondContact O-N 3.34Å; M166-F207 HydrophobicContact CB-CE1 4.42Å; M166-F207 HydrophobicContact CE-CD1 4.38Å; M166-F207 HydrophobicContact CE-CE1 3.58Å; M166-F207 HydrophobicContact CE-CZ 4.09Å; M166-F207 HydrophobicContact SD-CE1 4.34Å; M166-F207 HydrophobicContact SD-CZ 4.46Å
167	R	87.8	Confident	88.9	Confident	101 Å²	101	52 Å²	52	38%	0.381	27%	0.265	S	S	.	.	H	α-helix	trans	-59.4	-54.6	174.5	-169.4	169.2	175	179.7	-1.9	113	G163 M164 G165 S169 Y170 L171 L225 F227	G163-R167 PolarHBondContact O-N 2.95Å; M164-R167 VanDerWaalsContact O-CB 3.31Å; M164-R167 WeakPolarHBondContact O-CB 3.36Å; M164-R167 PolarHBondContact O-N 3.23Å; G165-R167 VanDerWaalsContact C-N 3.27Å; G165-R167 PolarHBondContact O-N 2.87Å; R167-S169 VanDerWaalsContact C-N 3.28Å; R167-S169 PolarHBondContact O-N 3.33Å; R167-Y170 PolarHBondContact O-N 3.05Å; R167-L171 HydrophobicContact CG-CD1 4.17Å; R167-L171 WeakPolarHBondContact O-CG 3.4Å; R167-L171 PolarHBondContact O-N 3.17Å; R167-L225 PolarHBondContact NE-O 3.3Å; R167-L225 PolarHBondContact NH2-O 2.98Å; R167-L225 VanDerWaalsContact NH2-O 3.14Å; R167-F227 VanDerWaalsContact CA-CE1 3.48Å; R167-F227 HydrophobicContact CB-CE1 4.05Å; R167-F227 HydrophobicContact CB-CE2 3.82Å; R167-F227 HydrophobicContact CB-CZ 3.19Å; R167-F227 HydrophobicContact CG-CE1 4.1Å; R167-F227 HydrophobicContact CG-CE2 3.53Å; R167-F227 HydrophobicContact CG-CZ 3.3Å
168	S	91.3	Very high	89.1	Confident	60 Å²	60	48.4 Å²	48.4	42%	0.42	25%	0.252	S	S	.	.	H	α-helix	trans	-60.5	-42.6	-178.3	-65.9	0	0	0	0	110.9	M164 G165 L171 I172	M164-S168 PolarHBondContact O-N 2.9Å; M164-S168 PolarHBondContact O-OG 3.14Å; G165-S168 PolarHBondContact O-N 3.18Å; S168-L171 PolarHBondContact O-N 2.87Å; S168-I172 VanDerWaalsContact O-CG1 3.27Å; S168-I172 WeakPolarHBondContact O-CG1 3.43Å; S168-I172 PolarHBondContact O-N 3.44Å; S168-I172 VanDerWaalsContact O-N 3.12Å
169	S	93.9	Very high	89.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.1	-49.7	175.1	173.8	0	0	0	0	112.2	A140 M144 G165 R167 L171 I172 Y173	A140-S169 WeakPolarHBondContact O-CB 3.46Å; A140-S169 PolarHBondContact O-OG 3.5Å; M144-S169 WeakPolarHBondContact CB-OG 3.24Å; G165-S169 WeakPolarHBondContact O-CB 3.21Å; G165-S169 PolarHBondContact O-N 3.21Å; R167-S169 VanDerWaalsContact C-N 3.28Å; R167-S169 PolarHBondContact O-N 3.33Å; S169-L171 VanDerWaalsContact C-N 3.32Å; S169-L171 PolarHBondContact O-N 3.09Å; S169-I172 PolarHBondContact O-N 3.35Å; S169-I172 VanDerWaalsContact O-N 3.11Å; S169-Y173 WeakPolarHBondContact O-CD2 3.35Å; S169-Y173 PolarHBondContact O-N 3.24Å
170	Y	91.4	Very high	89.4	Confident	10 Å²	10	44.5 Å²	44.5	4%	0.039	23%	0.234	C	C	.	.	H	α-helix	trans	-57.7	-42.6	179.1	178.4	-116.9	0	0	0	112.9	M166 R167 I172 Y173 K174 F207 F227	M166-Y170 WeakPolarHBondContact O-CB 3.4Å; M166-Y170 PolarHBondContact O-N 3.34Å; R167-Y170 PolarHBondContact O-N 3.05Å; Y170-I172 VanDerWaalsContact C-N 3.35Å; Y170-I172 PolarHBondContact O-N 3.42Å; Y170-Y173 PolarHBondContact O-N 3.03Å; Y170-K174 HydrophobicContact CE1-CG 4.2Å; Y170-K174 HydrophobicContact CE2-CG 4.19Å; Y170-K174 PolarHBondContact O-N 2.92Å; Y170-K174 WeakPolarHBondContact OH-CE 3.45Å; Y170-F207 HydrophobicContact CD2-CB 3.64Å; Y170-F207 AromaticContact CD2-CD1 3.92Å; Y170-F207 HydrophobicContact CD2-CD1 3.92Å; Y170-F207 AromaticContact CD2-CD2 3.91Å; Y170-F207 HydrophobicContact CD2-CD2 3.91Å; Y170-F207 AromaticContact CD2-CG 3.56Å; Y170-F207 HydrophobicContact CD2-CG 3.56Å; Y170-F207 HydrophobicContact CE2-CB 3.9Å; Y170-F207 HydrophobicContact CE2-CG 4.33Å; Y170-F207 HydrophobicContact CG-CD1 4.29Å; Y170-F207 HydrophobicContact CG-CG 4.34Å; Y170-F227 AromaticContact CD1-CD1 3.29Å; Y170-F227 HydrophobicContact CD1-CD1 3.29Å; Y170-F227 AromaticContact CD1-CE1 3.75Å; Y170-F227 HydrophobicContact CD1-CE1 3.75Å; Y170-F227 HydrophobicContact CD1-CG 4.23Å; Y170-F227 AromaticContact CE1-CD1 3.82Å; Y170-F227 HydrophobicContact CE1-CD1 3.82Å; Y170-F227 HydrophobicContact CE1-CG 4.45Å; Y170-F227 AromaticContact CG-CD1 3.85Å; Y170-F227 HydrophobicContact CG-CD1 3.85Å; Y170-F227 HydrophobicContact CG-CE1 4.04Å
171	L	90.6	Very high	89.4	Confident	83 Å²	83	45.3 Å²	45.3	44%	0.435	24%	0.239	S	C	.	.	H	α-helix	trans	-64.4	-38.9	177.4	-68.3	175.4	0	0	0	112.1	R167 S168 S169 K174 N175	R167-L171 HydrophobicContact CG-CD1 4.17Å; R167-L171 WeakPolarHBondContact O-CG 3.4Å; R167-L171 PolarHBondContact O-N 3.17Å; S168-L171 PolarHBondContact O-N 2.87Å; S169-L171 VanDerWaalsContact C-N 3.32Å; S169-L171 PolarHBondContact O-N 3.09Å; L171-K174 PolarHBondContact O-N 3.25Å; L171-N175 VanDerWaalsContact O-CG 3.3Å; L171-N175 PolarHBondContact O-N 3.46Å; L171-N175 PolarHBondContact O-OD1 2.79Å
172	I	93.9	Very high	89.2	Confident	18 Å²	18	43.8 Å²	43.8	9%	0.092	24%	0.24	C	C	.	.	H	α-helix	trans	-66.6	-42.5	175.9	-61.5	164.4	0	0	0	110.3	E136 Y139 A140 L143 S168 S169 Y170 K174 N175 C176	E136-I172 HydrophobicContact CB-CG2 4.18Å; E136-I172 WeakPolarHBondContact O-CG2 3.26Å; E136-I172 WeakPolarHBondContact OE2-CG2 3.39Å; Y139-I172 HydrophobicContact CD1-CD1 3.78Å; Y139-I172 HydrophobicContact CE1-CD1 3.99Å; A140-I172 HydrophobicContact CB-CB 3.87Å; A140-I172 HydrophobicContact CB-CG2 3.7Å; L143-I172 HydrophobicContact CD2-CD1 4.49Å; S168-I172 VanDerWaalsContact O-CG1 3.27Å; S168-I172 WeakPolarHBondContact O-CG1 3.43Å; S168-I172 PolarHBondContact O-N 3.44Å; S168-I172 VanDerWaalsContact O-N 3.12Å; S169-I172 PolarHBondContact O-N 3.35Å; S169-I172 VanDerWaalsContact O-N 3.11Å; Y170-I172 VanDerWaalsContact C-N 3.35Å; Y170-I172 PolarHBondContact O-N 3.42Å; I172-K174 VanDerWaalsContact C-N 3.31Å; I172-K174 PolarHBondContact O-N 3.4Å; I172-N175 WeakPolarHBondContact O-CB 3.49Å; I172-N175 PolarHBondContact O-N 3.33Å; I172-N175 VanDerWaalsContact O-N 3.14Å; I172-C176 PolarHBondContact O-N 2.8Å; I172-C176 PolarHBondContact O-SG 2.69Å
173	Y	94.4	Very high	88.8	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.5	-40.5	173.4	-84.8	-68.2	0	0	0	112.5	L137 A140 E141 S169 Y170 N175 C176 Q177 F207	L137-Y173 HydrophobicContact CD1-CD1 4.05Å; L137-Y173 HydrophobicContact CD1-CE1 3.46Å; L137-Y173 VanDerWaalsContact CD1-CE1 3.46Å; A140-Y173 HydrophobicContact CB-CD1 4.49Å; A140-Y173 HydrophobicContact CB-CD2 3.77Å; A140-Y173 HydrophobicContact CB-CE1 4.41Å; A140-Y173 HydrophobicContact CB-CE2 3.68Å; A140-Y173 HydrophobicContact CB-CG 4.19Å; E141-Y173 VanDerWaalsContact CA-OH 3.25Å; E141-Y173 WeakPolarHBondContact CA-OH 3.23Å; E141-Y173 VanDerWaalsContact CB-OH 3.24Å; E141-Y173 WeakPolarHBondContact CB-OH 3.42Å; S169-Y173 WeakPolarHBondContact O-CD2 3.35Å; S169-Y173 PolarHBondContact O-N 3.24Å; Y170-Y173 PolarHBondContact O-N 3.03Å; Y173-N175 VanDerWaalsContact C-N 3.32Å; Y173-N175 PolarHBondContact O-N 3.18Å; Y173-C176 PolarHBondContact O-N 3.23Å; Y173-Q177 PolarHBondContact O-N 3.49Å; Y173-F207 HydrophobicContact CD2-CD2 4.06Å; Y173-F207 AromaticContact CD2-CE2 3.57Å; Y173-F207 HydrophobicContact CD2-CE2 3.57Å; Y173-F207 HydrophobicContact CE2-CD2 4.48Å; Y173-F207 AromaticContact CE2-CE2 3.83Å; Y173-F207 HydrophobicContact CE2-CE2 3.83Å
174	K	91.1	Very high	88.1	Confident	70 Å²	70	50.5 Å²	50.5	30%	0.304	26%	0.263	S	S	.	.	H	α-helix	trans	-61.9	-39.5	174.5	-80.7	-65.6	-168.6	-177.3	0	112.3	Y170 L171 I172 Q177 A178 I204	Y170-K174 HydrophobicContact CE1-CG 4.2Å; Y170-K174 HydrophobicContact CE2-CG 4.19Å; Y170-K174 PolarHBondContact O-N 2.92Å; Y170-K174 WeakPolarHBondContact OH-CE 3.45Å; L171-K174 PolarHBondContact O-N 3.25Å; I172-K174 VanDerWaalsContact C-N 3.31Å; I172-K174 PolarHBondContact O-N 3.4Å; K174-Q177 PolarHBondContact O-N 3.15Å; K174-A178 PolarHBondContact O-N 3.42Å; K174-I204 HydrophobicContact CD-CD1 3.96Å; K174-I204 HydrophobicContact CG-CD1 4.23Å
175	N	90.1	Very high	87.3	Confident	84 Å²	84	51.1 Å²	51.1	45%	0.449	27%	0.269	S	S	.	.	H	α-helix	trans	-65.2	-42.4	173.1	-65.6	-14.7	0	0	0	111.3	L171 I172 Y173 Q177 A178 M179	L171-N175 VanDerWaalsContact O-CG 3.3Å; L171-N175 PolarHBondContact O-N 3.46Å; L171-N175 PolarHBondContact O-OD1 2.79Å; I172-N175 WeakPolarHBondContact O-CB 3.49Å; I172-N175 PolarHBondContact O-N 3.33Å; I172-N175 VanDerWaalsContact O-N 3.14Å; Y173-N175 VanDerWaalsContact C-N 3.32Å; Y173-N175 PolarHBondContact O-N 3.18Å; N175-Q177 VanDerWaalsContact C-N 3.31Å; N175-Q177 PolarHBondContact O-N 3.24Å; N175-A178 WeakPolarHBondContact O-CB 3.44Å; N175-A178 PolarHBondContact O-N 3.15Å; N175-M179 HydrophobicContact CB-CE 4.14Å; N175-M179 WeakPolarHBondContact O-CG 3.47Å; N175-M179 PolarHBondContact O-N 3.22Å
176	C	91.9	Very high	85.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.9	-37.2	176.1	-61.6	0	0	0	0	112.1	I172 Y173 M179 E180 F196 V200	I172-C176 PolarHBondContact O-N 2.8Å; I172-C176 PolarHBondContact O-SG 2.69Å; Y173-C176 PolarHBondContact O-N 3.23Å; C176-M179 WeakPolarHBondContact O-CB 3.47Å; C176-M179 PolarHBondContact O-N 3.3Å; C176-E180 PolarHBondContact O-N 3.17Å; C176-F196 HydrophobicContact CB-CE2 4.16Å; C176-F196 HydrophobicContact CB-CZ 3.74Å; C176-V200 HydrophobicContact CB-CG2 3.65Å
177	Q	90.9	Very high	84.7	Confident	23 Å²	23	55 Å²	55	11%	0.107	30%	0.298	C	S	.	.	H	α-helix	trans	-65.8	-40.4	172.6	179	169.8	64.3	0	0	112.1	Y173 K174 N175 M179 E180 N181 V200 I204 Q237	Y173-Q177 PolarHBondContact O-N 3.49Å; K174-Q177 PolarHBondContact O-N 3.15Å; N175-Q177 VanDerWaalsContact C-N 3.31Å; N175-Q177 PolarHBondContact O-N 3.24Å; Q177-M179 VanDerWaalsContact C-N 3.33Å; Q177-E180 PolarHBondContact O-N 3.41Å; Q177-N181 PolarHBondContact O-N 2.82Å; Q177-N181 PolarHBondContact O-ND2 2.99Å; Q177-V200 HydrophobicContact CB-CG1 3.74Å; Q177-V200 HydrophobicContact CG-CG1 4.39Å; Q177-I204 HydrophobicContact CB-CD1 4.34Å; Q177-I204 HydrophobicContact CB-CG1 4.18Å; Q177-Q237 VanDerWaalsContact NE2-OE1 3.16Å
178	A	88.7	Confident	83.6	Confident	35 Å²	35	53.4 Å²	53.4	29%	0.289	29%	0.294	S	S	.	.	H	α-helix	trans	-64.3	-38.4	174.3	0	0	0	0	0	111.9	F125 K174 N175 N181	F125-A178 HydrophobicContact CE2-CB 3.85Å; F125-A178 HydrophobicContact CZ-CB 3.65Å; K174-A178 PolarHBondContact O-N 3.42Å; N175-A178 WeakPolarHBondContact O-CB 3.44Å; N175-A178 PolarHBondContact O-N 3.15Å; A178-N181 PolarHBondContact O-N 3.43Å
179	M	86.3	Confident	82.2	Confident	13 Å²	13	58.6 Å²	58.6	6%	0.064	31%	0.311	C	S	.	.	H	α-helix	trans	-60	-47.9	171.6	-66.1	167.9	-152	0	0	111	F125 L128 M133 N175 C176 Q177 N181 V182 I183 F196	F125-M179 HydrophobicContact CD1-CB 4.42Å; F125-M179 HydrophobicContact CD1-CE 4.15Å; F125-M179 HydrophobicContact CD1-CG 3.3Å; F125-M179 HydrophobicContact CD1-SD 4.42Å; F125-M179 HydrophobicContact CE1-CE 3.89Å; F125-M179 HydrophobicContact CE1-CG 3.46Å; F125-M179 VanDerWaalsContact CE1-CG 3.46Å; F125-M179 HydrophobicContact CG-CG 4Å; F125-M179 HydrophobicContact CZ-CG 4.26Å; L128-M179 HydrophobicContact CD1-CE 3.8Å; L128-M179 HydrophobicContact CD1-CG 4.48Å; L128-M179 HydrophobicContact CD1-SD 3.8Å; M133-M179 HydrophobicContact CE-CB 4.47Å; M133-M179 HydrophobicContact CG-SD 4.23Å; N175-M179 HydrophobicContact CB-CE 4.14Å; N175-M179 WeakPolarHBondContact O-CG 3.47Å; N175-M179 PolarHBondContact O-N 3.22Å; C176-M179 WeakPolarHBondContact O-CB 3.47Å; C176-M179 PolarHBondContact O-N 3.3Å; Q177-M179 VanDerWaalsContact C-N 3.33Å; M179-N181 VanDerWaalsContact C-N 3.27Å; M179-N181 PolarHBondContact O-N 2.93Å; M179-V182 WeakPolarHBondContact O-CG2 3.28Å; M179-V182 PolarHBondContact O-N 3.28Å; M179-V182 VanDerWaalsContact O-N 3.12Å; M179-I183 WeakPolarHBondContact O-CG1 3.4Å; M179-I183 PolarHBondContact O-N 2.87Å; M179-F196 HydrophobicContact CB-CZ 4.42Å; M179-F196 HydrophobicContact SD-CZ 4.41Å
180	E	85.3	Confident	81	Confident	32 Å²	32	64 Å²	64	15%	0.15	33%	0.332	C	S	.	.	H	α-helix	trans	-58.1	-39.2	-178.4	-169.4	-86.3	171	0	0	112.9	C176 Q177 V182 F196 R197	C176-E180 PolarHBondContact O-N 3.17Å; Q177-E180 PolarHBondContact O-N 3.41Å; E180-V182 VanDerWaalsContact C-N 3.28Å; E180-V182 PolarHBondContact O-N 3.35Å; E180-F196 HydrophobicContact CB-CE1 4.17Å; E180-R197 HydrophobicContact CG-CB 4.35Å; E180-R197 HydrophobicContact CG-CG 4.09Å; E180-R197 VanDerWaalsContact OE1-CD 3.24Å; E180-R197 WeakPolarHBondContact OE1-CD 3.4Å
181	N	83.1	Confident	80.3	Confident	115 Å²	115	69 Å²	69	62%	0.615	36%	0.359	S	S	*	.	H	α-helix	trans	-67.8	-22.3	179.4	-72.6	-45.5	0	0	0	114.6	Q177 A178 M179	Q177-N181 PolarHBondContact O-N 2.82Å; Q177-N181 PolarHBondContact O-ND2 2.99Å; A178-N181 PolarHBondContact O-N 3.43Å; M179-N181 VanDerWaalsContact C-N 3.27Å; M179-N181 PolarHBondContact O-N 2.93Å
182	V	81.9	Confident	80.2	Confident	89 Å²	89	65.6 Å²	65.6	54%	0.539	34%	0.342	S	S	.	.	H	α-helix	trans	-102.7	-6.7	-176.2	-59.7	0	0	0	0	113.7	F125 M179 E180 E184	F125-V182 HydrophobicContact CB-CG2 4.15Å; F125-V182 HydrophobicContact CD2-CG2 3.92Å; F125-V182 HydrophobicContact CG-CG2 4.32Å; M179-V182 WeakPolarHBondContact O-CG2 3.28Å; M179-V182 PolarHBondContact O-N 3.28Å; M179-V182 VanDerWaalsContact O-N 3.12Å; E180-V182 VanDerWaalsContact C-N 3.28Å; E180-V182 PolarHBondContact O-N 3.35Å; V182-E184 PolarHBondContact O-N 3.41Å
183	I	78.8	Confident	80	Confident	21 Å²	21	65.2 Å²	65.2	11%	0.108	34%	0.34	C	S	.	.	S	Bend	trans	-65.5	133.2	177.6	-70.2	161.5	0	0	0	109.8	M133 M179 E187 K188	M133-I183 HydrophobicContact CE-CD1 3.53Å; M133-I183 HydrophobicContact CE-CG1 4.46Å; M179-I183 WeakPolarHBondContact O-CG1 3.4Å; M179-I183 PolarHBondContact O-N 2.87Å; I183-E187 HydrophobicContact CG2-CB 3.7Å; I183-K188 HydrophobicContact CG2-CG 3.9Å; I183-K188 WeakPolarHBondContact O-CE 3.21Å; I183-K188 PolarHBondContact O-NZ 3.4Å
184	E	72.4	Confident	79.9	Confident	150 Å²	150	67.3 Å²	67.3	70%	0.701	35%	0.35	S	S	*	.			trans	-65.7	147.3	177.6	-63.8	-172.1	170.6	0	0	111.6	V182 G186 E187 K188	V182-E184 PolarHBondContact O-N 3.41Å; E184-G186 PolarHBondContact O-N 2.88Å; E184-G186 VanDerWaalsContact O-N 3.13Å; E184-E187 PolarHBondContact O-N 3.27Å; E184-K188 PolarHBondContact O-N 2.89Å
185	D	69.7	Low	80.1	Confident	121 Å²	121	65.5 Å²	65.5	65%	0.647	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-29.7	-173.8	-68.9	-25.5	0	0	0	113.6	K188	D185-K188 WeakPolarHBondContact O-CB 3.44Å; D185-K188 PolarHBondContact O-N 3.24Å; D185-K188 IonicContact OD1-NZ 3.95Å; D185-K188 PolarHBondContact OD1-NZ 3.42Å
186	G	61.7	Low	80.3	Confident	54 Å²	54	61.5 Å²	61.5	56%	0.557	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-25.8	175.3	0	0	0	0	0	114.5	E184	E184-G186 PolarHBondContact O-N 2.88Å; E184-G186 VanDerWaalsContact O-N 3.13Å
187	E	63.2	Low	80.4	Confident	77 Å²	77	65.6 Å²	65.6	36%	0.36	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-20.7	174.9	-65.5	-155.7	133	0	0	112.2	I183 E184 E189 R190	I183-E187 HydrophobicContact CG2-CB 3.7Å; E184-E187 PolarHBondContact O-N 3.27Å; E187-E189 PolarHBondContact O-N 3.49Å; E187-R190 PolarHBondContact O-N 3.47Å; E187-R190 IonicContact OE1-CZ 3.93Å; E187-R190 IonicContact OE1-NH1 2.75Å; E187-R190 PolarHBondContact OE1-NH1 3Å; E187-R190 IonicContact OE1-NH2 3.69Å; E187-R190 PolarHBondContact OE1-NH2 3.2Å
188	K	64.5	Low	80.7	Confident	67 Å²	67	64.5 Å²	64.5	29%	0.291	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-16.3	173.1	-61.9	179.5	-174	149.9	0	113.3	I183 E184 D185 R190	I183-K188 HydrophobicContact CG2-CG 3.9Å; I183-K188 WeakPolarHBondContact O-CE 3.21Å; I183-K188 PolarHBondContact O-NZ 3.4Å; E184-K188 PolarHBondContact O-N 2.89Å; D185-K188 WeakPolarHBondContact O-CB 3.44Å; D185-K188 PolarHBondContact O-N 3.24Å; D185-K188 IonicContact OD1-NZ 3.95Å; D185-K188 PolarHBondContact OD1-NZ 3.42Å; K188-R190 VanDerWaalsContact C-N 3.33Å
189	E	61.7	Low	81.1	Confident	168 Å²	168	62.9 Å²	62.9	79%	0.785	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-10	177.1	-62.1	-171.1	164	0	0	113.5	E187	E187-E189 PolarHBondContact O-N 3.49Å
190	R	70.4	Confident	81.6	Confident	115 Å²	115	62.3 Å²	62.3	43%	0.434	32%	0.315	S	S	.	.	S	Bend	trans	-70.7	141.8	178.2	-66.5	-177.9	-175.2	157	15.3	112	E130 E187 K188 T192 H193	E130-R190 WeakPolarHBondContact OE1-CD 3.37Å; E130-R190 IonicContact OE1-CZ 2.73Å; E130-R190 IonicContact OE1-NE 3.1Å; E130-R190 IonicContact OE1-NH1 3.36Å; E130-R190 PolarHBondContact OE1-NH1 3.48Å; E187-R190 PolarHBondContact O-N 3.47Å; E187-R190 IonicContact OE1-CZ 3.93Å; E187-R190 IonicContact OE1-NH1 2.75Å; E187-R190 PolarHBondContact OE1-NH1 3Å; E187-R190 IonicContact OE1-NH2 3.69Å; E187-R190 PolarHBondContact OE1-NH2 3.2Å; K188-R190 VanDerWaalsContact C-N 3.33Å; R190-T192 VanDerWaalsContact C-N 3.26Å; R190-T192 PolarHBondContact O-N 2.67Å; R190-H193 PolarHBondContact O-N 3.31Å
191	N	76	Confident	82.2	Confident	114 Å²	114	61 Å²	61	61%	0.61	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-31.9	-178.8	-72.9	-16.9	0	0	0	113.5	E33 I194 H195	E33-N191 PolarHBondContact OE1-ND2 3Å; N191-I194 VanDerWaalsContact O-CG2 3.22Å; N191-I194 WeakPolarHBondContact O-CG2 3.45Å; N191-H195 PolarHBondContact O-CD2 3.31Å
192	T	87.8	Confident	82.8	Confident	12 Å²	12	55.9 Å²	55.9	7%	0.074	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-33.7	-179.3	50.2	0	0	0	0	112.3	L32 E33 L36 E130 H134 R190 I194 H195 F196	L32-T192 HydrophobicContact CD2-CG2 4.1Å; L32-T192 HydrophobicContact CG-CG2 4.18Å; E33-T192 HydrophobicContact CB-CG2 4.42Å; L36-T192 HydrophobicContact CD1-CG2 4.06Å; E130-T192 PolarHBondContact OE2-OG1 3.09Å; H134-T192 PolarHBondContact CE1-O 2.7Å; H134-T192 VanDerWaalsContact CE1-O 3.29Å; H134-T192 PolarHBondContact NE2-O 2.84Å; R190-T192 VanDerWaalsContact C-N 3.26Å; R190-T192 PolarHBondContact O-N 2.67Å; T192-I194 VanDerWaalsContact C-N 3.31Å; T192-I194 PolarHBondContact O-N 3.15Å; T192-H195 WeakPolarHBondContact O-CB 3.49Å; T192-H195 PolarHBondContact O-N 3.48Å; T192-F196 PolarHBondContact O-N 3.42Å
193	H	90.1	Very high	83.5	Confident	10 Å²	10	51.6 Å²	51.6	5%	0.046	26%	0.256	C	S	.	.	H	α-helix	trans	-61	-35.9	-175.7	-180	71.8	0	0	0	112.9	R190 H195 F196 R197	R190-H193 PolarHBondContact O-N 3.31Å; H193-H195 PolarHBondContact O-N 3.18Å; H193-F196 WeakPolarHBondContact O-CB 3.25Å; H193-F196 PolarHBondContact O-N 2.95Å; H193-F196 VanDerWaalsContact O-N 3.09Å; H193-R197 PolarHBondContact O-N 3.09Å
194	I	92.2	Very high	84.4	Confident	44 Å²	44	50.6 Å²	50.6	23%	0.226	25%	0.251	C	S	.	.	H	α-helix	trans	-58	-33.4	175.8	-161.3	176.1	0	0	0	111.9	N191 T192 G198 N245 S246	N191-I194 VanDerWaalsContact O-CG2 3.22Å; N191-I194 WeakPolarHBondContact O-CG2 3.45Å; T192-I194 VanDerWaalsContact C-N 3.31Å; T192-I194 PolarHBondContact O-N 3.15Å; I194-G198 PolarHBondContact O-N 2.9Å; I194-N245 HydrophobicContact CD1-CB 3.99Å; I194-S246 WeakPolarHBondContact O-CB 3.5Å
195	H	94.9	Very high	85.5	Confident	31 Å²	31	43.5 Å²	43.5	14%	0.144	22%	0.218	C	C	.	.	H	α-helix	trans	-75.4	-34.1	178.8	-63.9	-89.6	0	0	0	112.4	L36 N191 T192 H193 G199 L247	L36-H195 HydrophobicContact CD1-CB 4.14Å; L36-H195 HydrophobicContact CD2-CB 3.78Å; N191-H195 PolarHBondContact O-CD2 3.31Å; T192-H195 WeakPolarHBondContact O-CB 3.49Å; T192-H195 PolarHBondContact O-N 3.48Å; H193-H195 PolarHBondContact O-N 3.18Å; H195-G199 PolarHBondContact O-N 2.71Å; H195-L247 PolarHBondContact ND1-N 3.09Å; H195-L247 VanDerWaalsContact ND1-N 3.11Å
196	F	95.3	Very high	86.8	Confident	1 Å²	1	38 Å²	38	0%	0.004	19%	0.189	C	C	.	.	H	α-helix	trans	-66.3	-57.6	172.1	-178.7	-105	0	0	0	110.8	M133 L137 C176 M179 E180 T192 H193 G198 G199 V200	M133-F196 HydrophobicContact CB-CD2 4.19Å; M133-F196 HydrophobicContact CB-CE2 3.85Å; M133-F196 HydrophobicContact CB-CZ 4.28Å; M133-F196 HydrophobicContact CE-CD1 3.78Å; M133-F196 HydrophobicContact CE-CD2 4.43Å; M133-F196 HydrophobicContact CE-CE1 3.47Å; M133-F196 VanDerWaalsContact CE-CE1 3.47Å; M133-F196 HydrophobicContact CE-CE2 4.19Å; M133-F196 HydrophobicContact CE-CG 4.24Å; M133-F196 HydrophobicContact CE-CZ 3.7Å; M133-F196 WeakPolarHBondContact O-CE2 3.3Å; L137-F196 HydrophobicContact CB-CD2 4.12Å; L137-F196 HydrophobicContact CB-CE2 4.02Å; L137-F196 HydrophobicContact CD2-CD2 3.8Å; L137-F196 HydrophobicContact CD2-CE2 4.4Å; L137-F196 HydrophobicContact CD2-CG 4.46Å; L137-F196 WeakPolarHBondContact CD2-O 3.45Å; C176-F196 HydrophobicContact CB-CE2 4.16Å; C176-F196 HydrophobicContact CB-CZ 3.74Å; M179-F196 HydrophobicContact CB-CZ 4.42Å; M179-F196 HydrophobicContact SD-CZ 4.41Å; E180-F196 HydrophobicContact CB-CE1 4.17Å; T192-F196 PolarHBondContact O-N 3.42Å; H193-F196 WeakPolarHBondContact O-CB 3.25Å; H193-F196 PolarHBondContact O-N 2.95Å; H193-F196 VanDerWaalsContact O-N 3.09Å; F196-G198 VanDerWaalsContact C-N 3.32Å; F196-G198 PolarHBondContact O-N 2.99Å; F196-G199 WeakPolarHBondContact O-CA 3.44Å; F196-G199 PolarHBondContact O-N 3.46Å; F196-V200 HydrophobicContact CD1-CG2 4.19Å; F196-V200 HydrophobicContact CE1-CG2 3.85Å; F196-V200 HydrophobicContact CE2-CG2 4.25Å; F196-V200 HydrophobicContact CZ-CG2 3.89Å; F196-V200 WeakPolarHBondContact O-CG2 3.43Å; F196-V200 PolarHBondContact O-N 3.29Å
197	R	94.6	Very high	88.3	Confident	86 Å²	86	35.8 Å²	35.8	33%	0.325	16%	0.164	S	C	.	.	H	α-helix	trans	-56.3	-45.7	179.8	-175.1	177.9	69.4	-164.3	-1.3	111.8	E180 H193 G199 V200 N201	E180-R197 HydrophobicContact CG-CB 4.35Å; E180-R197 HydrophobicContact CG-CG 4.09Å; E180-R197 VanDerWaalsContact OE1-CD 3.24Å; E180-R197 WeakPolarHBondContact OE1-CD 3.4Å; H193-R197 PolarHBondContact O-N 3.09Å; R197-G199 PolarHBondContact O-N 2.66Å; R197-V200 PolarHBondContact O-N 3.16Å; R197-N201 WeakPolarHBondContact O-CB 3.21Å; R197-N201 PolarHBondContact O-N 3.47Å
198	G	95.7	Very high	89.7	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.1	-36.4	176.5	0	0	0	0	0	113.1	I194 F196 M202	I194-G198 PolarHBondContact O-N 2.9Å; F196-G198 VanDerWaalsContact C-N 3.32Å; F196-G198 PolarHBondContact O-N 2.99Å; G198-M202 WeakPolarHBondContact O-CB 3.46Å; G198-M202 PolarHBondContact O-N 2.84Å
199	G	96.8	Very high	91	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-77.6	-34.7	175.7	0	0	0	0	0	115.3	H195 F196 R197 M202 G203	H195-G199 PolarHBondContact O-N 2.71Å; F196-G199 WeakPolarHBondContact O-CA 3.44Å; F196-G199 PolarHBondContact O-N 3.46Å; R197-G199 PolarHBondContact O-N 2.66Å; G199-M202 PolarHBondContact O-N 3.47Å; G199-G203 PolarHBondContact O-N 3.18Å
200	V	96.9	Very high	92.3	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-59.8	-50	170.5	173.1	0	0	0	0	109.9	L137 C176 Q177 F196 R197 M202 G203 I204	L137-V200 HydrophobicContact CD1-CG2 4.4Å; C176-V200 HydrophobicContact CB-CG2 3.65Å; Q177-V200 HydrophobicContact CB-CG1 3.74Å; Q177-V200 HydrophobicContact CG-CG1 4.39Å; F196-V200 HydrophobicContact CD1-CG2 4.19Å; F196-V200 HydrophobicContact CE1-CG2 3.85Å; F196-V200 HydrophobicContact CE2-CG2 4.25Å; F196-V200 HydrophobicContact CZ-CG2 3.89Å; F196-V200 WeakPolarHBondContact O-CG2 3.43Å; F196-V200 PolarHBondContact O-N 3.29Å; R197-V200 PolarHBondContact O-N 3.16Å; V200-M202 PolarHBondContact O-N 2.91Å; V200-G203 PolarHBondContact O-N 2.94Å; V200-I204 HydrophobicContact CG1-CG1 4.17Å; V200-I204 WeakPolarHBondContact O-CB 3.46Å; V200-I204 WeakPolarHBondContact O-CG1 3.35Å; V200-I204 PolarHBondContact O-N 3.26Å
201	N	97.6	Very high	93	Very high	6 Å²	6	20.5 Å²	20.5	3%	0.032	10%	0.101	C	C	.	.	H	α-helix	trans	-58	-46.1	177.5	-78.7	3.3	0	0	0	112	R197 G205 Q237 E240	R197-N201 WeakPolarHBondContact O-CB 3.21Å; R197-N201 PolarHBondContact O-N 3.47Å; N201-G205 WeakPolarHBondContact O-CA 3.47Å; N201-G205 PolarHBondContact O-N 3.27Å; N201-Q237 WeakPolarHBondContact CB-O 3.35Å; N201-Q237 PolarHBondContact OD1-OE1 2.77Å; N201-E240 WeakPolarHBondContact ND2-CB 3.41Å
202	M	97.4	Very high	93.4	Very high	6 Å²	6	15.5 Å²	15.5	3%	0.03	8%	0.075	C	C	.	.	H	α-helix	trans	-59.5	-49.8	177	-175.1	-89.3	-70.8	0	0	112	E141 G198 G199 V200 S206 R248 L251 S252	E141-M202 HydrophobicContact CG-CE 4.33Å; E141-M202 WeakPolarHBondContact OE2-CE 3.27Å; G198-M202 WeakPolarHBondContact O-CB 3.46Å; G198-M202 PolarHBondContact O-N 2.84Å; G199-M202 PolarHBondContact O-N 3.47Å; V200-M202 PolarHBondContact O-N 2.91Å; M202-S206 VanDerWaalsContact O-CB 3.25Å; M202-S206 WeakPolarHBondContact O-CB 3.46Å; M202-S206 PolarHBondContact O-N 3.06Å; M202-S206 PolarHBondContact O-OG 3.05Å; M202-R248 HydrophobicContact CB-CB 4.35Å; M202-R248 HydrophobicContact CE-CB 4.34Å; M202-R248 HydrophobicContact CE-CG 4.08Å; M202-L251 HydrophobicContact CE-CD1 4.02Å; M202-L251 HydrophobicContact CG-CB 4.06Å; M202-L251 HydrophobicContact SD-CB 4.46Å; M202-S252 VanDerWaalsContact CB-OG 3.31Å; M202-S252 WeakPolarHBondContact CB-OG 3.47Å; M202-S252 WeakPolarHBondContact CG-OG 3.41Å
203	G	96.6	Very high	93.2	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-68.6	-53.4	-178.2	0	0	0	0	0	113.1	G199 V200 G205 S206 F207	G199-G203 PolarHBondContact O-N 3.18Å; V200-G203 PolarHBondContact O-N 2.94Å; G203-G205 VanDerWaalsContact C-N 3.3Å; G203-G205 PolarHBondContact O-N 3.14Å; G203-S206 PolarHBondContact O-N 3.34Å; G203-F207 VanDerWaalsContact O-CD2 3.3Å; G203-F207 WeakPolarHBondContact O-CD2 3.47Å; G203-F207 PolarHBondContact O-N 3.4Å
204	I	96	Very high	92.6	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59.4	-44.1	179.2	-69.1	-67	0	0	0	111	K174 Q177 V200 F207 N208 F233 Q237	K174-I204 HydrophobicContact CD-CD1 3.96Å; K174-I204 HydrophobicContact CG-CD1 4.23Å; Q177-I204 HydrophobicContact CB-CD1 4.34Å; Q177-I204 HydrophobicContact CB-CG1 4.18Å; V200-I204 HydrophobicContact CG1-CG1 4.17Å; V200-I204 WeakPolarHBondContact O-CB 3.46Å; V200-I204 WeakPolarHBondContact O-CG1 3.35Å; V200-I204 PolarHBondContact O-N 3.26Å; I204-F207 PolarHBondContact O-N 3.05Å; I204-N208 WeakPolarHBondContact O-CB 2.86Å; I204-N208 PolarHBondContact O-N 2.75Å; I204-N208 PolarHBondContact O-ND2 2.81Å; I204-F233 HydrophobicContact CG2-CD1 4.5Å; I204-F233 HydrophobicContact CG2-CE1 3.61Å; I204-F233 HydrophobicContact CG2-CZ 4.24Å; I204-Q237 HydrophobicContact CG2-CG 4.31Å
205	G	96.8	Very high	91.7	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60.6	-47	177.8	0	0	0	0	0	112.2	N201 G203 N208 L209 G234	N201-G205 WeakPolarHBondContact O-CA 3.47Å; N201-G205 PolarHBondContact O-N 3.27Å; G203-G205 VanDerWaalsContact C-N 3.3Å; G203-G205 PolarHBondContact O-N 3.14Å; G205-N208 PolarHBondContact O-N 3.06Å; G205-L209 VanDerWaalsContact O-CB 3.25Å; G205-L209 WeakPolarHBondContact O-CB 3.17Å; G205-L209 PolarHBondContact O-N 3.18Å; G205-G234 WeakPolarHBondContact CA-O 3.42Å
206	S	95.8	Very high	90.5	Very high	7 Å²	7	17 Å²	17	5%	0.049	9%	0.088	C	C	.	.	H	α-helix	trans	-60.4	-47.8	176.8	-61.7	0	0	0	0	112.6	M202 G203 L209 I210	M202-S206 VanDerWaalsContact O-CB 3.25Å; M202-S206 WeakPolarHBondContact O-CB 3.46Å; M202-S206 PolarHBondContact O-N 3.06Å; M202-S206 PolarHBondContact O-OG 3.05Å; G203-S206 PolarHBondContact O-N 3.34Å; S206-L209 PolarHBondContact O-N 2.63Å; S206-I210 WeakPolarHBondContact O-CB 3.5Å; S206-I210 VanDerWaalsContact O-CG1 3.24Å; S206-I210 WeakPolarHBondContact O-CG1 3.48Å; S206-I210 PolarHBondContact O-N 2.98Å
207	F	93.3	Very high	89.4	Confident	6 Å²	6	24.4 Å²	24.4	3%	0.026	12%	0.115	C	C	.	.	H	α-helix	trans	-60.9	-49.1	178.9	-88.4	-73.4	0	0	0	112	M144 M166 Y170 Y173 G203 I204 L209 I210 L211	M144-F207 HydrophobicContact CB-CZ 4.43Å; M144-F207 HydrophobicContact CG-CE2 4.28Å; M144-F207 HydrophobicContact CG-CZ 4Å; M144-F207 HydrophobicContact SD-CD2 4.38Å; M144-F207 HydrophobicContact SD-CE2 3.7Å; M144-F207 HydrophobicContact SD-CZ 3.96Å; M166-F207 HydrophobicContact CB-CE1 4.42Å; M166-F207 HydrophobicContact CE-CD1 4.38Å; M166-F207 HydrophobicContact CE-CE1 3.58Å; M166-F207 HydrophobicContact CE-CZ 4.09Å; M166-F207 HydrophobicContact SD-CE1 4.34Å; M166-F207 HydrophobicContact SD-CZ 4.46Å; Y170-F207 HydrophobicContact CD2-CB 3.64Å; Y170-F207 AromaticContact CD2-CD1 3.92Å; Y170-F207 HydrophobicContact CD2-CD1 3.92Å; Y170-F207 AromaticContact CD2-CD2 3.91Å; Y170-F207 HydrophobicContact CD2-CD2 3.91Å; Y170-F207 AromaticContact CD2-CG 3.56Å; Y170-F207 HydrophobicContact CD2-CG 3.56Å; Y170-F207 HydrophobicContact CE2-CB 3.9Å; Y170-F207 HydrophobicContact CE2-CG 4.33Å; Y170-F207 HydrophobicContact CG-CD1 4.29Å; Y170-F207 HydrophobicContact CG-CG 4.34Å; Y173-F207 HydrophobicContact CD2-CD2 4.06Å; Y173-F207 AromaticContact CD2-CE2 3.57Å; Y173-F207 HydrophobicContact CD2-CE2 3.57Å; Y173-F207 HydrophobicContact CE2-CD2 4.48Å; Y173-F207 AromaticContact CE2-CE2 3.83Å; Y173-F207 HydrophobicContact CE2-CE2 3.83Å; G203-F207 VanDerWaalsContact O-CD2 3.3Å; G203-F207 WeakPolarHBondContact O-CD2 3.47Å; G203-F207 PolarHBondContact O-N 3.4Å; I204-F207 PolarHBondContact O-N 3.05Å; F207-L209 VanDerWaalsContact C-N 3.34Å; F207-L209 PolarHBondContact O-N 3.18Å; F207-I210 PolarHBondContact O-N 3.37Å; F207-L211 VanDerWaalsContact O-CB 3.28Å; F207-L211 WeakPolarHBondContact O-CB 3.4Å; F207-L211 WeakPolarHBondContact O-CG 3.39Å; F207-L211 PolarHBondContact O-N 2.93Å
208	N	92.6	Very high	88.3	Confident	6 Å²	6	23.2 Å²	23.2	3%	0.032	12%	0.118	C	C	.	.	H	α-helix	trans	-62.1	-43	-179.7	-86.1	-81.6	0	0	0	111.8	I204 G205 S212 D230	I204-N208 WeakPolarHBondContact O-CB 2.86Å; I204-N208 PolarHBondContact O-N 2.75Å; I204-N208 PolarHBondContact O-ND2 2.81Å; G205-N208 PolarHBondContact O-N 3.06Å; N208-S212 WeakPolarHBondContact O-CB 3.21Å; N208-S212 PolarHBondContact O-N 3.32Å; N208-D230 WeakPolarHBondContact CB-O 3.48Å; N208-D230 PolarHBondContact OD1-N 3.09Å; N208-D230 VanDerWaalsContact OD1-N 3.11Å
209	L	92.3	Very high	87.2	Confident	4 Å²	4	24.6 Å²	24.6	2%	0.021	13%	0.125	C	C	.	.	H	α-helix	trans	-64	-50.1	178.2	-175.4	58.4	0	0	0	111.8	G205 S206 F207 L211 S212 M213 R231 L235 L238 F259	G205-L209 VanDerWaalsContact O-CB 3.25Å; G205-L209 WeakPolarHBondContact O-CB 3.17Å; G205-L209 PolarHBondContact O-N 3.18Å; S206-L209 PolarHBondContact O-N 2.63Å; F207-L209 VanDerWaalsContact C-N 3.34Å; F207-L209 PolarHBondContact O-N 3.18Å; L209-L211 PolarHBondContact O-N 2.94Å; L209-S212 PolarHBondContact O-N 2.9Å; L209-S212 PolarHBondContact O-OG 2.88Å; L209-M213 PolarHBondContact O-N 3.38Å; L209-R231 HydrophobicContact CD1-CG 4.18Å; L209-L235 HydrophobicContact CD1-CD2 3.93Å; L209-L235 HydrophobicContact CD1-CG 4.17Å; L209-L235 HydrophobicContact CD2-CD2 4.12Å; L209-L238 HydrophobicContact CB-CD1 4.38Å; L209-L238 HydrophobicContact CD2-CD1 3.57Å; L209-F259 HydrophobicContact CD1-CD1 4.4Å; L209-F259 HydrophobicContact CD1-CD2 3.79Å; L209-F259 HydrophobicContact CD1-CE1 4.29Å; L209-F259 HydrophobicContact CD1-CE2 3.67Å; L209-F259 HydrophobicContact CD1-CG 4.17Å; L209-F259 HydrophobicContact CD1-CZ 3.94Å; L209-F259 HydrophobicContact CD2-CB 3.85Å; L209-F259 HydrophobicContact CD2-CD1 4.34Å; L209-F259 HydrophobicContact CD2-CD2 3.97Å; L209-F259 HydrophobicContact CD2-CG 3.79Å; L209-F259 HydrophobicContact CG-CD2 4.07Å; L209-F259 HydrophobicContact CG-CE2 4.41Å; L209-F259 HydrophobicContact CG-CG 4.37Å
210	I	88.9	Confident	86.1	Confident	84 Å²	84	31.9 Å²	31.9	43%	0.431	15%	0.153	S	C	.	.	H	α-helix	trans	-60.7	-46.9	179.6	-69.2	168	0	0	0	111	S206 F207 S212 M213	S206-I210 WeakPolarHBondContact O-CB 3.5Å; S206-I210 VanDerWaalsContact O-CG1 3.24Å; S206-I210 WeakPolarHBondContact O-CG1 3.48Å; S206-I210 PolarHBondContact O-N 2.98Å; F207-I210 PolarHBondContact O-N 3.37Å; I210-S212 VanDerWaalsContact C-N 3.33Å; I210-S212 PolarHBondContact O-N 2.86Å; I210-M213 HydrophobicContact CG1-CE 4.33Å; I210-M213 PolarHBondContact O-N 3.38Å
211	L	85.3	Confident	84.9	Confident	13 Å²	13	36.6 Å²	36.6	7%	0.068	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-39.3	179.6	-72.3	171.6	0	0	0	111.9	F207 L209 M213 L214 M222 F227	F207-L211 VanDerWaalsContact O-CB 3.28Å; F207-L211 WeakPolarHBondContact O-CB 3.4Å; F207-L211 WeakPolarHBondContact O-CG 3.39Å; F207-L211 PolarHBondContact O-N 2.93Å; L209-L211 PolarHBondContact O-N 2.94Å; L211-M213 PolarHBondContact O-N 3.01Å; L211-M213 VanDerWaalsContact O-N 3.16Å; L211-L214 HydrophobicContact CD2-CD1 3.89Å; L211-L214 WeakPolarHBondContact O-CB 3.49Å; L211-L214 PolarHBondContact O-N 2.9Å; L211-L214 VanDerWaalsContact O-N 3.1Å; L211-M222 HydrophobicContact CD2-CB 4.36Å; L211-M222 HydrophobicContact CD2-CG 4.3Å; L211-F227 HydrophobicContact CD1-CB 4.09Å; L211-F227 HydrophobicContact CD1-CD1 4.4Å
212	S	85.4	Confident	83.7	Confident	9 Å²	9	38.5 Å²	38.5	6%	0.063	19%	0.186	C	C	.	.	H	α-helix	trans	-61.7	-24	178.8	81.2	0	0	0	0	113.8	N208 L209 I210 R231	N208-S212 WeakPolarHBondContact O-CB 3.21Å; N208-S212 PolarHBondContact O-N 3.32Å; L209-S212 PolarHBondContact O-N 2.9Å; L209-S212 PolarHBondContact O-OG 2.88Å; I210-S212 VanDerWaalsContact C-N 3.33Å; I210-S212 PolarHBondContact O-N 2.86Å; S212-R231 VanDerWaalsContact C-NH2 3.31Å; S212-R231 PolarHBondContact O-NH2 3.44Å; S212-R231 PolarHBondContact OG-NE 2.96Å; S212-R231 PolarHBondContact OG-NH2 3.31Å; S212-R231 VanDerWaalsContact OG-NH2 3.17Å
213	M	81.7	Confident	82.8	Confident	29 Å²	29	42.6 Å²	42.6	14%	0.143	21%	0.206	C	C	.	.	H	α-helix	trans	-83.2	-16.4	-179.4	-66.7	-173	-72.1	0	0	112.4	L209 I210 L211 F259 M263 F565	L209-M213 PolarHBondContact O-N 3.38Å; I210-M213 HydrophobicContact CG1-CE 4.33Å; I210-M213 PolarHBondContact O-N 3.38Å; L211-M213 PolarHBondContact O-N 3.01Å; L211-M213 VanDerWaalsContact O-N 3.16Å; M213-F259 HydrophobicContact CG-CE2 4.44Å; M213-F259 HydrophobicContact SD-CD2 3.85Å; M213-F259 HydrophobicContact SD-CE2 3.84Å; M213-M263 HydrophobicContact CE-CE 3.84Å; M213-M263 HydrophobicContact CE-CG 4.46Å; M213-M263 HydrophobicContact SD-CB 3.87Å; M213-M263 HydrophobicContact SD-CE 4.06Å; M213-M263 HydrophobicContact SD-CG 4.4Å; M213-F565 WeakPolarHBondContact O-CD1 3.5Å; M213-F565 WeakPolarHBondContact O-CE1 3.46Å
214	L	78.7	Confident	81.7	Confident	40 Å²	40	50.9 Å²	50.9	21%	0.209	24%	0.242	C	C	.	.	S	Bend	trans	-67.4	146.1	-176.9	-64.1	177.6	0	0	0	111.8	L211 V218 M222	L211-L214 HydrophobicContact CD2-CD1 3.89Å; L211-L214 WeakPolarHBondContact O-CB 3.49Å; L211-L214 PolarHBondContact O-N 2.9Å; L211-L214 VanDerWaalsContact O-N 3.1Å; L214-V218 HydrophobicContact CB-CB 4.38Å; L214-V218 HydrophobicContact CB-CG1 4.45Å; L214-V218 HydrophobicContact CD1-CG1 4.02Å; L214-V218 HydrophobicContact CD2-CG1 4.46Å; L214-M222 HydrophobicContact CD1-CG 4.24Å
215	P	72.6	Confident	80.3	Confident	22 Å²	22	53.7 Å²	53.7	14%	0.143	26%	0.256	C	S	.	.			trans	-68.7	151.3	177.8	-15.2	32.6	0	0	0	110	R217 V218 L219 F565	P215-R217 PolarHBondContact O-N 2.75Å; P215-V218 PolarHBondContact O-N 2.64Å; P215-L219 PolarHBondContact O-N 2.8Å; P215-F565 HydrophobicContact CG-CD1 3.91Å; P215-F565 HydrophobicContact CG-CD2 4Å; P215-F565 HydrophobicContact CG-CE1 3.62Å; P215-F565 HydrophobicContact CG-CE2 3.65Å; P215-F565 HydrophobicContact CG-CG 4.1Å; P215-F565 HydrophobicContact CG-CZ 3.46Å; P215-F565 VanDerWaalsContact CG-CZ 3.46Å
216	S	70.5	Confident	78.8	Confident	37 Å²	37	56.3 Å²	56.3	26%	0.259	28%	0.284	S	S	.	.	H	α-helix	trans	-55.5	-23.5	-172.4	64.1	0	0	0	0	116.3	R220	S216-R220 WeakPolarHBondContact O-CB 3.36Å; S216-R220 VanDerWaalsContact O-CG 3.28Å; S216-R220 WeakPolarHBondContact O-CG 3.32Å; S216-R220 PolarHBondContact O-N 3.28Å; S216-R220 PolarHBondContact O-NE 3.49Å
217	R	70.9	Confident	77.7	Confident	156 Å²	156	56.4 Å²	56.4	59%	0.589	28%	0.283	S	S	*	.	H	α-helix	trans	-72.8	-41.8	173.2	-67.6	-175.6	-174.8	158.8	4.3	112.1	P215	P215-R217 PolarHBondContact O-N 2.75Å
218	V	72.4	Confident	76.8	Confident	62 Å²	62	59.4 Å²	59.4	38%	0.376	31%	0.305	S	S	.	.	H	α-helix	trans	-74.5	-42.4	178.1	-175.1	0	0	0	0	109.5	L214 P215 R220 L221 M222	L214-V218 HydrophobicContact CB-CB 4.38Å; L214-V218 HydrophobicContact CB-CG1 4.45Å; L214-V218 HydrophobicContact CD1-CG1 4.02Å; L214-V218 HydrophobicContact CD2-CG1 4.46Å; P215-V218 PolarHBondContact O-N 2.64Å; V218-R220 PolarHBondContact O-N 3.49Å; V218-L221 WeakPolarHBondContact O-CB 3.49Å; V218-L221 PolarHBondContact O-N 3.23Å; V218-L221 VanDerWaalsContact O-N 3.12Å; V218-M222 WeakPolarHBondContact O-CG 3.41Å; V218-M222 PolarHBondContact O-N 3.3Å
219	L	71.9	Confident	76.3	Confident	28 Å²	28	60 Å²	60	15%	0.147	31%	0.313	C	S	.	.	H	α-helix	trans	-56.6	-47.5	177.2	-175	64.1	0	0	0	111.6	P215 L221 M222 E223	P215-L219 PolarHBondContact O-N 2.8Å; L219-L221 VanDerWaalsContact C-N 3.26Å; L219-L221 PolarHBondContact O-N 3.32Å; L219-M222 CarbonylContact O-C 3.53Å; L219-M222 WeakPolarHBondContact O-CA 3.47Å; L219-M222 WeakPolarHBondContact O-CB 3.21Å; L219-M222 PolarHBondContact O-N 3.29Å; L219-E223 HydrophobicContact CD1-CG 4.45Å; L219-E223 HydrophobicContact CG-CG 4.27Å; L219-E223 WeakPolarHBondContact O-CG 3.38Å; L219-E223 PolarHBondContact O-N 3.24Å
220	R	73.8	Confident	76.2	Confident	154 Å²	154	63.9 Å²	63.9	58%	0.581	33%	0.334	S	S	*	.	H	α-helix	trans	-58.2	-35.5	176.7	-80.2	-175	-67.5	164.8	-2.2	114	S216 V218 F224	S216-R220 WeakPolarHBondContact O-CB 3.36Å; S216-R220 VanDerWaalsContact O-CG 3.28Å; S216-R220 WeakPolarHBondContact O-CG 3.32Å; S216-R220 PolarHBondContact O-N 3.28Å; S216-R220 PolarHBondContact O-NE 3.49Å; V218-R220 PolarHBondContact O-N 3.49Å; R220-F224 WeakPolarHBondContact O-CB 3.49Å; R220-F224 PolarHBondContact O-N 3.09Å
221	L	72.8	Confident	76.2	Confident	99 Å²	99	63 Å²	63	52%	0.518	33%	0.325	S	S	.	.	H	α-helix	trans	-67.9	-40.3	175	-179.3	65.5	0	0	0	110.9	V218 L219 L225	V218-L221 WeakPolarHBondContact O-CB 3.49Å; V218-L221 PolarHBondContact O-N 3.23Å; V218-L221 VanDerWaalsContact O-N 3.12Å; L219-L221 VanDerWaalsContact C-N 3.26Å; L219-L221 PolarHBondContact O-N 3.32Å; L221-L225 WeakPolarHBondContact O-CG 3.11Å; L221-L225 PolarHBondContact O-N 2.92Å
222	M	72.4	Confident	76.5	Confident	47 Å²	47	68.1 Å²	68.1	23%	0.232	35%	0.348	C	S	.	.	H	α-helix	trans	-67.1	-42.7	175.5	-62.6	-60.1	124.4	0	0	111.1	L211 L214 V218 L219 F224 L225 G226 F227	L211-M222 HydrophobicContact CD2-CB 4.36Å; L211-M222 HydrophobicContact CD2-CG 4.3Å; L214-M222 HydrophobicContact CD1-CG 4.24Å; V218-M222 WeakPolarHBondContact O-CG 3.41Å; V218-M222 PolarHBondContact O-N 3.3Å; L219-M222 CarbonylContact O-C 3.53Å; L219-M222 WeakPolarHBondContact O-CA 3.47Å; L219-M222 WeakPolarHBondContact O-CB 3.21Å; L219-M222 PolarHBondContact O-N 3.29Å; M222-F224 VanDerWaalsContact C-N 3.34Å; M222-F224 PolarHBondContact O-N 3.45Å; M222-L225 HydrophobicContact CE-CD1 4.34Å; M222-L225 CarbonylContact O-C 3.43Å; M222-L225 WeakPolarHBondContact O-CA 3.32Å; M222-L225 WeakPolarHBondContact O-CB 3.26Å; M222-L225 PolarHBondContact O-N 2.94Å; M222-G226 PolarHBondContact O-N 3.27Å; M222-F227 CarbonylContact C-O 3.19Å; M222-F227 HydrophobicContact CB-CB 4.06Å; M222-F227 WeakPolarHBondContact O-CB 3.41Å; M222-F227 WeakPolarHBondContact O-CD2 3.38Å; M222-F227 PolarHBondContact O-N 2.92Å
223	E	77	Confident	77	Confident	92 Å²	92	71 Å²	71	43%	0.43	36%	0.36	S	S	.	.	H	α-helix	trans	-60	-43.2	176.5	-72.5	170.3	166.9	0	0	111.8	L219 L225 G226 F227	L219-E223 HydrophobicContact CD1-CG 4.45Å; L219-E223 HydrophobicContact CG-CG 4.27Å; L219-E223 WeakPolarHBondContact O-CG 3.38Å; L219-E223 PolarHBondContact O-N 3.24Å; E223-L225 PolarHBondContact O-N 3.43Å; E223-G226 WeakPolarHBondContact O-CA 3.47Å; E223-G226 PolarHBondContact O-N 3.09Å; E223-F227 WeakPolarHBondContact CA-O 3.45Å; E223-F227 WeakPolarHBondContact CG-O 3.19Å; E223-F227 PolarHBondContact N-O 2.7Å
224	F	74.9	Confident	77.6	Confident	174 Å²	174	69.6 Å²	69.6	76%	0.763	35%	0.353	S	S	*	.	H	α-helix	trans	-59.2	-35.1	173.1	176.5	-99.7	0	0	0	112.7	R220 M222 G226	R220-F224 WeakPolarHBondContact O-CB 3.49Å; R220-F224 PolarHBondContact O-N 3.09Å; M222-F224 VanDerWaalsContact C-N 3.34Å; M222-F224 PolarHBondContact O-N 3.45Å; F224-G226 PolarHBondContact O-N 2.68Å
225	L	66	Low	78.5	Confident	58 Å²	58	68 Å²	68	30%	0.304	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-0.1	175.1	-65.5	171.1	0	0	0	113.4	R167 L221 M222 E223 F227	R167-L225 PolarHBondContact NE-O 3.3Å; R167-L225 PolarHBondContact NH2-O 2.98Å; R167-L225 VanDerWaalsContact NH2-O 3.14Å; L221-L225 WeakPolarHBondContact O-CG 3.11Å; L221-L225 PolarHBondContact O-N 2.92Å; M222-L225 HydrophobicContact CE-CD1 4.34Å; M222-L225 CarbonylContact O-C 3.43Å; M222-L225 WeakPolarHBondContact O-CA 3.32Å; M222-L225 WeakPolarHBondContact O-CB 3.26Å; M222-L225 PolarHBondContact O-N 2.94Å; E223-L225 PolarHBondContact O-N 3.43Å; L225-F227 HydrophobicContact CB-CD2 3.68Å; L225-F227 HydrophobicContact CB-CE2 3.73Å
226	G	66.6	Low	79.7	Confident	56 Å²	56	69.3 Å²	69.3	58%	0.577	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.7	20.2	179.3	0	0	0	0	0	114.6	M222 E223 F224	M222-G226 PolarHBondContact O-N 3.27Å; E223-G226 WeakPolarHBondContact O-CA 3.47Å; E223-G226 PolarHBondContact O-N 3.09Å; F224-G226 PolarHBondContact O-N 2.68Å
227	F	71	Confident	81	Confident	9 Å²	9	68.4 Å²	68.4	4%	0.039	35%	0.346	C	S	.	.			trans	-119.5	117.5	-178.8	-56.5	-105.7	0	0	0	112.2	R167 Y170 L211 M222 E223 L225	R167-F227 VanDerWaalsContact CA-CE1 3.48Å; R167-F227 HydrophobicContact CB-CE1 4.05Å; R167-F227 HydrophobicContact CB-CE2 3.82Å; R167-F227 HydrophobicContact CB-CZ 3.19Å; R167-F227 HydrophobicContact CG-CE1 4.1Å; R167-F227 HydrophobicContact CG-CE2 3.53Å; R167-F227 HydrophobicContact CG-CZ 3.3Å; Y170-F227 AromaticContact CD1-CD1 3.29Å; Y170-F227 HydrophobicContact CD1-CD1 3.29Å; Y170-F227 AromaticContact CD1-CE1 3.75Å; Y170-F227 HydrophobicContact CD1-CE1 3.75Å; Y170-F227 HydrophobicContact CD1-CG 4.23Å; Y170-F227 AromaticContact CE1-CD1 3.82Å; Y170-F227 HydrophobicContact CE1-CD1 3.82Å; Y170-F227 HydrophobicContact CE1-CG 4.45Å; Y170-F227 AromaticContact CG-CD1 3.85Å; Y170-F227 HydrophobicContact CG-CD1 3.85Å; Y170-F227 HydrophobicContact CG-CE1 4.04Å; L211-F227 HydrophobicContact CD1-CB 4.09Å; L211-F227 HydrophobicContact CD1-CD1 4.4Å; M222-F227 CarbonylContact C-O 3.19Å; M222-F227 HydrophobicContact CB-CB 4.06Å; M222-F227 WeakPolarHBondContact O-CB 3.41Å; M222-F227 WeakPolarHBondContact O-CD2 3.38Å; M222-F227 PolarHBondContact O-N 2.92Å; E223-F227 WeakPolarHBondContact CA-O 3.45Å; E223-F227 WeakPolarHBondContact CG-O 3.19Å; E223-F227 PolarHBondContact N-O 2.7Å; L225-F227 HydrophobicContact CB-CD2 3.68Å; L225-F227 HydrophobicContact CB-CE2 3.73Å
228	S	75.6	Confident	82.3	Confident	68 Å²	68	61 Å²	61	48%	0.476	32%	0.318	S	S	.	.			trans	-114.1	152.6	163.5	54.8	0	0	0	0	109.5
229	G	82.6	Confident	83.5	Confident	20 Å²	20	62.3 Å²	62.3	21%	0.206	32%	0.316	C	S	.	.			trans	-116.6	126.6	173.1	0	0	0	0	0	110.3
230	D	88.2	Confident	84.7	Confident	85 Å²	85	65.4 Å²	65.4	46%	0.455	33%	0.33	S	S	.	.			trans	-109.4	115.4	171.5	-179.1	-26.1	0	0	0	109.3	N208 E232 F233 G234	N208-D230 WeakPolarHBondContact CB-O 3.48Å; N208-D230 PolarHBondContact OD1-N 3.09Å; N208-D230 VanDerWaalsContact OD1-N 3.11Å; D230-E232 PolarHBondContact OD1-N 3.47Å; D230-F233 HydrophobicContact CB-CB 3.79Å; D230-F233 VanDerWaalsContact CG-CB 3.48Å; D230-F233 PolarHBondContact OD1-N 3.15Å; D230-G234 PolarHBondContact O-N 3.49Å
231	R	89.8	Confident	85.8	Confident	64 Å²	64	58 Å²	58	24%	0.242	30%	0.302	C	S	.	.	H	α-helix	trans	-62.2	-49.1	-176.9	-180	171.1	-66.9	110.9	11.4	112.1	L209 S212 G234 L235	L209-R231 HydrophobicContact CD1-CG 4.18Å; S212-R231 VanDerWaalsContact C-NH2 3.31Å; S212-R231 PolarHBondContact O-NH2 3.44Å; S212-R231 PolarHBondContact OG-NE 2.96Å; S212-R231 PolarHBondContact OG-NH2 3.31Å; S212-R231 VanDerWaalsContact OG-NH2 3.17Å; R231-G234 PolarHBondContact O-N 3.38Å; R231-L235 HydrophobicContact CG-CD1 3.96Å; R231-L235 HydrophobicContact CG-CG 4.37Å; R231-L235 VanDerWaalsContact O-CG 3.3Å; R231-L235 WeakPolarHBondContact O-CG 3.37Å; R231-L235 PolarHBondContact O-N 3.12Å
232	E	92.3	Very high	86.9	Confident	121 Å²	121	54 Å²	54	57%	0.565	28%	0.283	S	S	*	.	H	α-helix	trans	-70.3	-41.4	-173.4	-69.4	-53	131.5	0	0	110.6	D230 G234 L235 S236	D230-E232 PolarHBondContact OD1-N 3.47Å; E232-G234 VanDerWaalsContact C-N 3.34Å; E232-G234 PolarHBondContact O-N 2.94Å; E232-L235 PolarHBondContact O-N 3.24Å; E232-S236 WeakPolarHBondContact O-CB 3.32Å; E232-S236 PolarHBondContact O-N 3.44Å
233	F	94.4	Very high	88	Confident	69 Å²	69	55.9 Å²	55.9	30%	0.303	31%	0.306	S	S	.	.	H	α-helix	trans	-60.3	-45.6	171.5	-178	-111.9	0	0	0	111.5	I204 D230 L235 S236 Q237	I204-F233 HydrophobicContact CG2-CD1 4.5Å; I204-F233 HydrophobicContact CG2-CE1 3.61Å; I204-F233 HydrophobicContact CG2-CZ 4.24Å; D230-F233 HydrophobicContact CB-CB 3.79Å; D230-F233 VanDerWaalsContact CG-CB 3.48Å; D230-F233 PolarHBondContact OD1-N 3.15Å; F233-L235 PolarHBondContact O-N 3.46Å; F233-S236 PolarHBondContact O-N 3.44Å; F233-Q237 HydrophobicContact CD1-CG 4.34Å; F233-Q237 HydrophobicContact CD2-CG 4.25Å; F233-Q237 HydrophobicContact CE1-CG 3.98Å; F233-Q237 HydrophobicContact CE2-CG 3.87Å; F233-Q237 HydrophobicContact CG-CG 4.47Å; F233-Q237 HydrophobicContact CZ-CG 3.74Å; F233-Q237 VanDerWaalsContact O-CG 3.27Å; F233-Q237 WeakPolarHBondContact O-CG 3.5Å; F233-Q237 PolarHBondContact O-N 3.08Å
234	G	95.8	Very high	88.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.4	-44.8	177.7	0	0	0	0	0	113	G205 D230 R231 E232 L238	G205-G234 WeakPolarHBondContact CA-O 3.42Å; D230-G234 PolarHBondContact O-N 3.49Å; R231-G234 PolarHBondContact O-N 3.38Å; E232-G234 VanDerWaalsContact C-N 3.34Å; E232-G234 PolarHBondContact O-N 2.94Å; G234-L238 WeakPolarHBondContact O-CG 3.26Å; G234-L238 PolarHBondContact O-N 3.39Å; G234-L238 VanDerWaalsContact O-N 3.09Å
235	L	96.4	Very high	89.4	Confident	8 Å²	8	51 Å²	51	4%	0.042	29%	0.292	C	S	.	.	H	α-helix	trans	-65.4	-42.3	175.6	-69.8	173.8	0	0	0	111.9	L209 R231 E232 F233 L238 R239 L256 F259	L209-L235 HydrophobicContact CD1-CD2 3.93Å; L209-L235 HydrophobicContact CD1-CG 4.17Å; L209-L235 HydrophobicContact CD2-CD2 4.12Å; R231-L235 HydrophobicContact CG-CD1 3.96Å; R231-L235 HydrophobicContact CG-CG 4.37Å; R231-L235 VanDerWaalsContact O-CG 3.3Å; R231-L235 WeakPolarHBondContact O-CG 3.37Å; R231-L235 PolarHBondContact O-N 3.12Å; E232-L235 PolarHBondContact O-N 3.24Å; F233-L235 PolarHBondContact O-N 3.46Å; L235-L238 PolarHBondContact O-N 3.33Å; L235-R239 WeakPolarHBondContact O-CB 3.32Å; L235-R239 WeakPolarHBondContact O-CD 3.47Å; L235-R239 WeakPolarHBondContact O-CG 3.48Å; L235-R239 PolarHBondContact O-N 3.11Å; L235-L256 HydrophobicContact CD2-CD2 3.72Å; L235-F259 HydrophobicContact CD1-CE1 4.24Å; L235-F259 HydrophobicContact CD2-CD1 3.79Å; L235-F259 HydrophobicContact CD2-CE1 3.79Å
236	S	97.6	Very high	90.7	Very high	49 Å²	49	48.7 Å²	48.7	34%	0.343	28%	0.281	S	S	.	.	H	α-helix	trans	-58.6	-49.1	176.8	-166.5	0	0	0	0	111.6	E232 F233 L238 R239 E240	E232-S236 WeakPolarHBondContact O-CB 3.32Å; E232-S236 PolarHBondContact O-N 3.44Å; F233-S236 PolarHBondContact O-N 3.44Å; S236-L238 PolarHBondContact O-N 2.97Å; S236-R239 WeakPolarHBondContact O-CB 3.48Å; S236-R239 PolarHBondContact O-N 3.31Å; S236-E240 WeakPolarHBondContact O-CG 3.41Å; S236-E240 PolarHBondContact O-N 3.22Å; S236-E240 PolarHBondContact OG-OE1 3.38Å
237	Q	97.9	Very high	92	Very high	17 Å²	17	46.9 Å²	46.9	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-63	-42.5	-179.9	-65.3	-72.6	-84.5	0	0	111.6	Q177 N201 I204 F233 R239 E240 G241	Q177-Q237 VanDerWaalsContact NE2-OE1 3.16Å; N201-Q237 WeakPolarHBondContact CB-O 3.35Å; N201-Q237 PolarHBondContact OD1-OE1 2.77Å; I204-Q237 HydrophobicContact CG2-CG 4.31Å; F233-Q237 HydrophobicContact CD1-CG 4.34Å; F233-Q237 HydrophobicContact CD2-CG 4.25Å; F233-Q237 HydrophobicContact CE1-CG 3.98Å; F233-Q237 HydrophobicContact CE2-CG 3.87Å; F233-Q237 HydrophobicContact CG-CG 4.47Å; F233-Q237 HydrophobicContact CZ-CG 3.74Å; F233-Q237 VanDerWaalsContact O-CG 3.27Å; F233-Q237 WeakPolarHBondContact O-CG 3.5Å; F233-Q237 PolarHBondContact O-N 3.08Å; Q237-R239 PolarHBondContact O-N 3.03Å; Q237-E240 PolarHBondContact NE2-OE2 3.39Å; Q237-E240 PolarHBondContact O-N 3.43Å; Q237-G241 PolarHBondContact O-N 3.34Å
238	L	98.3	Very high	93.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.4	-39.8	174.6	-73.8	168.9	0	0	0	112.4	L209 G234 L235 S236 G241 A242 S252 T255 L256	L209-L238 HydrophobicContact CB-CD1 4.38Å; L209-L238 HydrophobicContact CD2-CD1 3.57Å; G234-L238 WeakPolarHBondContact O-CG 3.26Å; G234-L238 PolarHBondContact O-N 3.39Å; G234-L238 VanDerWaalsContact O-N 3.09Å; L235-L238 PolarHBondContact O-N 3.33Å; S236-L238 PolarHBondContact O-N 2.97Å; L238-G241 PolarHBondContact O-N 3.29Å; L238-A242 VanDerWaalsContact O-CB 3.31Å; L238-A242 WeakPolarHBondContact O-CB 3.19Å; L238-A242 PolarHBondContact O-N 2.91Å; L238-S252 WeakPolarHBondContact O-CB 3.36Å; L238-T255 HydrophobicContact CD1-CG2 3.76Å; L238-T255 HydrophobicContact CD2-CG2 3.97Å; L238-L256 HydrophobicContact CB-CD1 3.97Å; L238-L256 HydrophobicContact CB-CD2 3.77Å; L238-L256 HydrophobicContact CB-CG 3.78Å; L238-L256 HydrophobicContact CD1-CD2 4.01Å; L238-L256 HydrophobicContact CD1-CG 4.29Å
239	R	98.3	Very high	94.2	Very high	91 Å²	91	43.5 Å²	43.5	34%	0.343	24%	0.235	S	C	.	.	H	α-helix	trans	-62.9	-45.8	176.7	-73.8	163.9	177.7	151.1	0.6	111.4	L235 S236 Q237 G241 A242 A243 L256 E276	L235-R239 WeakPolarHBondContact O-CB 3.32Å; L235-R239 WeakPolarHBondContact O-CD 3.47Å; L235-R239 WeakPolarHBondContact O-CG 3.48Å; L235-R239 PolarHBondContact O-N 3.11Å; S236-R239 WeakPolarHBondContact O-CB 3.48Å; S236-R239 PolarHBondContact O-N 3.31Å; Q237-R239 PolarHBondContact O-N 3.03Å; R239-G241 VanDerWaalsContact C-N 3.33Å; R239-G241 PolarHBondContact O-N 2.92Å; R239-A242 PolarHBondContact O-N 3.47Å; R239-A243 WeakPolarHBondContact O-CB 3.4Å; R239-A243 PolarHBondContact O-N 2.99Å; R239-L256 HydrophobicContact CG-CD1 4.18Å; R239-E276 IonicContact CZ-OE1 3.19Å; R239-E276 VanDerWaalsContact CZ-OE1 3.32Å; R239-E276 IonicContact CZ-OE2 3.62Å; R239-E276 IonicContact NE-OE1 2.69Å; R239-E276 PolarHBondContact NE-OE1 2.92Å; R239-E276 IonicContact NE-OE2 3.72Å; R239-E276 IonicContact NH2-OE1 2.74Å; R239-E276 PolarHBondContact NH2-OE1 3.1Å; R239-E276 VanDerWaalsContact NH2-OE1 3.08Å; R239-E276 IonicContact NH2-OE2 3.33Å; R239-E276 PolarHBondContact NH2-OE2 3.31Å
240	E	96.7	Very high	94.8	Very high	92 Å²	92	42.8 Å²	42.8	43%	0.43	23%	0.227	S	C	.	.	H	α-helix	trans	-60.7	-43.4	174.3	-72	168.7	-145.6	0	0	111.6	N201 S236 Q237 A243 S244	N201-E240 WeakPolarHBondContact ND2-CB 3.41Å; S236-E240 WeakPolarHBondContact O-CG 3.41Å; S236-E240 PolarHBondContact O-N 3.22Å; S236-E240 PolarHBondContact OG-OE1 3.38Å; Q237-E240 PolarHBondContact NE2-OE2 3.39Å; Q237-E240 PolarHBondContact O-N 3.43Å; E240-A243 PolarHBondContact O-N 3.38Å; E240-S244 PolarHBondContact O-N 3.05Å
241	G	96.6	Very high	95.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.5	-45.6	174.1	0	0	0	0	0	112.3	Q237 L238 R239 S244 S249	Q237-G241 PolarHBondContact O-N 3.34Å; L238-G241 PolarHBondContact O-N 3.29Å; R239-G241 VanDerWaalsContact C-N 3.33Å; R239-G241 PolarHBondContact O-N 2.92Å; G241-S244 WeakPolarHBondContact O-CB 3.35Å; G241-S244 PolarHBondContact O-N 3.45Å; G241-S244 PolarHBondContact O-OG 3.27Å; G241-S249 WeakPolarHBondContact O-CA 3.42Å; G241-S249 PolarHBondContact O-OG 2.97Å
242	A	97.4	Very high	95.6	Very high	13 Å²	13	38.8 Å²	38.8	11%	0.107	21%	0.209	C	C	.	.	H	α-helix	trans	-67.1	-35.6	179.6	0	0	0	0	0	113.2	L238 R239 S244 L256 L280	L238-A242 VanDerWaalsContact O-CB 3.31Å; L238-A242 WeakPolarHBondContact O-CB 3.19Å; L238-A242 PolarHBondContact O-N 2.91Å; R239-A242 PolarHBondContact O-N 3.47Å; A242-S244 VanDerWaalsContact C-N 3.28Å; A242-S244 PolarHBondContact O-N 3.41Å; A242-L256 HydrophobicContact CB-CD1 4.23Å; A242-L280 HydrophobicContact CB-CD2 4.01Å
243	A	95.1	Very high	95.9	Very high	88 Å²	88	33.1 Å²	33.1	73%	0.727	18%	0.183	S	C	*	.	H	α-helix	trans	-76.1	-13.8	177.5	0	0	0	0	0	113.5	R239 E240	R239-A243 WeakPolarHBondContact O-CB 3.4Å; R239-A243 PolarHBondContact O-N 2.99Å; E240-A243 PolarHBondContact O-N 3.38Å
244	S	90.6	Very high	96	Very high	16 Å²	16	31.1 Å²	31.1	11%	0.112	18%	0.175	C	C	.	.	S	Bend	trans	-74.9	164.6	176.5	79.5	0	0	0	0	112.2	E240 G241 A242 S246 S249	E240-S244 PolarHBondContact O-N 3.05Å; G241-S244 WeakPolarHBondContact O-CB 3.35Å; G241-S244 PolarHBondContact O-N 3.45Å; G241-S244 PolarHBondContact O-OG 3.27Å; A242-S244 VanDerWaalsContact C-N 3.28Å; A242-S244 PolarHBondContact O-N 3.41Å; S244-S246 VanDerWaalsContact C-N 3.29Å; S244-S246 WeakPolarHBondContact OG-CB 3.37Å; S244-S246 PolarHBondContact OG-N 3.03Å; S244-S246 PolarHBondContact OG-OG 2.92Å; S244-S246 VanDerWaalsContact OG-OG 3.05Å; S244-S249 VanDerWaalsContact C-OG 3.22Å; S244-S249 VanDerWaalsContact O-CB 3.27Å; S244-S249 WeakPolarHBondContact O-CB 3.46Å; S244-S249 PolarHBondContact O-OG 3.05Å; S244-S249 PolarHBondContact OG-OG 2.87Å
245	N	89.8	Confident	96.1	Very high	147 Å²	147	33 Å²	33	79%	0.786	19%	0.187	S	C	*	.			trans	-94.8	24.7	169.8	-69.4	-36.8	0	0	0	112.5	I194	I194-N245 HydrophobicContact CD1-CB 3.99Å
246	S	94.3	Very high	96.1	Very high	10 Å²	10	32.6 Å²	32.6	7%	0.07	19%	0.185	C	C	.	.	S	Bend	trans	-72.5	162.2	179.8	79.1	0	0	0	0	112.5	I194 S244 R248 S249	I194-S246 WeakPolarHBondContact O-CB 3.5Å; S244-S246 VanDerWaalsContact C-N 3.29Å; S244-S246 WeakPolarHBondContact OG-CB 3.37Å; S244-S246 PolarHBondContact OG-N 3.03Å; S244-S246 PolarHBondContact OG-OG 2.92Å; S244-S246 VanDerWaalsContact OG-OG 3.05Å; S246-R248 PolarHBondContact O-N 3.32Å; S246-R248 VanDerWaalsContact O-N 3.11Å; S246-R248 PolarHBondContact OG-N 3.23Å; S246-S249 PolarHBondContact N-OG 3.06Å; S246-S249 WeakPolarHBondContact O-CB 3.46Å; S246-S249 PolarHBondContact O-N 2.7Å; S246-S249 PolarHBondContact O-OG 3.22Å; S246-S249 PolarHBondContact OG-N 3Å; S246-S249 VanDerWaalsContact OG-N 3.12Å; S246-S249 PolarHBondContact OG-OG 3.26Å
247	L	93.9	Very high	96.1	Very high	17 Å²	17	30.3 Å²	30.3	9%	0.089	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-26.3	171.5	-173.7	67.7	0	0	0	112.3	C39 N40 L43 Y67 H195	C39-L247 HydrophobicContact CB-CD1 4.46Å; C39-L247 HydrophobicContact CB-CD2 4Å; N40-L247 HydrophobicContact CB-CD1 4.06Å; L43-L247 HydrophobicContact CB-CD1 4.23Å; L43-L247 HydrophobicContact CD2-CD1 3.88Å; Y67-L247 HydrophobicContact CD1-CD2 3.82Å; Y67-L247 HydrophobicContact CE1-CD2 3.95Å; H195-L247 PolarHBondContact ND1-N 3.09Å; H195-L247 VanDerWaalsContact ND1-N 3.11Å
248	R	95.3	Very high	96	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.008	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	0.7	-174.2	-68.7	166.5	172.6	95.1	-5.7	113.5	Y67 M70 E141 M202 S246 I250 L251 S252	Y67-R248 PolarHBondContact OH-NH1 2.82Å; M70-R248 PolarHBondContact SD-NH2 2.58Å; E141-R248 IonicContact OE1-NE 3.16Å; E141-R248 IonicContact OE2-CZ 2.71Å; E141-R248 VanDerWaalsContact OE2-CZ 3.27Å; E141-R248 IonicContact OE2-NE 2.66Å; E141-R248 PolarHBondContact OE2-NE 3.05Å; E141-R248 IonicContact OE2-NH2 3.46Å; E141-R248 PolarHBondContact OE2-NH2 2.7Å; M202-R248 HydrophobicContact CB-CB 4.35Å; M202-R248 HydrophobicContact CE-CB 4.34Å; M202-R248 HydrophobicContact CE-CG 4.08Å; S246-R248 PolarHBondContact O-N 3.32Å; S246-R248 VanDerWaalsContact O-N 3.11Å; S246-R248 PolarHBondContact OG-N 3.23Å; R248-I250 PolarHBondContact O-N 3.43Å; R248-L251 HydrophobicContact CG-CD1 4.32Å; R248-L251 WeakPolarHBondContact O-CB 3.42Å; R248-L251 PolarHBondContact O-N 3.06Å; R248-S252 PolarHBondContact O-N 3.1Å
249	S	96.8	Very high	95.8	Very high	4 Å²	4	34 Å²	34	3%	0.028	19%	0.187	C	C	.	.	H	α-helix	trans	-56.8	-41.5	179.1	-58	0	0	0	0	111.9	G241 S244 S246 L251 S252 T253	G241-S249 WeakPolarHBondContact O-CA 3.42Å; G241-S249 PolarHBondContact O-OG 2.97Å; S244-S249 VanDerWaalsContact C-OG 3.22Å; S244-S249 VanDerWaalsContact O-CB 3.27Å; S244-S249 WeakPolarHBondContact O-CB 3.46Å; S244-S249 PolarHBondContact O-OG 3.05Å; S244-S249 PolarHBondContact OG-OG 2.87Å; S246-S249 PolarHBondContact N-OG 3.06Å; S246-S249 WeakPolarHBondContact O-CB 3.46Å; S246-S249 PolarHBondContact O-N 2.7Å; S246-S249 PolarHBondContact O-OG 3.22Å; S246-S249 PolarHBondContact OG-N 3Å; S246-S249 VanDerWaalsContact OG-N 3.12Å; S246-S249 PolarHBondContact OG-OG 3.26Å; S249-L251 VanDerWaalsContact C-N 3.34Å; S249-L251 PolarHBondContact O-N 2.73Å; S249-S252 WeakPolarHBondContact O-CB 3.35Å; S249-S252 PolarHBondContact O-N 2.74Å; S249-T253 PolarHBondContact O-N 3.45Å; S249-T253 PolarHBondContact O-OG1 3.47Å
250	I	96.3	Very high	95.6	Very high	6 Å²	6	30 Å²	30	3%	0.031	17%	0.172	C	C	.	.	H	α-helix	trans	-64.7	-36.7	175.4	-177.5	57.3	0	0	0	112.1	L43 L47 R248 S252 T253 L254 Y284 M294	L43-I250 HydrophobicContact CD1-CG2 3.97Å; L43-I250 HydrophobicContact CD2-CG2 3.84Å; L43-I250 HydrophobicContact CG-CG2 4.49Å; L47-I250 HydrophobicContact CD1-CG1 4.38Å; L47-I250 HydrophobicContact CD2-CG1 4.17Å; R248-I250 PolarHBondContact O-N 3.43Å; I250-S252 VanDerWaalsContact C-N 3.34Å; I250-T253 HydrophobicContact CD1-CG2 4.48Å; I250-T253 WeakPolarHBondContact O-CB 3.3Å; I250-T253 PolarHBondContact O-N 3.3Å; I250-L254 HydrophobicContact CD1-CD1 4.32Å; I250-L254 HydrophobicContact CD1-CD2 4.29Å; I250-L254 HydrophobicContact CD1-CG 3.92Å; I250-L254 HydrophobicContact CG1-CD1 4.02Å; I250-L254 HydrophobicContact CG1-CG 4.1Å; I250-L254 WeakPolarHBondContact O-CB 3.28Å; I250-L254 WeakPolarHBondContact O-CG 3.33Å; I250-L254 PolarHBondContact O-N 3.45Å; I250-Y284 WeakPolarHBondContact CA-OH 3.41Å; I250-Y284 HydrophobicContact CB-CE1 3.86Å; I250-Y284 HydrophobicContact CD1-CD1 3.75Å; I250-Y284 HydrophobicContact CD1-CD2 4.18Å; I250-Y284 HydrophobicContact CD1-CE1 3.67Å; I250-Y284 HydrophobicContact CD1-CE2 4.1Å; I250-Y284 HydrophobicContact CD1-CG 4.01Å; I250-Y284 HydrophobicContact CG1-CE1 4.17Å; I250-Y284 PolarHBondContact N-OH 3.01Å; I250-M294 HydrophobicContact CD1-CE 4.18Å
251	L	96.1	Very high	95.6	Very high	64 Å²	64	25.6 Å²	25.6	34%	0.335	15%	0.151	S	C	.	.	H	α-helix	trans	-67.3	-38.1	177.7	-61.4	-177	0	0	0	111.1	M202 R248 S249 L254 T255	M202-L251 HydrophobicContact CE-CD1 4.02Å; M202-L251 HydrophobicContact CG-CB 4.06Å; M202-L251 HydrophobicContact SD-CB 4.46Å; R248-L251 HydrophobicContact CG-CD1 4.32Å; R248-L251 WeakPolarHBondContact O-CB 3.42Å; R248-L251 PolarHBondContact O-N 3.06Å; S249-L251 VanDerWaalsContact C-N 3.34Å; S249-L251 PolarHBondContact O-N 2.73Å; L251-L254 PolarHBondContact O-N 2.83Å; L251-T255 WeakPolarHBondContact O-CB 3.43Å; L251-T255 PolarHBondContact O-N 3.23Å; L251-T255 PolarHBondContact O-OG1 3.02Å
252	S	98.1	Very high	95.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.9	-45.5	171.2	-61.6	0	0	0	0	111.7	M202 L238 R248 S249 I250 T255 L256	M202-S252 VanDerWaalsContact CB-OG 3.31Å; M202-S252 WeakPolarHBondContact CB-OG 3.47Å; M202-S252 WeakPolarHBondContact CG-OG 3.41Å; L238-S252 WeakPolarHBondContact O-CB 3.36Å; R248-S252 PolarHBondContact O-N 3.1Å; S249-S252 WeakPolarHBondContact O-CB 3.35Å; S249-S252 PolarHBondContact O-N 2.74Å; I250-S252 VanDerWaalsContact C-N 3.34Å; S252-T255 PolarHBondContact O-N 3.37Å; S252-L256 WeakPolarHBondContact O-CG 3.47Å; S252-L256 PolarHBondContact O-N 3.44Å
253	T	98.2	Very high	95	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.012	17%	0.166	C	C	.	.	H	α-helix	trans	-58	-50.3	174.1	-66.7	0	0	0	0	111.7	S249 I250 T255 L256 L257 L280 Y284	S249-T253 PolarHBondContact O-N 3.45Å; S249-T253 PolarHBondContact O-OG1 3.47Å; I250-T253 HydrophobicContact CD1-CG2 4.48Å; I250-T253 WeakPolarHBondContact O-CB 3.3Å; I250-T253 PolarHBondContact O-N 3.3Å; T253-T255 VanDerWaalsContact C-N 3.29Å; T253-T255 PolarHBondContact O-N 3.02Å; T253-L256 PolarHBondContact O-N 2.88Å; T253-L257 HydrophobicContact CG2-CD1 3.88Å; T253-L257 HydrophobicContact CG2-CG 4.3Å; T253-L257 WeakPolarHBondContact O-CB 3.36Å; T253-L257 VanDerWaalsContact O-CG 3.29Å; T253-L257 WeakPolarHBondContact O-CG 3.49Å; T253-L257 PolarHBondContact O-N 2.76Å; T253-L280 HydrophobicContact CG2-CB 4.15Å; T253-Y284 HydrophobicContact CG2-CD2 4.06Å; T253-Y284 HydrophobicContact CG2-CE2 3.83Å; T253-Y284 WeakPolarHBondContact OG1-CE2 3.18Å
254	L	96.7	Very high	94.7	Very high	27 Å²	27	26 Å²	26	14%	0.141	14%	0.138	C	C	.	.	H	α-helix	trans	-62	-37.7	178.9	-70	178.3	0	0	0	111.5	I250 L251 L257 M258 L293 Y297	I250-L254 HydrophobicContact CD1-CD1 4.32Å; I250-L254 HydrophobicContact CD1-CD2 4.29Å; I250-L254 HydrophobicContact CD1-CG 3.92Å; I250-L254 HydrophobicContact CG1-CD1 4.02Å; I250-L254 HydrophobicContact CG1-CG 4.1Å; I250-L254 WeakPolarHBondContact O-CB 3.28Å; I250-L254 WeakPolarHBondContact O-CG 3.33Å; I250-L254 PolarHBondContact O-N 3.45Å; L251-L254 PolarHBondContact O-N 2.83Å; L254-L257 HydrophobicContact CD2-CD1 4.39Å; L254-L257 PolarHBondContact O-N 3.21Å; L254-M258 WeakPolarHBondContact O-CB 3.39Å; L254-M258 VanDerWaalsContact O-CG 3.29Å; L254-M258 WeakPolarHBondContact O-CG 2.91Å; L254-M258 PolarHBondContact O-N 2.58Å; L254-L293 HydrophobicContact CD1-CD1 4.29Å; L254-Y297 HydrophobicContact CD2-CD2 4.08Å; L254-Y297 HydrophobicContact CD2-CE2 3.38Å
255	T	96.9	Very high	94.6	Very high	39 Å²	39	25.3 Å²	25.3	24%	0.239	13%	0.133	C	C	.	.	H	α-helix	trans	-63.7	-45.5	175.6	-58.7	0	0	0	0	111.4	L238 L251 S252 T253 M258 F259	L238-T255 HydrophobicContact CD1-CG2 3.76Å; L238-T255 HydrophobicContact CD2-CG2 3.97Å; L251-T255 WeakPolarHBondContact O-CB 3.43Å; L251-T255 PolarHBondContact O-N 3.23Å; L251-T255 PolarHBondContact O-OG1 3.02Å; S252-T255 PolarHBondContact O-N 3.37Å; T253-T255 VanDerWaalsContact C-N 3.29Å; T253-T255 PolarHBondContact O-N 3.02Å; T255-M258 PolarHBondContact O-N 3.07Å; T255-F259 WeakPolarHBondContact O-CB 3.36Å; T255-F259 PolarHBondContact O-N 2.97Å
256	L	97.8	Very high	94.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.5	-42.9	174.8	-72.1	167.5	0	0	0	111.8	L235 L238 R239 A242 S252 T253 F259 H260 L280	L235-L256 HydrophobicContact CD2-CD2 3.72Å; L238-L256 HydrophobicContact CB-CD1 3.97Å; L238-L256 HydrophobicContact CB-CD2 3.77Å; L238-L256 HydrophobicContact CB-CG 3.78Å; L238-L256 HydrophobicContact CD1-CD2 4.01Å; L238-L256 HydrophobicContact CD1-CG 4.29Å; R239-L256 HydrophobicContact CG-CD1 4.18Å; A242-L256 HydrophobicContact CB-CD1 4.23Å; S252-L256 WeakPolarHBondContact O-CG 3.47Å; S252-L256 PolarHBondContact O-N 3.44Å; T253-L256 PolarHBondContact O-N 2.88Å; L256-F259 WeakPolarHBondContact O-CB 3.46Å; L256-F259 PolarHBondContact O-N 2.96Å; L256-H260 PolarHBondContact O-CD2 3.31Å; L256-H260 PolarHBondContact O-N 2.89Å; L256-L280 HydrophobicContact CB-CD1 3.6Å; L256-L280 HydrophobicContact CD1-CD1 3.78Å; L256-L280 HydrophobicContact CD1-CD2 4Å; L256-L280 HydrophobicContact CG-CD1 4.29Å
257	L	97.6	Very high	93.7	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-61.1	-45.4	175.7	-70.8	174	0	0	0	111.5	T253 L254 F259 H260 L261 A277 L281 Y297	T253-L257 HydrophobicContact CG2-CD1 3.88Å; T253-L257 HydrophobicContact CG2-CG 4.3Å; T253-L257 WeakPolarHBondContact O-CB 3.36Å; T253-L257 VanDerWaalsContact O-CG 3.29Å; T253-L257 WeakPolarHBondContact O-CG 3.49Å; T253-L257 PolarHBondContact O-N 2.76Å; L254-L257 HydrophobicContact CD2-CD1 4.39Å; L254-L257 PolarHBondContact O-N 3.21Å; L257-F259 VanDerWaalsContact C-N 3.3Å; L257-F259 PolarHBondContact O-N 3.35Å; L257-H260 PolarHBondContact O-N 3.47Å; L257-L261 HydrophobicContact CB-CD1 4.27Å; L257-L261 HydrophobicContact CD2-CD1 4.01Å; L257-L261 WeakPolarHBondContact O-CB 3.47Å; L257-L261 VanDerWaalsContact O-CG 3.25Å; L257-L261 WeakPolarHBondContact O-CG 3.23Å; L257-L261 PolarHBondContact O-N 3.38Å; L257-A277 HydrophobicContact CD2-CB 3.76Å; L257-A277 WeakPolarHBondContact CD2-O 3.44Å; L257-L281 HydrophobicContact CD1-CD1 4.08Å; L257-L281 HydrophobicContact CD2-CB 4.44Å; L257-Y297 HydrophobicContact CB-CD1 4.09Å; L257-Y297 HydrophobicContact CB-CE1 3.89Å; L257-Y297 HydrophobicContact CD1-CD1 4.3Å; L257-Y297 HydrophobicContact CD1-CD2 4Å; L257-Y297 HydrophobicContact CD1-CE2 4.37Å; L257-Y297 HydrophobicContact CD1-CG 3.98Å
258	M	95.1	Very high	93.1	Very high	76 Å²	76	21.1 Å²	21.1	37%	0.374	11%	0.112	S	C	.	.	H	α-helix	trans	-60.7	-40.4	174.9	-75	-54.4	-63.3	0	0	112	L254 T255 Y262 M263 Y297	L254-M258 WeakPolarHBondContact O-CB 3.39Å; L254-M258 VanDerWaalsContact O-CG 3.29Å; L254-M258 WeakPolarHBondContact O-CG 2.91Å; L254-M258 PolarHBondContact O-N 2.58Å; T255-M258 PolarHBondContact O-N 3.07Å; M258-Y262 HydrophobicContact CE-CD2 3.81Å; M258-Y262 HydrophobicContact CE-CG 4.07Å; M258-Y262 WeakPolarHBondContact O-CB 3.42Å; M258-Y262 PolarHBondContact O-N 3.27Å; M258-Y262 VanDerWaalsContact O-N 3.12Å; M258-Y262 HydrophobicContact SD-CD2 3.73Å; M258-Y262 HydrophobicContact SD-CE2 4.18Å; M258-M263 PolarHBondContact O-N 3.32Å; M258-Y297 WeakPolarHBondContact CG-OH 3.39Å; M258-Y297 HydrophobicContact SD-CE1 4.07Å; M258-Y297 PolarHBondContact SD-OH 2.88Å
259	F	94.1	Very high	92.1	Very high	18 Å²	18	22.8 Å²	22.8	8%	0.079	12%	0.122	C	C	.	.	I	π-helix	trans	-63	-53.5	176.1	175.4	-110	0	0	0	112.1	L209 M213 L235 T255 L256 L257 M263 S264	L209-F259 HydrophobicContact CD1-CD1 4.4Å; L209-F259 HydrophobicContact CD1-CD2 3.79Å; L209-F259 HydrophobicContact CD1-CE1 4.29Å; L209-F259 HydrophobicContact CD1-CE2 3.67Å; L209-F259 HydrophobicContact CD1-CG 4.17Å; L209-F259 HydrophobicContact CD1-CZ 3.94Å; L209-F259 HydrophobicContact CD2-CB 3.85Å; L209-F259 HydrophobicContact CD2-CD1 4.34Å; L209-F259 HydrophobicContact CD2-CD2 3.97Å; L209-F259 HydrophobicContact CD2-CG 3.79Å; L209-F259 HydrophobicContact CG-CD2 4.07Å; L209-F259 HydrophobicContact CG-CE2 4.41Å; L209-F259 HydrophobicContact CG-CG 4.37Å; M213-F259 HydrophobicContact CG-CE2 4.44Å; M213-F259 HydrophobicContact SD-CD2 3.85Å; M213-F259 HydrophobicContact SD-CE2 3.84Å; L235-F259 HydrophobicContact CD1-CE1 4.24Å; L235-F259 HydrophobicContact CD2-CD1 3.79Å; L235-F259 HydrophobicContact CD2-CE1 3.79Å; T255-F259 WeakPolarHBondContact O-CB 3.36Å; T255-F259 PolarHBondContact O-N 2.97Å; L256-F259 WeakPolarHBondContact O-CB 3.46Å; L256-F259 PolarHBondContact O-N 2.96Å; L257-F259 VanDerWaalsContact C-N 3.3Å; L257-F259 PolarHBondContact O-N 3.35Å; F259-M263 HydrophobicContact CD2-CB 4.2Å; F259-M263 PolarHBondContact O-N 3.24Å; F259-S264 WeakPolarHBondContact CE2-OG 3.39Å; F259-S264 WeakPolarHBondContact CZ-OG 3.5Å; F259-S264 WeakPolarHBondContact O-CB 3.37Å; F259-S264 PolarHBondContact O-N 2.75Å; F259-S264 PolarHBondContact O-OG 3.39Å
260	H	94.8	Very high	91.1	Very high	7 Å²	7	23 Å²	23	3%	0.032	13%	0.125	C	C	.	.	I	π-helix	trans	-71.4	-36.1	-175.4	-66	-54.7	0	0	0	113.3	L256 L257 G272 E276 A277	L256-H260 PolarHBondContact O-CD2 3.31Å; L256-H260 PolarHBondContact O-N 2.89Å; L257-H260 PolarHBondContact O-N 3.47Å; H260-G272 WeakPolarHBondContact O-CA 3.3Å; H260-E276 IonicContact CE1-OE2 2.7Å; H260-E276 IonicContact NE2-OE1 3.99Å; H260-E276 IonicContact NE2-OE2 3.55Å; H260-E276 PolarHBondContact NE2-OE2 2.9Å; H260-A277 HydrophobicContact CB-CB 4.46Å
261	L	95.6	Very high	90.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.15	C	C	.	.	I	π-helix	trans	-97	-19.3	-170.6	-55.1	176	0	0	0	114.2	L257 L274 A277 Y297 R300 I301 L304	L257-L261 HydrophobicContact CB-CD1 4.27Å; L257-L261 HydrophobicContact CD2-CD1 4.01Å; L257-L261 WeakPolarHBondContact O-CB 3.47Å; L257-L261 VanDerWaalsContact O-CG 3.25Å; L257-L261 WeakPolarHBondContact O-CG 3.23Å; L257-L261 PolarHBondContact O-N 3.38Å; L261-L274 HydrophobicContact CD2-CD2 3.63Å; L261-A277 HydrophobicContact CD1-CB 4.47Å; L261-A277 HydrophobicContact CD2-CB 3.84Å; L261-A277 HydrophobicContact CG-CB 4.24Å; L261-Y297 HydrophobicContact CD1-CD1 3.62Å; L261-Y297 HydrophobicContact CD1-CE1 4.29Å; L261-R300 HydrophobicContact CB-CG 4.02Å; L261-R300 HydrophobicContact CD1-CG 4.31Å; L261-R300 PolarHBondContact O-NE 3.37Å; L261-R300 PolarHBondContact O-NH2 3.46Å; L261-I301 HydrophobicContact CD1-CD1 4.41Å; L261-I301 HydrophobicContact CD1-CG1 3.86Å; L261-I301 HydrophobicContact CD2-CG1 3.73Å; L261-I301 HydrophobicContact CG-CG1 4.48Å; L261-L304 HydrophobicContact CB-CD1 4.15Å; L261-L304 HydrophobicContact CD2-CD1 3.71Å
262	Y	92.6	Very high	89.7	Confident	26 Å²	26	26.5 Å²	26.5	10%	0.102	15%	0.147	C	C	.	.	I	π-helix	trans	-125.8	-58.9	-178.6	-71.3	-82	0	0	0	112.6	M258 V265 I266 F296 Y297 R300 E335	M258-Y262 HydrophobicContact CE-CD2 3.81Å; M258-Y262 HydrophobicContact CE-CG 4.07Å; M258-Y262 WeakPolarHBondContact O-CB 3.42Å; M258-Y262 PolarHBondContact O-N 3.27Å; M258-Y262 VanDerWaalsContact O-N 3.12Å; M258-Y262 HydrophobicContact SD-CD2 3.73Å; M258-Y262 HydrophobicContact SD-CE2 4.18Å; Y262-V265 PolarHBondContact O-N 2.98Å; Y262-I266 HydrophobicContact CD1-CD1 4.05Å; Y262-I266 VanDerWaalsContact O-CB 3.26Å; Y262-I266 WeakPolarHBondContact O-CB 3.4Å; Y262-I266 WeakPolarHBondContact O-CG1 3.46Å; Y262-I266 PolarHBondContact O-N 3.01Å; Y262-F296 HydrophobicContact CE2-CE1 4.2Å; Y262-F296 VanDerWaalsContact OH-CE1 3.31Å; Y262-F296 WeakPolarHBondContact OH-CE1 3.25Å; Y262-F296 WeakPolarHBondContact OH-CZ 3.2Å; Y262-Y297 HydrophobicContact CE2-CE1 4.37Å; Y262-R300 HydrophobicContact CE2-CG 3.9Å; Y262-R300 WeakPolarHBondContact OH-CD 3.32Å; Y262-E335 WeakPolarHBondContact CE1-OE1 3.2Å; Y262-E335 PolarHBondContact OH-OE1 3.41Å
263	M	90	Very high	89.4	Confident	63 Å²	63	29.6 Å²	29.6	31%	0.31	16%	0.163	S	C	.	.	I	π-helix	trans	-65.1	-48.7	-170.5	-60.8	-60.1	-75.5	0	0	112.2	M213 M258 F259 V265 L267 G268	M213-M263 HydrophobicContact CE-CE 3.84Å; M213-M263 HydrophobicContact CE-CG 4.46Å; M213-M263 HydrophobicContact SD-CB 3.87Å; M213-M263 HydrophobicContact SD-CE 4.06Å; M213-M263 HydrophobicContact SD-CG 4.4Å; M258-M263 PolarHBondContact O-N 3.32Å; F259-M263 HydrophobicContact CD2-CB 4.2Å; F259-M263 PolarHBondContact O-N 3.24Å; M263-V265 VanDerWaalsContact C-N 3.28Å; M263-V265 PolarHBondContact O-N 3.33Å; M263-L267 HydrophobicContact CE-CD1 3.56Å; M263-L267 WeakPolarHBondContact O-CA 3.35Å; M263-L267 WeakPolarHBondContact O-CB 3.43Å; M263-L267 PolarHBondContact O-N 3.22Å; M263-L267 HydrophobicContact SD-CD1 4.34Å; M263-G268 PolarHBondContact O-N 3.46Å
264	S	87.6	Confident	89.3	Confident	20 Å²	20	31 Å²	31	14%	0.14	17%	0.17	C	C	.	.	H	α-helix	trans	-66.6	-31	177.2	-64.2	0	0	0	0	112.8	F259 G268 T269 G270	F259-S264 WeakPolarHBondContact CE2-OG 3.39Å; F259-S264 WeakPolarHBondContact CZ-OG 3.5Å; F259-S264 WeakPolarHBondContact O-CB 3.37Å; F259-S264 PolarHBondContact O-N 2.75Å; F259-S264 PolarHBondContact O-OG 3.39Å; S264-G268 CarbonylContact O-C 3.48Å; S264-G268 VanDerWaalsContact O-C 3.32Å; S264-G268 WeakPolarHBondContact O-CA 3.39Å; S264-G268 PolarHBondContact O-N 2.94Å; S264-T269 PolarHBondContact O-N 3.29Å; S264-G270 PolarHBondContact O-N 3.14Å
265	V	88.9	Confident	89.3	Confident	3 Å²	3	34 Å²	34	2%	0.018	19%	0.191	C	C	.	.	H	α-helix	trans	-75.2	-44.7	178.1	179.6	0	0	0	0	111.5	Y262 M263 G270 L304 N442	Y262-V265 PolarHBondContact O-N 2.98Å; M263-V265 VanDerWaalsContact C-N 3.28Å; M263-V265 PolarHBondContact O-N 3.33Å; V265-G270 WeakPolarHBondContact O-CA 3.43Å; V265-L304 HydrophobicContact CG1-CD2 4.12Å; V265-L304 HydrophobicContact CG2-CD1 3.99Å; V265-L304 HydrophobicContact CG2-CD2 4.15Å; V265-N442 WeakPolarHBondContact O-CB 3.32Å; V265-N442 PolarHBondContact O-ND2 3.38Å
266	I	85.8	Confident	89.3	Confident	32 Å²	32	33.4 Å²	33.4	16%	0.164	19%	0.186	C	C	.	.	H	α-helix	trans	-88	-43.6	-171.7	-67.2	176.5	0	0	0	111.6	Y262 W441 N442 R562	Y262-I266 HydrophobicContact CD1-CD1 4.05Å; Y262-I266 VanDerWaalsContact O-CB 3.26Å; Y262-I266 WeakPolarHBondContact O-CB 3.4Å; Y262-I266 WeakPolarHBondContact O-CG1 3.46Å; Y262-I266 PolarHBondContact O-N 3.01Å; I266-W441 HydrophobicContact CD1-CE3 4.44Å; I266-W441 HydrophobicContact CG2-CE3 4.44Å; I266-W441 HydrophobicContact CG2-CZ3 4.47Å; I266-N442 PolarHBondContact O-ND2 2.85Å; I266-R562 PolarHBondContact O-NH2 3.24Å
267	L	79.6	Confident	89.3	Confident	44 Å²	44	33.4 Å²	33.4	23%	0.23	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-15.8	-175.2	-57.2	-179.8	0	0	0	113.2	M263 F565 R566	M263-L267 HydrophobicContact CE-CD1 3.56Å; M263-L267 WeakPolarHBondContact O-CA 3.35Å; M263-L267 WeakPolarHBondContact O-CB 3.43Å; M263-L267 PolarHBondContact O-N 3.22Å; M263-L267 HydrophobicContact SD-CD1 4.34Å; L267-F565 HydrophobicContact CB-CB 4.48Å; L267-F565 CarbonylContact O-C 3.51Å; L267-R566 WeakPolarHBondContact O-CA 3.39Å; L267-R566 PolarHBondContact O-N 2.93Å
268	G	80.4	Confident	89.3	Confident	9 Å²	9	37 Å²	37	9%	0.093	20%	0.203	C	C	.	.	S	Bend	trans	-96.1	-145.4	-177.5	0	0	0	0	0	114.1	M263 S264 G270	M263-G268 PolarHBondContact O-N 3.46Å; S264-G268 CarbonylContact O-C 3.48Å; S264-G268 VanDerWaalsContact O-C 3.32Å; S264-G268 WeakPolarHBondContact O-CA 3.39Å; S264-G268 PolarHBondContact O-N 2.94Å; G268-G270 PolarHBondContact O-N 3.27Å
269	T	76.2	Confident	89.4	Confident	37 Å²	37	36.6 Å²	36.6	23%	0.227	21%	0.212	C	C	.	.	S	Bend	trans	-76.1	-5.3	-179.4	57.1	0	0	0	0	113.6	S264 E271 V570 T573	S264-T269 PolarHBondContact O-N 3.29Å; T269-E271 VanDerWaalsContact C-N 3.34Å; T269-V570 HydrophobicContact CG2-CG2 3.87Å; T269-T573 HydrophobicContact CG2-CG2 3.89Å
270	G	75.8	Confident	89.6	Confident	9 Å²	9	37.1 Å²	37.1	9%	0.093	22%	0.215	C	C	.	.	S	Bend	trans	90	-2.7	-172.4	0	0	0	0	0	113.8	S264 V265 G268	S264-G270 PolarHBondContact O-N 3.14Å; V265-G270 WeakPolarHBondContact O-CA 3.43Å; G268-G270 PolarHBondContact O-N 3.27Å
271	E	77.1	Confident	89.8	Confident	118 Å²	118	37.1 Å²	37.1	55%	0.551	22%	0.215	S	C	*	.			trans	-121.8	139.3	-179.8	-62.7	-170.7	148.2	0	0	111.4	T269 M445	T269-E271 VanDerWaalsContact C-N 3.34Å; E271-M445 HydrophobicContact CG-CE 4.27Å
272	G	84.5	Confident	89.9	Confident	26 Å²	26	43 Å²	43	27%	0.268	24%	0.241	S	C	.	.			trans	-122.2	164.6	175.5	0	0	0	0	0	111.7	H260 L274	H260-G272 WeakPolarHBondContact O-CA 3.3Å; G272-L274 VanDerWaalsContact C-N 3.32Å; G272-L274 PolarHBondContact O-N 3Å
273	N	92.2	Very high	90.1	Very high	65 Å²	65	45.5 Å²	45.5	35%	0.348	26%	0.26	S	S	.	.			trans	-79.8	80	175.4	-167.1	-9.9	0	0	0	110.3	P275 E276 A277	N273-P275 WeakPolarHBondContact OD1-CD 3.47Å; N273-E276 HydrophobicContact CB-CB 3.99Å; N273-E276 VanDerWaalsContact ND2-CB 3.29Å; N273-E276 WeakPolarHBondContact ND2-CB 3.5Å; N273-E276 PolarHBondContact ND2-OE2 3.14Å; N273-E276 PolarHBondContact O-N 3.48Å; N273-E276 WeakPolarHBondContact OD1-CB 3.47Å; N273-E276 PolarHBondContact OD1-N 3.22Å; N273-A277 PolarHBondContact O-N 3.42Å
274	L	95.3	Very high	90.5	Very high	31 Å²	31	44.4 Å²	44.4	16%	0.162	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-41.5	-179.9	-58.4	-176.8	0	0	0	113.4	L261 G272 E276 A277 E278 L304 K305	L261-L274 HydrophobicContact CD2-CD2 3.63Å; G272-L274 VanDerWaalsContact C-N 3.32Å; G272-L274 PolarHBondContact O-N 3Å; L274-E276 VanDerWaalsContact C-N 3.31Å; L274-E276 PolarHBondContact O-N 3.22Å; L274-A277 PolarHBondContact O-N 3.48Å; L274-E278 WeakPolarHBondContact O-CG 3.35Å; L274-E278 PolarHBondContact O-N 2.85Å; L274-L304 HydrophobicContact CD1-CB 4Å; L274-L304 HydrophobicContact CD2-CB 3.89Å; L274-L304 HydrophobicContact CD2-CD1 3.75Å; L274-L304 HydrophobicContact CD2-CG 4.5Å; L274-K305 HydrophobicContact CD1-CG 3.87Å
275	P	97.1	Very high	90.9	Very high	90 Å²	90	44.5 Å²	44.5	58%	0.584	26%	0.255	S	S	*	.	H	α-helix	trans	-57.5	-42.9	175.3	-27	35.4	0	0	0	113.1	N273 E278 A279	N273-P275 WeakPolarHBondContact OD1-CD 3.47Å; P275-E278 PolarHBondContact O-N 3.07Å; P275-A279 WeakPolarHBondContact O-CB 3.26Å; P275-A279 PolarHBondContact O-N 3.12Å
276	E	97.1	Very high	91.3	Very high	27 Å²	27	49.4 Å²	49.4	13%	0.126	28%	0.281	C	S	.	.	H	α-helix	trans	-65.6	-43.9	175.3	178.6	171.3	-164.6	0	0	111.6	R239 H260 N273 L274 E278 A279 L280	R239-E276 IonicContact CZ-OE1 3.19Å; R239-E276 VanDerWaalsContact CZ-OE1 3.32Å; R239-E276 IonicContact CZ-OE2 3.62Å; R239-E276 IonicContact NE-OE1 2.69Å; R239-E276 PolarHBondContact NE-OE1 2.92Å; R239-E276 IonicContact NE-OE2 3.72Å; R239-E276 IonicContact NH2-OE1 2.74Å; R239-E276 PolarHBondContact NH2-OE1 3.1Å; R239-E276 VanDerWaalsContact NH2-OE1 3.08Å; R239-E276 IonicContact NH2-OE2 3.33Å; R239-E276 PolarHBondContact NH2-OE2 3.31Å; H260-E276 IonicContact CE1-OE2 2.7Å; H260-E276 IonicContact NE2-OE1 3.99Å; H260-E276 IonicContact NE2-OE2 3.55Å; H260-E276 PolarHBondContact NE2-OE2 2.9Å; N273-E276 HydrophobicContact CB-CB 3.99Å; N273-E276 VanDerWaalsContact ND2-CB 3.29Å; N273-E276 WeakPolarHBondContact ND2-CB 3.5Å; N273-E276 PolarHBondContact ND2-OE2 3.14Å; N273-E276 PolarHBondContact O-N 3.48Å; N273-E276 WeakPolarHBondContact OD1-CB 3.47Å; N273-E276 PolarHBondContact OD1-N 3.22Å; L274-E276 VanDerWaalsContact C-N 3.31Å; L274-E276 PolarHBondContact O-N 3.22Å; E276-E278 VanDerWaalsContact C-N 3.31Å; E276-E278 PolarHBondContact O-N 2.87Å; E276-A279 PolarHBondContact O-N 2.77Å; E276-L280 HydrophobicContact CG-CD1 3.83Å; E276-L280 HydrophobicContact CG-CG 4.3Å; E276-L280 WeakPolarHBondContact O-CB 3.35Å; E276-L280 VanDerWaalsContact O-CG 3.27Å; E276-L280 WeakPolarHBondContact O-CG 3.19Å; E276-L280 PolarHBondContact O-N 3Å
277	A	97.8	Very high	91.9	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.9	-41.3	176.6	0	0	0	0	0	112.4	L257 H260 L261 N273 L274 L281 I301	L257-A277 HydrophobicContact CD2-CB 3.76Å; L257-A277 WeakPolarHBondContact CD2-O 3.44Å; H260-A277 HydrophobicContact CB-CB 4.46Å; L261-A277 HydrophobicContact CD1-CB 4.47Å; L261-A277 HydrophobicContact CD2-CB 3.84Å; L261-A277 HydrophobicContact CG-CB 4.24Å; N273-A277 PolarHBondContact O-N 3.42Å; L274-A277 PolarHBondContact O-N 3.48Å; A277-L281 WeakPolarHBondContact O-CB 3.4Å; A277-L281 PolarHBondContact O-N 2.9Å; A277-I301 HydrophobicContact CB-CD1 4.22Å; A277-I301 HydrophobicContact CB-CG1 4.46Å
278	E	97.9	Very high	92.7	Very high	77 Å²	77	52.2 Å²	52.2	36%	0.36	29%	0.29	S	S	.	.	H	α-helix	trans	-65.1	-44.7	175.1	-73.4	-177.2	129.6	0	0	112.4	L274 P275 E276 L280 L281 K282 I301 K305	L274-E278 WeakPolarHBondContact O-CG 3.35Å; L274-E278 PolarHBondContact O-N 2.85Å; P275-E278 PolarHBondContact O-N 3.07Å; E276-E278 VanDerWaalsContact C-N 3.31Å; E276-E278 PolarHBondContact O-N 2.87Å; E278-L280 VanDerWaalsContact C-N 3.32Å; E278-L280 PolarHBondContact O-N 3.25Å; E278-L281 PolarHBondContact O-N 3.03Å; E278-K282 VanDerWaalsContact O-CB 3.29Å; E278-K282 WeakPolarHBondContact O-CB 3.37Å; E278-K282 PolarHBondContact O-N 2.7Å; E278-I301 HydrophobicContact CG-CD1 3.97Å; E278-I301 HydrophobicContact CG-CG2 3.69Å; E278-K305 WeakPolarHBondContact OE1-CE 3.33Å; E278-K305 IonicContact OE1-NZ 3.85Å; E278-K305 PolarHBondContact OE1-NZ 3.12Å; E278-K305 WeakPolarHBondContact OE2-CE 3.45Å; E278-K305 IonicContact OE2-NZ 3.46Å; E278-K305 PolarHBondContact OE2-NZ 3.12Å
279	A	98.1	Very high	93.5	Very high	67 Å²	67	55.7 Å²	55.7	55%	0.554	31%	0.311	S	S	*	.	H	α-helix	trans	-62.3	-40.4	177.9	0	0	0	0	0	112	P275 E276 P283	P275-A279 WeakPolarHBondContact O-CB 3.26Å; P275-A279 PolarHBondContact O-N 3.12Å; E276-A279 PolarHBondContact O-N 2.77Å; A279-P283 VanDerWaalsContact O-CD 3.25Å; A279-P283 WeakPolarHBondContact O-CD 3.42Å
280	L	98.2	Very high	94.4	Very high	29 Å²	29	59.1 Å²	59.1	15%	0.152	33%	0.328	C	S	.	.	H	α-helix	trans	-67	-40.2	176.5	-74.5	168.5	0	0	0	112.5	A242 T253 L256 E276 E278 Y284	A242-L280 HydrophobicContact CB-CD2 4.01Å; T253-L280 HydrophobicContact CG2-CB 4.15Å; L256-L280 HydrophobicContact CB-CD1 3.6Å; L256-L280 HydrophobicContact CD1-CD1 3.78Å; L256-L280 HydrophobicContact CD1-CD2 4Å; L256-L280 HydrophobicContact CG-CD1 4.29Å; E276-L280 HydrophobicContact CG-CD1 3.83Å; E276-L280 HydrophobicContact CG-CG 4.3Å; E276-L280 WeakPolarHBondContact O-CB 3.35Å; E276-L280 VanDerWaalsContact O-CG 3.27Å; E276-L280 WeakPolarHBondContact O-CG 3.19Å; E276-L280 PolarHBondContact O-N 3Å; E278-L280 VanDerWaalsContact C-N 3.32Å; E278-L280 PolarHBondContact O-N 3.25Å; L280-Y284 WeakPolarHBondContact O-CD2 3.33Å
281	L	98.2	Very high	95.4	Very high	7 Å²	7	58.7 Å²	58.7	4%	0.037	32%	0.323	C	S	.	.	H	α-helix	trans	-75.9	-35.9	-177.6	-175.7	63.2	0	0	0	112.4	L257 A277 E278 Y284 A285 M294 I301	L257-L281 HydrophobicContact CD1-CD1 4.08Å; L257-L281 HydrophobicContact CD2-CB 4.44Å; A277-L281 WeakPolarHBondContact O-CB 3.4Å; A277-L281 PolarHBondContact O-N 2.9Å; E278-L281 PolarHBondContact O-N 3.03Å; L281-Y284 PolarHBondContact O-N 3.28Å; L281-A285 HydrophobicContact CG-CB 4.38Å; L281-A285 PolarHBondContact O-N 3.19Å; L281-M294 HydrophobicContact CD1-SD 3.65Å; L281-I301 HydrophobicContact CD2-CD1 3.85Å
282	K	97.4	Very high	96.4	Very high	123 Å²	123	53.1 Å²	53.1	54%	0.535	30%	0.297	S	S	.	.	H	α-helix	trans	-50.4	-50	-169.7	175	170.7	177.7	47.7	0	114.4	E278 Y284 A285 D286	E278-K282 VanDerWaalsContact O-CB 3.29Å; E278-K282 WeakPolarHBondContact O-CB 3.37Å; E278-K282 PolarHBondContact O-N 2.7Å; K282-Y284 PolarHBondContact O-N 3.37Å; K282-A285 PolarHBondContact O-N 3.49Å; K282-D286 WeakPolarHBondContact CG-OD2 3.31Å; K282-D286 IonicContact NZ-OD1 2.69Å; K282-D286 IonicContact NZ-OD2 3.91Å; K282-D286 PolarHBondContact NZ-OD2 3.46Å; K282-D286 WeakPolarHBondContact O-CB 3.47Å; K282-D286 VanDerWaalsContact O-CG 3.27Å; K282-D286 PolarHBondContact O-N 2.64Å
283	P	96.9	Very high	96.9	Very high	79 Å²	79	52.7 Å²	52.7	51%	0.513	29%	0.289	S	S	.	.	H	α-helix	trans	-60.2	-34.7	-179.8	-23.5	34.1	0	0	0	113.1	A279 K287	A279-P283 VanDerWaalsContact O-CD 3.25Å; A279-P283 WeakPolarHBondContact O-CD 3.42Å; P283-K287 VanDerWaalsContact O-CB 3.29Å; P283-K287 WeakPolarHBondContact O-CB 3.41Å; P283-K287 PolarHBondContact O-N 2.7Å; P283-K287 VanDerWaalsContact O-N 3.15Å
284	Y	97.7	Very high	97.2	Very high	39 Å²	39	49.8 Å²	49.8	15%	0.153	27%	0.273	C	S	.	.	H	α-helix	trans	-79	-37.8	178.2	-63	-82.3	0	0	0	112.1	I250 T253 L280 L281 K282 D286 K287 Y288 M294	I250-Y284 WeakPolarHBondContact CA-OH 3.41Å; I250-Y284 HydrophobicContact CB-CE1 3.86Å; I250-Y284 HydrophobicContact CD1-CD1 3.75Å; I250-Y284 HydrophobicContact CD1-CD2 4.18Å; I250-Y284 HydrophobicContact CD1-CE1 3.67Å; I250-Y284 HydrophobicContact CD1-CE2 4.1Å; I250-Y284 HydrophobicContact CD1-CG 4.01Å; I250-Y284 HydrophobicContact CG1-CE1 4.17Å; I250-Y284 PolarHBondContact N-OH 3.01Å; T253-Y284 HydrophobicContact CG2-CD2 4.06Å; T253-Y284 HydrophobicContact CG2-CE2 3.83Å; T253-Y284 WeakPolarHBondContact OG1-CE2 3.18Å; L280-Y284 WeakPolarHBondContact O-CD2 3.33Å; L281-Y284 PolarHBondContact O-N 3.28Å; K282-Y284 PolarHBondContact O-N 3.37Å; Y284-D286 VanDerWaalsContact C-N 3.34Å; Y284-K287 PolarHBondContact O-N 3.43Å; Y284-Y288 HydrophobicContact CD1-CD2 4.45Å; Y284-Y288 HydrophobicContact CD1-CE2 4.04Å; Y284-Y288 WeakPolarHBondContact O-CA 3.34Å; Y284-Y288 WeakPolarHBondContact O-CB 3.26Å; Y284-Y288 VanDerWaalsContact O-CD2 3.27Å; Y284-Y288 WeakPolarHBondContact O-CD2 3.38Å; Y284-Y288 PolarHBondContact O-N 2.83Å; Y284-M294 WeakPolarHBondContact CB-SD 3.29Å; Y284-M294 HydrophobicContact CG-CE 4.45Å; Y284-M294 HydrophobicContact CG-SD 4.46Å
285	A	97.3	Very high	97.3	Very high	23 Å²	23	48.9 Å²	48.9	19%	0.19	27%	0.269	C	S	.	.	H	α-helix	trans	-64.3	-39	173.6	0	0	0	0	0	111.9	L281 K282 Y288 P289 M294	L281-A285 HydrophobicContact CG-CB 4.38Å; L281-A285 PolarHBondContact O-N 3.19Å; K282-A285 PolarHBondContact O-N 3.49Å; A285-Y288 CarbonylContact O-C 3.26Å; A285-P289 WeakPolarHBondContact O-CA 3.45Å; A285-M294 HydrophobicContact CB-CB 4.42Å
286	D	97.3	Very high	97.4	Very high	105 Å²	105	45.1 Å²	45.1	56%	0.561	24%	0.243	S	C	*	.	H	α-helix	trans	-67.8	-37.1	176.1	-68.3	-18.6	0	0	0	111	K282 Y284	K282-D286 WeakPolarHBondContact CG-OD2 3.31Å; K282-D286 IonicContact NZ-OD1 2.69Å; K282-D286 IonicContact NZ-OD2 3.91Å; K282-D286 PolarHBondContact NZ-OD2 3.46Å; K282-D286 WeakPolarHBondContact O-CB 3.47Å; K282-D286 VanDerWaalsContact O-CG 3.27Å; K282-D286 PolarHBondContact O-N 2.64Å; Y284-D286 VanDerWaalsContact C-N 3.34Å
287	K	97.2	Very high	97.4	Very high	127 Å²	127	44.6 Å²	44.6	55%	0.552	24%	0.24	S	C	*	.	H	α-helix	trans	-79.2	-32.5	179.4	-171.2	170.4	-178.9	170.2	0	113.8	H44 P283 Y284	H44-K287 PolarHBondContact CE1-NZ 2.85Å; P283-K287 VanDerWaalsContact O-CB 3.29Å; P283-K287 WeakPolarHBondContact O-CB 3.41Å; P283-K287 PolarHBondContact O-N 2.7Å; P283-K287 VanDerWaalsContact O-N 3.15Å; Y284-K287 PolarHBondContact O-N 3.43Å
288	Y	97.4	Very high	97.5	Very high	9 Å²	9	46.3 Å²	46.3	4%	0.035	25%	0.251	C	S	.	.			trans	-129.9	66.9	-178.1	-46.1	-73.5	0	0	0	110.4	H44 L47 N48 Y284 A285 N290 G291	H44-Y288 PolarHBondContact CE1-OH 3.03Å; H44-Y288 AromaticContact ND1-CE1 3.84Å; H44-Y288 AromaticContact ND1-CZ 3.67Å; H44-Y288 PolarHBondContact ND1-OH 3.27Å; L47-Y288 HydrophobicContact CB-CD1 4.08Å; L47-Y288 HydrophobicContact CB-CD2 4.06Å; L47-Y288 HydrophobicContact CB-CE1 4.01Å; L47-Y288 HydrophobicContact CB-CE2 4Å; L47-Y288 HydrophobicContact CB-CG 4.09Å; L47-Y288 HydrophobicContact CD1-CD2 4.21Å; L47-Y288 HydrophobicContact CD1-CE2 3.53Å; L47-Y288 HydrophobicContact CG-CE2 4.39Å; N48-Y288 VanDerWaalsContact ND2-CD1 3.33Å; N48-Y288 WeakPolarHBondContact ND2-CD1 3.49Å; N48-Y288 WeakPolarHBondContact ND2-CE1 3.4Å; Y284-Y288 HydrophobicContact CD1-CD2 4.45Å; Y284-Y288 HydrophobicContact CD1-CE2 4.04Å; Y284-Y288 WeakPolarHBondContact O-CA 3.34Å; Y284-Y288 WeakPolarHBondContact O-CB 3.26Å; Y284-Y288 VanDerWaalsContact O-CD2 3.27Å; Y284-Y288 WeakPolarHBondContact O-CD2 3.38Å; Y284-Y288 PolarHBondContact O-N 2.83Å; A285-Y288 CarbonylContact O-C 3.26Å; Y288-N290 PolarHBondContact O-N 3.18Å; Y288-N290 VanDerWaalsContact O-N 3.09Å; Y288-G291 PolarHBondContact O-N 3.1Å
289	P	96.3	Very high	97.5	Very high	81 Å²	81	42.7 Å²	42.7	53%	0.526	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-22.8	-172.6	23.9	-34.8	0	0	0	114.1	A285	A285-P289 WeakPolarHBondContact O-CA 3.45Å
290	N	95.4	Very high	97.5	Very high	109 Å²	109	40.4 Å²	40.4	58%	0.583	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.6	9	175.3	-59.7	-36.8	0	0	0	112.6	N49 Y288 A292 T321	N49-N290 PolarHBondContact ND2-O 3.26Å; Y288-N290 PolarHBondContact O-N 3.18Å; Y288-N290 VanDerWaalsContact O-N 3.09Å; N290-A292 PolarHBondContact O-N 3.22Å; N290-T321 WeakPolarHBondContact O-CG2 3.35Å; N290-T321 PolarHBondContact O-OG1 3.22Å; N290-T321 VanDerWaalsContact O-OG1 3.07Å
291	G	97.6	Very high	97.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.205	C	C	.	.			trans	-65.8	127.5	175.5	0	0	0	0	0	110.2	L47 Y288 L293 M294 L295	L47-G291 VanDerWaalsContact O-CA 3.32Å; L47-G291 WeakPolarHBondContact O-CA 3.34Å; Y288-G291 PolarHBondContact O-N 3.1Å; G291-L293 VanDerWaalsContact C-N 3.3Å; G291-L293 PolarHBondContact O-N 3.44Å; G291-M294 WeakPolarHBondContact O-CA 3.15Å; G291-M294 WeakPolarHBondContact O-CB 3.19Å; G291-M294 PolarHBondContact O-N 3.41Å; G291-L295 PolarHBondContact O-N 3.12Å
292	A	96.9	Very high	97.5	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-59.5	-41.6	-174.7	0	0	0	0	0	111.5	N49 N290 M294 L295 F296 C318 T321 Q322 I328	N49-A292 WeakPolarHBondContact OD1-CB 3.45Å; N49-A292 PolarHBondContact OD1-N 3.38Å; N290-A292 PolarHBondContact O-N 3.22Å; A292-M294 VanDerWaalsContact C-N 3.3Å; A292-M294 PolarHBondContact O-N 3.2Å; A292-L295 PolarHBondContact O-N 3.23Å; A292-F296 VanDerWaalsContact O-CB 3.26Å; A292-F296 WeakPolarHBondContact O-CB 3.27Å; A292-F296 PolarHBondContact O-N 3.08Å; A292-C318 PolarHBondContact O-SG 3.42Å; A292-T321 HydrophobicContact CB-CG2 4.05Å; A292-Q322 HydrophobicContact CB-CG 4.11Å; A292-I328 HydrophobicContact CB-CD1 4.17Å; A292-I328 HydrophobicContact CB-CG2 4.19Å
293	L	95.9	Very high	97.5	Very high	18 Å²	18	33.5 Å²	33.5	9%	0.094	18%	0.18	C	C	.	.	H	α-helix	trans	-60.5	-39.6	173.3	-65.1	-177.8	0	0	0	112.2	F46 L47 M78 L254 G291 F296 Y297	F46-L293 HydrophobicContact CE1-CD1 3.89Å; L47-L293 HydrophobicContact CD2-CD1 4.28Å; M78-L293 HydrophobicContact CE-CD1 4.35Å; M78-L293 HydrophobicContact CE-CD2 3.95Å; L254-L293 HydrophobicContact CD1-CD1 4.29Å; G291-L293 VanDerWaalsContact C-N 3.3Å; G291-L293 PolarHBondContact O-N 3.44Å; L293-F296 PolarHBondContact O-N 3.26Å; L293-Y297 WeakPolarHBondContact O-CD2 3.49Å; L293-Y297 PolarHBondContact O-N 2.88Å
294	M	97.6	Very high	97.5	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.015	16%	0.16	C	C	.	.	H	α-helix	trans	-68.6	-43.4	-179.5	-52.7	-49.2	142.7	0	0	111.2	L47 I250 L281 Y284 A285 G291 A292 T298	L47-M294 HydrophobicContact CD2-CE 3.87Å; I250-M294 HydrophobicContact CD1-CE 4.18Å; L281-M294 HydrophobicContact CD1-SD 3.65Å; Y284-M294 WeakPolarHBondContact CB-SD 3.29Å; Y284-M294 HydrophobicContact CG-CE 4.45Å; Y284-M294 HydrophobicContact CG-SD 4.46Å; A285-M294 HydrophobicContact CB-CB 4.42Å; G291-M294 WeakPolarHBondContact O-CA 3.15Å; G291-M294 WeakPolarHBondContact O-CB 3.19Å; G291-M294 PolarHBondContact O-N 3.41Å; A292-M294 VanDerWaalsContact C-N 3.3Å; A292-M294 PolarHBondContact O-N 3.2Å; M294-T298 VanDerWaalsContact O-CB 3.26Å; M294-T298 WeakPolarHBondContact O-CB 3.39Å; M294-T298 PolarHBondContact O-N 2.78Å; M294-T298 PolarHBondContact O-OG1 2.94Å
295	L	98.5	Very high	97.5	Very high	13 Å²	13	33.3 Å²	33.3	7%	0.068	17%	0.173	C	C	.	.	H	α-helix	trans	-63.5	-44	175.3	-69.3	170.8	0	0	0	111.3	G291 A292 T298 A299 K314 A317 C318 T321	G291-L295 PolarHBondContact O-N 3.12Å; A292-L295 PolarHBondContact O-N 3.23Å; L295-T298 PolarHBondContact O-N 2.9Å; L295-A299 WeakPolarHBondContact O-CB 3.41Å; L295-A299 PolarHBondContact O-N 3.33Å; L295-K314 HydrophobicContact CD2-CD 4.08Å; L295-A317 HydrophobicContact CD1-CB 4.36Å; L295-C318 HydrophobicContact CB-CB 3.77Å; L295-C318 HydrophobicContact CD1-CB 4.44Å; L295-T321 HydrophobicContact CD1-CG2 3.95Å
296	F	98.3	Very high	97.4	Very high	11 Å²	11	32.3 Å²	32.3	5%	0.048	17%	0.165	C	C	.	.	H	α-helix	trans	-59.4	-51.9	178.3	-179.1	-95	0	0	0	112.3	Y262 A292 L293 T298 A299 R300 F315 L331 E335	Y262-F296 HydrophobicContact CE2-CE1 4.2Å; Y262-F296 VanDerWaalsContact OH-CE1 3.31Å; Y262-F296 WeakPolarHBondContact OH-CE1 3.25Å; Y262-F296 WeakPolarHBondContact OH-CZ 3.2Å; A292-F296 VanDerWaalsContact O-CB 3.26Å; A292-F296 WeakPolarHBondContact O-CB 3.27Å; A292-F296 PolarHBondContact O-N 3.08Å; L293-F296 PolarHBondContact O-N 3.26Å; F296-T298 PolarHBondContact O-N 2.82Å; F296-A299 WeakPolarHBondContact O-CB 3.37Å; F296-A299 PolarHBondContact O-N 3.37Å; F296-R300 PolarHBondContact O-N 3.46Å; F296-F315 AromaticContact CD2-CD1 4Å; F296-F315 HydrophobicContact CD2-CD1 4Å; F296-F315 AromaticContact CD2-CE1 3.63Å; F296-F315 HydrophobicContact CD2-CE1 3.63Å; F296-F315 HydrophobicContact CE2-CD1 4.35Å; F296-F315 AromaticContact CE2-CE1 3.75Å; F296-F315 HydrophobicContact CE2-CE1 3.75Å; F296-F315 HydrophobicContact CG-CE1 4.35Å; F296-L331 HydrophobicContact CD2-CB 4.3Å; F296-L331 HydrophobicContact CE2-CB 3.57Å; F296-L331 HydrophobicContact CZ-CB 3.95Å; F296-E335 HydrophobicContact CE2-CG 3.96Å; F296-E335 HydrophobicContact CZ-CG 4.11Å
297	Y	98.3	Very high	97.4	Very high	16 Å²	16	30.8 Å²	30.8	6%	0.063	16%	0.157	C	C	.	.	H	α-helix	trans	-69.2	-33.9	179.2	-75.4	-65.4	0	0	0	112.7	L254 L257 M258 L261 Y262 L293 A299 R300 I301	L254-Y297 HydrophobicContact CD2-CD2 4.08Å; L254-Y297 HydrophobicContact CD2-CE2 3.38Å; L257-Y297 HydrophobicContact CB-CD1 4.09Å; L257-Y297 HydrophobicContact CB-CE1 3.89Å; L257-Y297 HydrophobicContact CD1-CD1 4.3Å; L257-Y297 HydrophobicContact CD1-CD2 4Å; L257-Y297 HydrophobicContact CD1-CE2 4.37Å; L257-Y297 HydrophobicContact CD1-CG 3.98Å; M258-Y297 WeakPolarHBondContact CG-OH 3.39Å; M258-Y297 HydrophobicContact SD-CE1 4.07Å; M258-Y297 PolarHBondContact SD-OH 2.88Å; L261-Y297 HydrophobicContact CD1-CD1 3.62Å; L261-Y297 HydrophobicContact CD1-CE1 4.29Å; Y262-Y297 HydrophobicContact CE2-CE1 4.37Å; L293-Y297 WeakPolarHBondContact O-CD2 3.49Å; L293-Y297 PolarHBondContact O-N 2.88Å; Y297-A299 VanDerWaalsContact C-N 3.32Å; Y297-A299 PolarHBondContact O-N 3.32Å; Y297-R300 PolarHBondContact O-N 3.46Å; Y297-I301 VanDerWaalsContact O-CG1 3.32Å; Y297-I301 WeakPolarHBondContact O-CG1 3.48Å; Y297-I301 PolarHBondContact O-N 3.15Å
298	T	98.6	Very high	97.5	Very high	36 Å²	36	24.7 Å²	24.7	22%	0.221	13%	0.13	C	C	.	.	H	α-helix	trans	-57.8	-47.6	171.9	-61.7	0	0	0	0	110.7	M294 L295 F296 I301 A302 F310 K314	M294-T298 VanDerWaalsContact O-CB 3.26Å; M294-T298 WeakPolarHBondContact O-CB 3.39Å; M294-T298 PolarHBondContact O-N 2.78Å; M294-T298 PolarHBondContact O-OG1 2.94Å; L295-T298 PolarHBondContact O-N 2.9Å; F296-T298 PolarHBondContact O-N 2.82Å; T298-I301 PolarHBondContact O-N 3.25Å; T298-A302 PolarHBondContact O-N 3.01Å; T298-A302 VanDerWaalsContact O-N 3.15Å; T298-F310 HydrophobicContact CG2-CE1 3.94Å; T298-F310 HydrophobicContact CG2-CZ 4.23Å; T298-K314 HydrophobicContact CG2-CD 4.49Å; T298-K314 HydrophobicContact CG2-CG 4.3Å
299	A	98.6	Very high	97.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.7	-44.3	177.7	0	0	0	0	0	111.8	L295 F296 Y297 I301 A302 V303 A311 K314 F315	L295-A299 WeakPolarHBondContact O-CB 3.41Å; L295-A299 PolarHBondContact O-N 3.33Å; F296-A299 WeakPolarHBondContact O-CB 3.37Å; F296-A299 PolarHBondContact O-N 3.37Å; Y297-A299 VanDerWaalsContact C-N 3.32Å; Y297-A299 PolarHBondContact O-N 3.32Å; A299-I301 PolarHBondContact O-N 3.2Å; A299-A302 WeakPolarHBondContact O-CA 3.3Å; A299-A302 WeakPolarHBondContact O-CB 3.44Å; A299-A302 PolarHBondContact O-N 3Å; A299-A302 VanDerWaalsContact O-N 3.08Å; A299-V303 PolarHBondContact O-N 2.89Å; A299-A311 WeakPolarHBondContact O-CB 3.29Å; A299-K314 HydrophobicContact CB-CB 3.61Å; A299-F315 HydrophobicContact CB-CD1 3.53Å; A299-F315 HydrophobicContact CB-CD2 3.72Å; A299-F315 HydrophobicContact CB-CE1 3.39Å; A299-F315 HydrophobicContact CB-CE2 3.58Å; A299-F315 HydrophobicContact CB-CG 3.67Å; A299-F315 HydrophobicContact CB-CZ 3.4Å; A299-F315 VanDerWaalsContact CB-CZ 3.4Å
300	R	97.9	Very high	97.6	Very high	20 Å²	20	27.4 Å²	27.4	8%	0.075	14%	0.14	C	C	.	.	H	α-helix	trans	-61.7	-42.2	178.4	179.9	59	-179.7	175.8	5	112.7	L261 Y262 F296 Y297 A302 V303 L304 F315 E335	L261-R300 HydrophobicContact CB-CG 4.02Å; L261-R300 HydrophobicContact CD1-CG 4.31Å; L261-R300 PolarHBondContact O-NE 3.37Å; L261-R300 PolarHBondContact O-NH2 3.46Å; Y262-R300 HydrophobicContact CE2-CG 3.9Å; Y262-R300 WeakPolarHBondContact OH-CD 3.32Å; F296-R300 PolarHBondContact O-N 3.46Å; Y297-R300 PolarHBondContact O-N 3.46Å; R300-A302 VanDerWaalsContact C-N 3.27Å; R300-A302 PolarHBondContact O-N 2.91Å; R300-V303 WeakPolarHBondContact O-CB 3.45Å; R300-V303 PolarHBondContact O-N 3.47Å; R300-L304 WeakPolarHBondContact O-CG 3.29Å; R300-L304 PolarHBondContact O-N 3.48Å; R300-L304 VanDerWaalsContact O-N 3.12Å; R300-F315 HydrophobicContact CB-CZ 4.47Å; R300-E335 WeakPolarHBondContact CD-OE2 3.37Å; R300-E335 IonicContact CZ-OE1 3.26Å; R300-E335 IonicContact CZ-OE2 3.16Å; R300-E335 IonicContact NE-OE2 3.98Å; R300-E335 IonicContact NH1-OE1 3.23Å; R300-E335 PolarHBondContact NH1-OE1 3.22Å; R300-E335 IonicContact NH1-OE2 3.21Å; R300-E335 PolarHBondContact NH1-OE2 2.94Å
301	I	98.3	Very high	97.7	Very high	7 Å²	7	22.2 Å²	22.2	4%	0.036	11%	0.113	C	C	.	.	H	α-helix	trans	-59.2	-43.2	173.5	-71.2	166.2	0	0	0	110	L261 A277 E278 L281 Y297 T298 A299 L304 K305	L261-I301 HydrophobicContact CD1-CD1 4.41Å; L261-I301 HydrophobicContact CD1-CG1 3.86Å; L261-I301 HydrophobicContact CD2-CG1 3.73Å; L261-I301 HydrophobicContact CG-CG1 4.48Å; A277-I301 HydrophobicContact CB-CD1 4.22Å; A277-I301 HydrophobicContact CB-CG1 4.46Å; E278-I301 HydrophobicContact CG-CD1 3.97Å; E278-I301 HydrophobicContact CG-CG2 3.69Å; L281-I301 HydrophobicContact CD2-CD1 3.85Å; Y297-I301 VanDerWaalsContact O-CG1 3.32Å; Y297-I301 WeakPolarHBondContact O-CG1 3.48Å; Y297-I301 PolarHBondContact O-N 3.15Å; T298-I301 PolarHBondContact O-N 3.25Å; A299-I301 PolarHBondContact O-N 3.2Å; I301-L304 PolarHBondContact O-N 3.03Å; I301-K305 HydrophobicContact CG2-CD 4.34Å; I301-K305 WeakPolarHBondContact O-CG 3.28Å; I301-K305 PolarHBondContact O-N 3.42Å
302	A	98.3	Very high	97.8	Very high	5 Å²	5	23.1 Å²	23.1	4%	0.041	12%	0.117	C	C	.	.	H	α-helix	trans	-63.7	-39.6	177.6	0	0	0	0	0	113.2	T298 A299 R300 L304 K305 G306 N307 F310 A311	T298-A302 PolarHBondContact O-N 3.01Å; T298-A302 VanDerWaalsContact O-N 3.15Å; A299-A302 WeakPolarHBondContact O-CA 3.3Å; A299-A302 WeakPolarHBondContact O-CB 3.44Å; A299-A302 PolarHBondContact O-N 3Å; A299-A302 VanDerWaalsContact O-N 3.08Å; R300-A302 VanDerWaalsContact C-N 3.27Å; R300-A302 PolarHBondContact O-N 2.91Å; A302-L304 VanDerWaalsContact C-N 3.34Å; A302-L304 PolarHBondContact O-N 3.04Å; A302-K305 CarbonylContact O-C 3.49Å; A302-K305 PolarHBondContact O-N 3.39Å; A302-G306 PolarHBondContact O-N 2.99Å; A302-N307 HydrophobicContact CB-CB 4.34Å; A302-N307 PolarHBondContact O-N 3.3Å; A302-F310 HydrophobicContact CB-CD1 3.61Å; A302-F310 HydrophobicContact CB-CE1 4.25Å; A302-A311 HydrophobicContact CB-CB 3.93Å
303	V	97.8	Very high	97.9	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-55.1	-51.1	171.4	172.5	0	0	0	0	110.3	A299 R300 K305 G306 F308 A311 F315 F342 V446	A299-V303 PolarHBondContact O-N 2.89Å; R300-V303 WeakPolarHBondContact O-CB 3.45Å; R300-V303 PolarHBondContact O-N 3.47Å; V303-K305 PolarHBondContact O-N 3.19Å; V303-G306 WeakPolarHBondContact O-CA 3.46Å; V303-G306 PolarHBondContact O-N 3.23Å; V303-F308 HydrophobicContact CG1-CE1 4.23Å; V303-A311 HydrophobicContact CG2-CB 3.51Å; V303-F315 HydrophobicContact CG2-CE2 3.73Å; V303-F315 HydrophobicContact CG2-CZ 4.26Å; V303-F342 HydrophobicContact CG1-CE2 4.08Å; V303-V446 HydrophobicContact CG1-CG1 3.85Å; V303-V446 WeakPolarHBondContact O-CG1 3.34Å
304	L	96.6	Very high	98	Very high	15 Å²	15	30.8 Å²	30.8	8%	0.079	15%	0.151	C	C	.	.	H	α-helix	trans	-68	-19.5	-177.6	-63.7	179.5	0	0	0	113.5	L261 V265 L274 R300 I301 A302 G306 V446	L261-L304 HydrophobicContact CB-CD1 4.15Å; L261-L304 HydrophobicContact CD2-CD1 3.71Å; V265-L304 HydrophobicContact CG1-CD2 4.12Å; V265-L304 HydrophobicContact CG2-CD1 3.99Å; V265-L304 HydrophobicContact CG2-CD2 4.15Å; L274-L304 HydrophobicContact CD1-CB 4Å; L274-L304 HydrophobicContact CD2-CB 3.89Å; L274-L304 HydrophobicContact CD2-CD1 3.75Å; L274-L304 HydrophobicContact CD2-CG 4.5Å; R300-L304 WeakPolarHBondContact O-CG 3.29Å; R300-L304 PolarHBondContact O-N 3.48Å; R300-L304 VanDerWaalsContact O-N 3.12Å; I301-L304 PolarHBondContact O-N 3.03Å; A302-L304 VanDerWaalsContact C-N 3.34Å; A302-L304 PolarHBondContact O-N 3.04Å; L304-G306 VanDerWaalsContact C-N 3.35Å; L304-V446 HydrophobicContact CD2-CG2 3.87Å
305	K	96.4	Very high	98	Very high	99 Å²	99	30.6 Å²	30.6	43%	0.43	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-4.3	169.4	-70.6	-174.2	171.5	-170.7	0	113.8	L274 E278 I301 A302 V303 N307	L274-K305 HydrophobicContact CD1-CG 3.87Å; E278-K305 WeakPolarHBondContact OE1-CE 3.33Å; E278-K305 IonicContact OE1-NZ 3.85Å; E278-K305 PolarHBondContact OE1-NZ 3.12Å; E278-K305 WeakPolarHBondContact OE2-CE 3.45Å; E278-K305 IonicContact OE2-NZ 3.46Å; E278-K305 PolarHBondContact OE2-NZ 3.12Å; I301-K305 HydrophobicContact CG2-CD 4.34Å; I301-K305 WeakPolarHBondContact O-CG 3.28Å; I301-K305 PolarHBondContact O-N 3.42Å; A302-K305 CarbonylContact O-C 3.49Å; A302-K305 PolarHBondContact O-N 3.39Å; V303-K305 PolarHBondContact O-N 3.19Å; K305-N307 VanDerWaalsContact C-N 3.3Å
306	G	96.6	Very high	98	Very high	2 Å²	2	33.5 Å²	33.5	2%	0.021	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	14.6	-174.4	0	0	0	0	0	114.2	A302 V303 L304 F308 R450	A302-G306 PolarHBondContact O-N 2.99Å; V303-G306 WeakPolarHBondContact O-CA 3.46Å; V303-G306 PolarHBondContact O-N 3.23Å; L304-G306 VanDerWaalsContact C-N 3.35Å; G306-F308 PolarHBondContact O-N 2.6Å; G306-R450 VanDerWaalsContact O-CD 3.25Å; G306-R450 WeakPolarHBondContact O-CD 3.44Å; G306-R450 WeakPolarHBondContact O-CG 3.24Å; G306-R450 PolarHBondContact O-NH1 3.41Å
307	N	97.9	Very high	98	Very high	73 Å²	73	34.8 Å²	34.8	39%	0.39	18%	0.178	S	C	.	.			trans	-91.8	70.6	176.1	-170.2	-4.3	0	0	0	110.4	A302 K305 F310 A311	A302-N307 HydrophobicContact CB-CB 4.34Å; A302-N307 PolarHBondContact O-N 3.3Å; K305-N307 VanDerWaalsContact C-N 3.3Å; N307-F310 VanDerWaalsContact CG-CB 3.5Å; N307-F310 WeakPolarHBondContact ND2-CB 3.48Å; N307-F310 WeakPolarHBondContact OD1-CB 3.49Å; N307-F310 PolarHBondContact OD1-N 3.41Å; N307-A311 WeakPolarHBondContact O-CB 3.44Å; N307-A311 PolarHBondContact O-N 3.07Å
308	F	97.8	Very high	98	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66	-40.1	-172.3	-56.8	-47	0	0	0	113.4	V303 G306 F310 A311 Q312 F342 E343 V446 R450 L453	V303-F308 HydrophobicContact CG1-CE1 4.23Å; G306-F308 PolarHBondContact O-N 2.6Å; F308-F310 PolarHBondContact O-N 3.49Å; F308-A311 WeakPolarHBondContact O-CB 3.38Å; F308-A311 PolarHBondContact O-N 3.38Å; F308-Q312 WeakPolarHBondContact O-CB 3.35Å; F308-Q312 VanDerWaalsContact O-CG 3.24Å; F308-Q312 WeakPolarHBondContact O-CG 3.5Å; F308-Q312 PolarHBondContact O-N 2.95Å; F308-F342 HydrophobicContact CD1-CD2 4.13Å; F308-F342 HydrophobicContact CD2-CB 4.35Å; F308-F342 HydrophobicContact CE1-CB 4.33Å; F308-F342 AromaticContact CE1-CD2 3.51Å; F308-F342 HydrophobicContact CE1-CD2 3.51Å; F308-F342 HydrophobicContact CE1-CE2 4.23Å; F308-F342 HydrophobicContact CE1-CG 4.25Å; F308-F342 HydrophobicContact CE2-CB 3.84Å; F308-F342 HydrophobicContact CZ-CB 3.83Å; F308-F342 AromaticContact CZ-CD2 3.74Å; F308-F342 HydrophobicContact CZ-CD2 3.74Å; F308-F342 HydrophobicContact CZ-CG 4.02Å; F308-E343 HydrophobicContact CB-CG 4.37Å; F308-E343 HydrophobicContact CD2-CG 4.08Å; F308-V446 HydrophobicContact CE1-CG1 3.79Å; F308-V446 HydrophobicContact CZ-CG1 4.01Å; F308-R450 HydrophobicContact CD2-CG 4.44Å; F308-R450 HydrophobicContact CE2-CG 3.87Å; F308-L453 HydrophobicContact CD2-CD1 3.67Å; F308-L453 HydrophobicContact CE2-CD1 3.59Å
309	T	97.1	Very high	98	Very high	73 Å²	73	33.8 Å²	33.8	45%	0.448	17%	0.172	S	C	.	.	H	α-helix	trans	-59.2	-50.5	177.7	-46.4	0	0	0	0	111.6	A311 Q312 E313	T309-A311 VanDerWaalsContact C-N 3.33Å; T309-A311 PolarHBondContact O-N 3.03Å; T309-Q312 PolarHBondContact O-N 3.46Å; T309-E313 WeakPolarHBondContact O-CG 3.21Å; T309-E313 PolarHBondContact O-N 2.89Å
310	F	98.6	Very high	97.9	Very high	73 Å²	73	37.8 Å²	37.8	32%	0.32	21%	0.205	S	C	.	.	H	α-helix	trans	-65.4	-37.3	177.3	-179.7	-104.7	0	0	0	112.2	T298 A302 N307 F308 E313 K314	T298-F310 HydrophobicContact CG2-CE1 3.94Å; T298-F310 HydrophobicContact CG2-CZ 4.23Å; A302-F310 HydrophobicContact CB-CD1 3.61Å; A302-F310 HydrophobicContact CB-CE1 4.25Å; N307-F310 VanDerWaalsContact CG-CB 3.5Å; N307-F310 WeakPolarHBondContact ND2-CB 3.48Å; N307-F310 WeakPolarHBondContact OD1-CB 3.49Å; N307-F310 PolarHBondContact OD1-N 3.41Å; F308-F310 PolarHBondContact O-N 3.49Å; F310-E313 PolarHBondContact O-N 3.04Å; F310-K314 HydrophobicContact CD1-CG 4.29Å; F310-K314 HydrophobicContact CD2-CG 4.46Å; F310-K314 HydrophobicContact CE1-CG 3.93Å; F310-K314 HydrophobicContact CE2-CD 4.39Å; F310-K314 HydrophobicContact CE2-CG 4.12Å; F310-K314 HydrophobicContact CZ-CD 4.19Å; F310-K314 HydrophobicContact CZ-CG 3.86Å; F310-K314 WeakPolarHBondContact O-CG 3.39Å; F310-K314 PolarHBondContact O-N 2.99Å
311	A	98.6	Very high	97.9	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.4	-46.3	174.8	0	0	0	0	0	111.8	A299 A302 V303 N307 F308 T309 K314 F315	A299-A311 WeakPolarHBondContact O-CB 3.29Å; A302-A311 HydrophobicContact CB-CB 3.93Å; V303-A311 HydrophobicContact CG2-CB 3.51Å; N307-A311 WeakPolarHBondContact O-CB 3.44Å; N307-A311 PolarHBondContact O-N 3.07Å; F308-A311 WeakPolarHBondContact O-CB 3.38Å; F308-A311 PolarHBondContact O-N 3.38Å; T309-A311 VanDerWaalsContact C-N 3.33Å; T309-A311 PolarHBondContact O-N 3.03Å; A311-K314 PolarHBondContact O-N 3.38Å; A311-F315 HydrophobicContact CB-CD2 4.45Å; A311-F315 HydrophobicContact CB-CE2 4.19Å; A311-F315 WeakPolarHBondContact O-CD2 3.43Å; A311-F315 PolarHBondContact O-N 3.48Å
312	Q	98.7	Very high	97.6	Very high	20 Å²	20	39.3 Å²	39.3	9%	0.093	22%	0.216	C	C	.	.	H	α-helix	trans	-59.5	-47.8	177.7	-71	163.5	13	0	0	111.3	F308 T309 K314 F315 L316 L336 A339 Y340 E343	F308-Q312 WeakPolarHBondContact O-CB 3.35Å; F308-Q312 VanDerWaalsContact O-CG 3.24Å; F308-Q312 WeakPolarHBondContact O-CG 3.5Å; F308-Q312 PolarHBondContact O-N 2.95Å; T309-Q312 PolarHBondContact O-N 3.46Å; Q312-K314 VanDerWaalsContact C-N 3.27Å; Q312-K314 PolarHBondContact O-N 3.39Å; Q312-F315 PolarHBondContact O-N 3.45Å; Q312-L316 WeakPolarHBondContact O-CB 3.41Å; Q312-L316 VanDerWaalsContact O-CG 3.3Å; Q312-L316 WeakPolarHBondContact O-CG 3.31Å; Q312-L316 PolarHBondContact O-N 2.95Å; Q312-L336 HydrophobicContact CB-CD2 3.97Å; Q312-L336 HydrophobicContact CG-CD2 3.89Å; Q312-A339 HydrophobicContact CG-CB 4.09Å; Q312-Y340 VanDerWaalsContact CD-CE1 3.48Å; Q312-Y340 HydrophobicContact CG-CE1 4.37Å; Q312-Y340 HydrophobicContact CG-CE2 4.35Å; Q312-E343 PolarHBondContact NE2-OE2 3.39Å
313	E	98.5	Very high	97.3	Very high	113 Å²	113	47.2 Å²	47.2	53%	0.528	25%	0.252	S	S	.	.	H	α-helix	trans	-54.9	-43.8	175.5	-72.3	176.5	-178.7	0	0	112	T309 F310 A317	T309-E313 WeakPolarHBondContact O-CG 3.21Å; T309-E313 PolarHBondContact O-N 2.89Å; F310-E313 PolarHBondContact O-N 3.04Å; E313-A317 WeakPolarHBondContact O-CB 3.47Å; E313-A317 PolarHBondContact O-N 3.48Å
314	K	98.7	Very high	97	Very high	66 Å²	66	51.8 Å²	51.8	29%	0.287	27%	0.274	S	S	.	.	H	α-helix	trans	-74.1	-36.2	-178.7	-67.7	-64.5	177.2	-171.7	0	113.4	L295 T298 A299 F310 A311 Q312 A317 C318	L295-K314 HydrophobicContact CD2-CD 4.08Å; T298-K314 HydrophobicContact CG2-CD 4.49Å; T298-K314 HydrophobicContact CG2-CG 4.3Å; A299-K314 HydrophobicContact CB-CB 3.61Å; F310-K314 HydrophobicContact CD1-CG 4.29Å; F310-K314 HydrophobicContact CD2-CG 4.46Å; F310-K314 HydrophobicContact CE1-CG 3.93Å; F310-K314 HydrophobicContact CE2-CD 4.39Å; F310-K314 HydrophobicContact CE2-CG 4.12Å; F310-K314 HydrophobicContact CZ-CD 4.19Å; F310-K314 HydrophobicContact CZ-CG 3.86Å; F310-K314 WeakPolarHBondContact O-CG 3.39Å; F310-K314 PolarHBondContact O-N 2.99Å; A311-K314 PolarHBondContact O-N 3.38Å; Q312-K314 VanDerWaalsContact C-N 3.27Å; Q312-K314 PolarHBondContact O-N 3.39Å; K314-A317 PolarHBondContact O-N 3.24Å; K314-C318 WeakPolarHBondContact O-CB 3.27Å; K314-C318 PolarHBondContact O-N 3.26Å
315	F	98.7	Very high	96.6	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-65.4	-41.2	171.5	-73	-54.6	0	0	0	111.8	F296 A299 R300 V303 A311 Q312 C318 I319 C332 E335 L336	F296-F315 AromaticContact CD2-CD1 4Å; F296-F315 HydrophobicContact CD2-CD1 4Å; F296-F315 AromaticContact CD2-CE1 3.63Å; F296-F315 HydrophobicContact CD2-CE1 3.63Å; F296-F315 HydrophobicContact CE2-CD1 4.35Å; F296-F315 AromaticContact CE2-CE1 3.75Å; F296-F315 HydrophobicContact CE2-CE1 3.75Å; F296-F315 HydrophobicContact CG-CE1 4.35Å; A299-F315 HydrophobicContact CB-CD1 3.53Å; A299-F315 HydrophobicContact CB-CD2 3.72Å; A299-F315 HydrophobicContact CB-CE1 3.39Å; A299-F315 HydrophobicContact CB-CE2 3.58Å; A299-F315 HydrophobicContact CB-CG 3.67Å; A299-F315 HydrophobicContact CB-CZ 3.4Å; A299-F315 VanDerWaalsContact CB-CZ 3.4Å; R300-F315 HydrophobicContact CB-CZ 4.47Å; V303-F315 HydrophobicContact CG2-CE2 3.73Å; V303-F315 HydrophobicContact CG2-CZ 4.26Å; A311-F315 HydrophobicContact CB-CD2 4.45Å; A311-F315 HydrophobicContact CB-CE2 4.19Å; A311-F315 WeakPolarHBondContact O-CD2 3.43Å; A311-F315 PolarHBondContact O-N 3.48Å; Q312-F315 PolarHBondContact O-N 3.45Å; F315-C318 VanDerWaalsContact O-CB 3.32Å; F315-C318 WeakPolarHBondContact O-CB 3.27Å; F315-C318 PolarHBondContact O-N 2.99Å; F315-I319 WeakPolarHBondContact O-CG1 3.49Å; F315-I319 PolarHBondContact O-N 2.85Å; F315-C332 HydrophobicContact CB-CB 4.25Å; F315-C332 HydrophobicContact CD1-CB 4.2Å; F315-E335 HydrophobicContact CD1-CB 4.21Å; F315-E335 HydrophobicContact CD2-CB 3.98Å; F315-E335 HydrophobicContact CE1-CB 3.64Å; F315-E335 HydrophobicContact CE1-CG 3.74Å; F315-E335 HydrophobicContact CE2-CB 3.39Å; F315-E335 HydrophobicContact CE2-CG 4.2Å; F315-E335 HydrophobicContact CG-CB 4.38Å; F315-E335 HydrophobicContact CZ-CB 3.21Å; F315-E335 HydrophobicContact CZ-CG 3.5Å; F315-E335 VanDerWaalsContact CZ-CG 3.5Å; F315-L336 HydrophobicContact CB-CD1 3.95Å; F315-L336 HydrophobicContact CB-CD2 3.85Å; F315-L336 HydrophobicContact CB-CG 3.74Å; F315-L336 HydrophobicContact CD2-CD2 4.24Å; F315-L336 HydrophobicContact CD2-CG 4.27Å; F315-L336 HydrophobicContact CG-CD2 4.49Å; F315-L336 HydrophobicContact CG-CG 4.28Å
316	L	98.5	Very high	96.3	Very high	73 Å²	73	51.8 Å²	51.8	38%	0.382	27%	0.27	S	S	.	.	H	α-helix	trans	-64	-40.5	174.6	-70.8	172	0	0	0	111.9	Q312 C318 I319 A320 L336 Y352	Q312-L316 WeakPolarHBondContact O-CB 3.41Å; Q312-L316 VanDerWaalsContact O-CG 3.3Å; Q312-L316 WeakPolarHBondContact O-CG 3.31Å; Q312-L316 PolarHBondContact O-N 2.95Å; L316-C318 VanDerWaalsContact C-N 3.33Å; L316-C318 PolarHBondContact O-N 3.1Å; L316-I319 HydrophobicContact CD2-CD1 4.44Å; L316-I319 PolarHBondContact O-N 3.35Å; L316-A320 WeakPolarHBondContact O-CB 2.94Å; L316-A320 PolarHBondContact O-N 3.47Å; L316-L336 HydrophobicContact CD2-CD1 4.13Å; L316-L336 HydrophobicContact CG-CD1 4.44Å; L316-Y352 WeakPolarHBondContact CD2-OH 3.44Å
317	A	98.3	Very high	95.9	Very high	38 Å²	38	52.8 Å²	52.8	31%	0.314	27%	0.274	S	S	.	.	H	α-helix	trans	-63.4	-38.3	172.5	0	0	0	0	0	112.3	L295 E313 K314 I319 A320 T321	L295-A317 HydrophobicContact CD1-CB 4.36Å; E313-A317 WeakPolarHBondContact O-CB 3.47Å; E313-A317 PolarHBondContact O-N 3.48Å; K314-A317 PolarHBondContact O-N 3.24Å; A317-I319 VanDerWaalsContact C-N 3.33Å; A317-I319 PolarHBondContact O-N 3.42Å; A317-A320 PolarHBondContact O-N 2.91Å; A317-T321 PolarHBondContact O-N 3.33Å
318	C	98.3	Very high	95.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-41.1	174.4	-174.7	0	0	0	0	111.7	A292 L295 K314 F315 L316 T321	A292-C318 PolarHBondContact O-SG 3.42Å; L295-C318 HydrophobicContact CB-CB 3.77Å; L295-C318 HydrophobicContact CD1-CB 4.44Å; K314-C318 WeakPolarHBondContact O-CB 3.27Å; K314-C318 PolarHBondContact O-N 3.26Å; F315-C318 VanDerWaalsContact O-CB 3.32Å; F315-C318 WeakPolarHBondContact O-CB 3.27Å; F315-C318 PolarHBondContact O-N 2.99Å; L316-C318 VanDerWaalsContact C-N 3.33Å; L316-C318 PolarHBondContact O-N 3.1Å; C318-T321 WeakPolarHBondContact O-CG2 3.35Å
319	I	97.7	Very high	95.5	Very high	31 Å²	31	49.5 Å²	49.5	16%	0.159	26%	0.256	C	S	.	.	H	α-helix	trans	-66.3	-39.4	174.2	-66.8	156.9	0	0	0	111	F315 L316 A317 T321 H329 C332 F333 L336	F315-I319 WeakPolarHBondContact O-CG1 3.49Å; F315-I319 PolarHBondContact O-N 2.85Å; L316-I319 HydrophobicContact CD2-CD1 4.44Å; L316-I319 PolarHBondContact O-N 3.35Å; A317-I319 VanDerWaalsContact C-N 3.33Å; A317-I319 PolarHBondContact O-N 3.42Å; I319-T321 VanDerWaalsContact C-N 3.34Å; I319-T321 PolarHBondContact O-N 3.49Å; I319-H329 HydrophobicContact CG1-CB 4.3Å; I319-H329 PolarHBondContact O-CE1 3.49Å; I319-H329 PolarHBondContact O-NE2 3.17Å; I319-H329 VanDerWaalsContact O-NE2 3.09Å; I319-C332 HydrophobicContact CD1-CB 3.67Å; I319-C332 HydrophobicContact CG1-CB 3.66Å; I319-F333 HydrophobicContact CD1-CD1 3.89Å; I319-F333 HydrophobicContact CD1-CE1 3.66Å; I319-F333 HydrophobicContact CG1-CE1 4.27Å; I319-L336 HydrophobicContact CD1-CD1 3.79Å
320	A	97.6	Very high	95.4	Very high	85 Å²	85	46.5 Å²	46.5	70%	0.702	24%	0.237	S	C	*	.	H	α-helix	trans	-75	-20.2	-176.4	0	0	0	0	0	114	L316 A317	L316-A320 WeakPolarHBondContact O-CB 2.94Å; L316-A320 PolarHBondContact O-N 3.47Å; A317-A320 PolarHBondContact O-N 2.91Å
321	T	96.5	Very high	95.2	Very high	46 Å²	46	46.2 Å²	46.2	28%	0.282	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-10.5	-172	-165.8	0	0	0	0	114.6	N49 N290 A292 L295 A317 C318 I319	N49-T321 WeakPolarHBondContact ND2-CG2 3.37Å; N49-T321 PolarHBondContact ND2-OG1 3.08Å; N290-T321 WeakPolarHBondContact O-CG2 3.35Å; N290-T321 PolarHBondContact O-OG1 3.22Å; N290-T321 VanDerWaalsContact O-OG1 3.07Å; A292-T321 HydrophobicContact CB-CG2 4.05Å; L295-T321 HydrophobicContact CD1-CG2 3.95Å; A317-T321 PolarHBondContact O-N 3.33Å; C318-T321 WeakPolarHBondContact O-CG2 3.35Å; I319-T321 VanDerWaalsContact C-N 3.34Å; I319-T321 PolarHBondContact O-N 3.49Å
322	Q	93.4	Very high	95.1	Very high	12 Å²	12	46.2 Å²	46.2	6%	0.056	24%	0.239	C	C	.	.			trans	-158.4	151.6	-176.1	68	85.3	28.3	0	0	111.2	N49 F51 A292 W325 H329	N49-Q322 HydrophobicContact CB-CB 3.78Å; F51-Q322 HydrophobicContact CE2-CB 4.48Å; F51-Q322 HydrophobicContact CE2-CG 4.37Å; A292-Q322 HydrophobicContact CB-CG 4.11Å; Q322-W325 PolarHBondContact NE2-O 3.1Å; Q322-W325 PolarHBondContact OE1-O 2.71Å; Q322-H329 PolarHBondContact NE2-CD2 3.31Å; Q322-H329 PolarHBondContact NE2-NE2 3.03Å; Q322-H329 PolarHBondContact O-CE1 3.19Å; Q322-H329 VanDerWaalsContact O-CE1 3.22Å; Q322-H329 PolarHBondContact O-NE2 3.22Å
323	E	91.9	Very high	95.1	Very high	172 Å²	172	45.8 Å²	45.8	80%	0.804	24%	0.237	S	C	*	.	S	Bend	trans	-128.4	-6.6	174.6	-64.6	-174.3	162.8	0	0	113.3
324	E	89.8	Confident	95	Very high	97 Å²	97	42.6 Å²	42.6	45%	0.453	22%	0.22	S	C	.	.	S	Bend	trans	-66	-42.1	-177.1	-71.5	-178	-152.6	0	0	111.9	F51 A52	F51-E324 WeakPolarHBondContact CB-OE2 3.42Å; F51-E324 HydrophobicContact CD2-CB 3.97Å; F51-E324 PolarHBondContact N-OE2 3.29Å; F51-E324 VanDerWaalsContact N-OE2 3.15Å; A52-E324 WeakPolarHBondContact CB-OE2 3.32Å; A52-E324 PolarHBondContact N-OE2 3.1Å
325	W	89.9	Confident	95	Very high	10 Å²	10	39.7 Å²	39.7	4%	0.038	21%	0.207	C	C	.	.			trans	-112.6	84.5	-175.6	-79.3	20.5	0	0	0	110.4	F46 F51 I75 M78 Q79 M82 Q322 Q327 I328	F46-W325 AromaticContact CE2-CH2 3.46Å; F46-W325 HydrophobicContact CE2-CH2 3.46Å; F46-W325 VanDerWaalsContact CE2-CH2 3.46Å; F46-W325 HydrophobicContact CE2-CZ2 4.11Å; F46-W325 AromaticContact CE2-CZ3 3.69Å; F46-W325 HydrophobicContact CE2-CZ3 3.69Å; F46-W325 AromaticContact CZ-CH2 3.99Å; F46-W325 HydrophobicContact CZ-CH2 3.99Å; F46-W325 AromaticContact CZ-CZ3 3.78Å; F46-W325 HydrophobicContact CZ-CZ3 3.78Å; F51-W325 HydrophobicContact CB-CD2 4.24Å; F51-W325 HydrophobicContact CB-CG 4.4Å; F51-W325 HydrophobicContact CB-CZ2 4.2Å; F51-W325 HydrophobicContact CD1-CD2 4.04Å; F51-W325 HydrophobicContact CD1-CE3 4.18Å; F51-W325 HydrophobicContact CD1-CZ2 4.39Å; F51-W325 HydrophobicContact CD1-CZ3 4.44Å; F51-W325 HydrophobicContact CD2-CB 3.99Å; F51-W325 AromaticContact CD2-CD1 3.66Å; F51-W325 AromaticContact CD2-CD2 3.83Å; F51-W325 HydrophobicContact CD2-CD2 3.83Å; F51-W325 AromaticContact CD2-CG 3.53Å; F51-W325 HydrophobicContact CD2-CG 3.53Å; F51-W325 HydrophobicContact CE1-CD2 4.33Å; F51-W325 HydrophobicContact CE1-CE3 4.14Å; F51-W325 HydrophobicContact CE2-CB 3.87Å; F51-W325 HydrophobicContact CE2-CD2 4.14Å; F51-W325 HydrophobicContact CE2-CE3 4.48Å; F51-W325 AromaticContact CE2-CG 3.85Å; F51-W325 HydrophobicContact CE2-CG 3.85Å; F51-W325 AromaticContact CG-CD1 3.93Å; F51-W325 AromaticContact CG-CD2 3.78Å; F51-W325 HydrophobicContact CG-CD2 3.78Å; F51-W325 AromaticContact CG-CE2 3.75Å; F51-W325 HydrophobicContact CG-CE3 4.37Å; F51-W325 AromaticContact CG-CG 3.94Å; F51-W325 HydrophobicContact CG-CG 3.94Å; F51-W325 HydrophobicContact CG-CZ2 4.37Å; F51-W325 AromaticContact CG-NE1 3.79Å; F51-W325 HydrophobicContact CZ-CD2 4.38Å; F51-W325 HydrophobicContact CZ-CE3 4.29Å; I75-W325 HydrophobicContact CG2-CH2 3.73Å; I75-W325 HydrophobicContact CG2-CZ2 3.53Å; M78-W325 HydrophobicContact CB-CH2 4.33Å; M78-W325 HydrophobicContact CB-CZ3 4.46Å; M78-W325 HydrophobicContact CE-CZ3 4.47Å; M78-W325 HydrophobicContact CG-CH2 4.46Å; M78-W325 HydrophobicContact CG-CZ3 4.11Å; M78-W325 HydrophobicContact SD-CZ3 4.13Å; Q79-W325 HydrophobicContact CB-CH2 4.29Å; Q79-W325 HydrophobicContact CB-CZ2 4.15Å; M82-W325 HydrophobicContact CE-CE3 3.65Å; M82-W325 HydrophobicContact CE-CZ3 3.67Å; Q322-W325 PolarHBondContact NE2-O 3.1Å; Q322-W325 PolarHBondContact OE1-O 2.71Å; W325-Q327 VanDerWaalsContact C-OE1 3.23Å; W325-Q327 VanDerWaalsContact CA-OE1 3.29Å; W325-Q327 PolarHBondContact O-N 3.11Å; W325-Q327 VanDerWaalsContact O-N 3.09Å; W325-I328 HydrophobicContact CB-CD1 4.17Å; W325-I328 HydrophobicContact CB-CG1 4.32Å; W325-I328 HydrophobicContact CE3-CD1 4.08Å; W325-I328 HydrophobicContact CE3-CG1 4.46Å; W325-I328 PolarHBondContact O-N 3.07Å; W325-I328 VanDerWaalsContact O-N 3.09Å
326	R	89.8	Confident	95	Very high	104 Å²	104	39.7 Å²	39.7	39%	0.392	21%	0.207	S	C	.	.	H	α-helix	trans	-56.7	-25.9	177	-163.6	69.4	-177.7	175.5	0.1	113.1	I328 H329 H330 E359	R326-I328 VanDerWaalsContact C-N 3.27Å; R326-I328 PolarHBondContact O-N 3.32Å; R326-H329 PolarHBondContact NH1-ND1 3Å; R326-H329 VanDerWaalsContact NH1-ND1 3.11Å; R326-H329 WeakPolarHBondContact O-CA 3.49Å; R326-H329 VanDerWaalsContact O-CB 3.23Å; R326-H329 WeakPolarHBondContact O-CB 3.42Å; R326-H329 PolarHBondContact O-N 3.14Å; R326-H330 PolarHBondContact O-N 3.28Å; R326-H330 VanDerWaalsContact O-N 3.15Å; R326-E359 IonicContact CZ-OE1 3.05Å; R326-E359 IonicContact CZ-OE2 3.14Å; R326-E359 IonicContact NE-OE2 2.72Å; R326-E359 PolarHBondContact NE-OE2 3.22Å; R326-E359 IonicContact NH2-OE1 3.89Å; R326-E359 PolarHBondContact NH2-OE1 3.35Å; R326-E359 IonicContact NH2-OE2 2.7Å; R326-E359 PolarHBondContact NH2-OE2 3.47Å
327	Q	87.8	Confident	95	Very high	22 Å²	22	36.3 Å²	36.3	10%	0.103	19%	0.189	C	C	.	.	H	α-helix	trans	-52.4	-42.4	174.3	-66.9	82.6	-1.4	0	0	113	M82 T83 W325 H329 H330 L331	M82-Q327 HydrophobicContact CB-CB 3.64Å; M82-Q327 HydrophobicContact CB-CG 3.89Å; M82-Q327 HydrophobicContact CE-CB 3.77Å; M82-Q327 HydrophobicContact CE-CG 4.43Å; M82-Q327 HydrophobicContact CG-CB 4.47Å; M82-Q327 HydrophobicContact SD-CB 4.08Å; T83-Q327 HydrophobicContact CG2-CG 3.24Å; W325-Q327 VanDerWaalsContact C-OE1 3.23Å; W325-Q327 VanDerWaalsContact CA-OE1 3.29Å; W325-Q327 PolarHBondContact O-N 3.11Å; W325-Q327 VanDerWaalsContact O-N 3.09Å; Q327-H329 VanDerWaalsContact C-N 3.26Å; Q327-H329 PolarHBondContact O-N 3.39Å; Q327-H330 WeakPolarHBondContact O-CB 3.46Å; Q327-H330 PolarHBondContact O-N 3.03Å; Q327-L331 PolarHBondContact O-N 3.39Å
328	I	92.5	Very high	95	Very high	2 Å²	2	35 Å²	35	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-67.3	-32.8	178	-62.6	175.4	0	0	0	110.3	F51 M82 A292 W325 R326 H330 L331 C332	F51-I328 HydrophobicContact CE2-CD1 4.21Å; F51-I328 HydrophobicContact CZ-CD1 3.69Å; M82-I328 HydrophobicContact CE-CG1 4.45Å; M82-I328 HydrophobicContact SD-CG1 4.42Å; A292-I328 HydrophobicContact CB-CD1 4.17Å; A292-I328 HydrophobicContact CB-CG2 4.19Å; W325-I328 HydrophobicContact CB-CD1 4.17Å; W325-I328 HydrophobicContact CB-CG1 4.32Å; W325-I328 HydrophobicContact CE3-CD1 4.08Å; W325-I328 HydrophobicContact CE3-CG1 4.46Å; W325-I328 PolarHBondContact O-N 3.07Å; W325-I328 VanDerWaalsContact O-N 3.09Å; R326-I328 VanDerWaalsContact C-N 3.27Å; R326-I328 PolarHBondContact O-N 3.32Å; I328-H330 VanDerWaalsContact C-N 3.3Å; I328-H330 PolarHBondContact O-N 3.27Å; I328-L331 PolarHBondContact O-N 2.7Å; I328-C332 PolarHBondContact O-N 3.12Å; I328-C332 PolarHBondContact O-SG 2.96Å
329	H	95.1	Very high	95	Very high	2 Å²	2	35 Å²	35	1%	0.009	18%	0.176	C	C	.	.	H	α-helix	trans	-64.7	-39.3	174.4	-58.5	179.3	0	0	0	110.9	I319 Q322 R326 Q327 L331 C332 F333	I319-H329 HydrophobicContact CG1-CB 4.3Å; I319-H329 PolarHBondContact O-CE1 3.49Å; I319-H329 PolarHBondContact O-NE2 3.17Å; I319-H329 VanDerWaalsContact O-NE2 3.09Å; Q322-H329 PolarHBondContact NE2-CD2 3.31Å; Q322-H329 PolarHBondContact NE2-NE2 3.03Å; Q322-H329 PolarHBondContact O-CE1 3.19Å; Q322-H329 VanDerWaalsContact O-CE1 3.22Å; Q322-H329 PolarHBondContact O-NE2 3.22Å; R326-H329 PolarHBondContact NH1-ND1 3Å; R326-H329 VanDerWaalsContact NH1-ND1 3.11Å; R326-H329 WeakPolarHBondContact O-CA 3.49Å; R326-H329 VanDerWaalsContact O-CB 3.23Å; R326-H329 WeakPolarHBondContact O-CB 3.42Å; R326-H329 PolarHBondContact O-N 3.14Å; Q327-H329 VanDerWaalsContact C-N 3.26Å; Q327-H329 PolarHBondContact O-N 3.39Å; H329-L331 VanDerWaalsContact C-N 3.32Å; H329-L331 PolarHBondContact O-N 3.25Å; H329-C332 CarbonylContact O-C 3.58Å; H329-C332 WeakPolarHBondContact O-CA 3.45Å; H329-C332 WeakPolarHBondContact O-CB 3.46Å; H329-C332 PolarHBondContact O-N 3Å; H329-C332 VanDerWaalsContact O-N 3.08Å; H329-F333 HydrophobicContact CB-CE1 4.14Å; H329-F333 HydrophobicContact CB-CE2 4.15Å; H329-F333 HydrophobicContact CB-CZ 3.81Å; H329-F333 WeakPolarHBondContact O-CD1 3.48Å; H329-F333 WeakPolarHBondContact O-CG 3.44Å; H329-F333 PolarHBondContact O-N 2.93Å
330	H	94.6	Very high	95	Very high	11 Å²	11	34.7 Å²	34.7	5%	0.051	17%	0.173	C	C	.	.	H	α-helix	trans	-64.1	-38.3	177.4	-56.8	160.3	0	0	0	112.2	R326 Q327 I328 C332 F333 W334 L356 E359 N360	R326-H330 PolarHBondContact O-N 3.28Å; R326-H330 VanDerWaalsContact O-N 3.15Å; Q327-H330 WeakPolarHBondContact O-CB 3.46Å; Q327-H330 PolarHBondContact O-N 3.03Å; I328-H330 VanDerWaalsContact C-N 3.3Å; I328-H330 PolarHBondContact O-N 3.27Å; H330-C332 VanDerWaalsContact C-N 3.32Å; H330-C332 PolarHBondContact O-N 3.28Å; H330-F333 AromaticContact CD2-CD2 3.8Å; H330-F333 AromaticContact CD2-CE2 3.8Å; H330-F333 PolarHBondContact O-N 3.24Å; H330-W334 PolarHBondContact O-N 3.01Å; H330-L356 HydrophobicContact CB-CD2 4.06Å; H330-L356 WeakPolarHBondContact O-CD2 3.32Å; H330-E359 IonicContact CD2-OE2 3.23Å; H330-E359 PolarHBondContact CE1-O 2.81Å; H330-E359 WeakPolarHBondContact NE2-CB 3.17Å; H330-E359 IonicContact NE2-OE2 3.7Å; H330-E359 PolarHBondContact NE2-OE2 3.41Å; H330-N360 HydrophobicContact CB-CB 4.28Å; H330-N360 WeakPolarHBondContact CB-ND2 3.44Å
331	L	94.3	Very high	95.1	Very high	67 Å²	67	30.7 Å²	30.7	35%	0.351	14%	0.14	S	C	.	.	H	α-helix	trans	-60.2	-43.4	170.6	-62	178.6	0	0	0	111.3	M82 F296 Q327 I328 H329 W334 E335	M82-L331 HydrophobicContact SD-CD1 3.86Å; F296-L331 HydrophobicContact CD2-CB 4.3Å; F296-L331 HydrophobicContact CE2-CB 3.57Å; F296-L331 HydrophobicContact CZ-CB 3.95Å; Q327-L331 PolarHBondContact O-N 3.39Å; I328-L331 PolarHBondContact O-N 2.7Å; H329-L331 VanDerWaalsContact C-N 3.32Å; H329-L331 PolarHBondContact O-N 3.25Å; L331-W334 WeakPolarHBondContact O-CB 3.37Å; L331-W334 PolarHBondContact O-N 3.27Å; L331-E335 WeakPolarHBondContact O-CG 3.42Å; L331-E335 PolarHBondContact O-N 2.85Å
332	C	97.8	Very high	95.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-65.1	-39.5	176	-61.9	0	0	0	0	112.3	F315 I319 I328 H329 H330 W334 E335 L336	F315-C332 HydrophobicContact CB-CB 4.25Å; F315-C332 HydrophobicContact CD1-CB 4.2Å; I319-C332 HydrophobicContact CD1-CB 3.67Å; I319-C332 HydrophobicContact CG1-CB 3.66Å; I328-C332 PolarHBondContact O-N 3.12Å; I328-C332 PolarHBondContact O-SG 2.96Å; H329-C332 CarbonylContact O-C 3.58Å; H329-C332 WeakPolarHBondContact O-CA 3.45Å; H329-C332 WeakPolarHBondContact O-CB 3.46Å; H329-C332 PolarHBondContact O-N 3Å; H329-C332 VanDerWaalsContact O-N 3.08Å; H330-C332 VanDerWaalsContact C-N 3.32Å; H330-C332 PolarHBondContact O-N 3.28Å; C332-W334 VanDerWaalsContact C-N 3.32Å; C332-W334 PolarHBondContact O-N 2.78Å; C332-E335 PolarHBondContact O-N 3.4Å; C332-L336 VanDerWaalsContact O-CB 3.31Å; C332-L336 WeakPolarHBondContact O-CB 3.46Å; C332-L336 VanDerWaalsContact O-CG 3.27Å; C332-L336 WeakPolarHBondContact O-CG 3.29Å; C332-L336 PolarHBondContact O-N 3.01Å
333	F	98.1	Very high	95.3	Very high	11 Å²	11	30.9 Å²	30.9	5%	0.048	14%	0.138	C	C	.	.	H	α-helix	trans	-62.8	-40.2	177	-61.1	-17.6	0	0	0	111.1	I319 H329 H330 L336 M337 Y352 C355 L356	I319-F333 HydrophobicContact CD1-CD1 3.89Å; I319-F333 HydrophobicContact CD1-CE1 3.66Å; I319-F333 HydrophobicContact CG1-CE1 4.27Å; H329-F333 HydrophobicContact CB-CE1 4.14Å; H329-F333 HydrophobicContact CB-CE2 4.15Å; H329-F333 HydrophobicContact CB-CZ 3.81Å; H329-F333 WeakPolarHBondContact O-CD1 3.48Å; H329-F333 WeakPolarHBondContact O-CG 3.44Å; H329-F333 PolarHBondContact O-N 2.93Å; H330-F333 AromaticContact CD2-CD2 3.8Å; H330-F333 AromaticContact CD2-CE2 3.8Å; H330-F333 PolarHBondContact O-N 3.24Å; F333-L336 PolarHBondContact O-N 3.41Å; F333-M337 VanDerWaalsContact O-CB 3.24Å; F333-M337 WeakPolarHBondContact O-CB 3.36Å; F333-M337 PolarHBondContact O-N 2.88Å; F333-Y352 HydrophobicContact CB-CD1 4.11Å; F333-Y352 AromaticContact CD1-CD1 3.55Å; F333-Y352 HydrophobicContact CD1-CD1 3.55Å; F333-Y352 AromaticContact CD1-CE1 3.94Å; F333-Y352 HydrophobicContact CD1-CE1 3.94Å; F333-Y352 HydrophobicContact CE1-CD1 4.26Å; F333-Y352 HydrophobicContact CE1-CE1 4.33Å; F333-Y352 HydrophobicContact CG-CD1 4.03Å; F333-Y352 WeakPolarHBondContact O-CB 3.45Å; F333-C355 HydrophobicContact CD2-CB 3.66Å; F333-C355 HydrophobicContact CE2-CB 3.78Å; F333-C355 HydrophobicContact CG-CB 4.33Å; F333-L356 HydrophobicContact CB-CD1 4.37Å; F333-L356 HydrophobicContact CB-CD2 4.05Å; F333-L356 HydrophobicContact CB-CG 3.89Å
334	W	96.9	Very high	95.6	Very high	46 Å²	46	24.7 Å²	24.7	17%	0.174	11%	0.109	C	C	.	.	H	α-helix	trans	-59.8	-47.3	174.2	176.6	-93.8	0	0	0	112	H330 L331 C332 M337 W338 L356 T366 Y367 W441	H330-W334 PolarHBondContact O-N 3.01Å; L331-W334 WeakPolarHBondContact O-CB 3.37Å; L331-W334 PolarHBondContact O-N 3.27Å; C332-W334 VanDerWaalsContact C-N 3.32Å; C332-W334 PolarHBondContact O-N 2.78Å; W334-M337 HydrophobicContact CD2-CE 4.26Å; W334-M337 HydrophobicContact CE3-CE 3.85Å; W334-M337 HydrophobicContact CH2-CE 4.42Å; W334-M337 HydrophobicContact CZ3-CE 3.94Å; W334-W338 AromaticContact CD2-NE1 3.94Å; W334-W338 AromaticContact CE2-CD1 3.7Å; W334-W338 AromaticContact CE2-NE1 3.3Å; W334-W338 VanDerWaalsContact CE2-NE1 3.3Å; W334-W338 AromaticContact CH2-NE1 3.75Å; W334-W338 AromaticContact CZ2-NE1 3.2Å; W334-W338 AromaticContact NE1-CD1 3.61Å; W334-W338 AromaticContact NE1-NE1 3.66Å; W334-W338 VanDerWaalsContact O-CD1 3.24Å; W334-W338 PolarHBondContact O-N 2.8Å; W334-L356 HydrophobicContact CB-CD1 4.23Å; W334-L356 HydrophobicContact CE3-CD1 4.09Å; W334-T366 HydrophobicContact CH2-CG2 4.21Å; W334-T366 HydrophobicContact CZ3-CG2 4.32Å; W334-Y367 HydrophobicContact CE3-CD1 4.26Å; W334-Y367 AromaticContact CE3-CE1 3.83Å; W334-Y367 HydrophobicContact CE3-CE1 3.83Å; W334-Y367 HydrophobicContact CZ3-CD1 4.04Å; W334-Y367 AromaticContact CZ3-CE1 3.85Å; W334-Y367 HydrophobicContact CZ3-CE1 3.85Å; W334-W441 HydrophobicContact CH2-CD2 4.45Å; W334-W441 AromaticContact CH2-CE2 3.78Å; W334-W441 HydrophobicContact CH2-CH2 4.4Å; W334-W441 AromaticContact CH2-CZ2 3.77Å; W334-W441 HydrophobicContact CH2-CZ2 3.77Å; W334-W441 AromaticContact CH2-NE1 3.93Å; W334-W441 HydrophobicContact CZ2-CD2 4Å; W334-W441 AromaticContact CZ2-CE2 3.8Å; W334-W441 HydrophobicContact CZ2-CE3 4.3Å; W334-W441 HydrophobicContact CZ2-CH2 4.26Å; W334-W441 AromaticContact CZ2-CZ2 3.95Å; W334-W441 HydrophobicContact CZ2-CZ2 3.95Å; W334-W441 HydrophobicContact CZ2-CZ3 4.43Å
335	E	97.8	Very high	96	Very high	4 Å²	4	23 Å²	23	2%	0.019	10%	0.103	C	C	.	.	H	α-helix	trans	-69.9	-40	179.5	-63.5	-69	154.5	0	0	112.5	Y262 F296 R300 F315 L331 C332 W338 A339	Y262-E335 WeakPolarHBondContact CE1-OE1 3.2Å; Y262-E335 PolarHBondContact OH-OE1 3.41Å; F296-E335 HydrophobicContact CE2-CG 3.96Å; F296-E335 HydrophobicContact CZ-CG 4.11Å; R300-E335 WeakPolarHBondContact CD-OE2 3.37Å; R300-E335 IonicContact CZ-OE1 3.26Å; R300-E335 IonicContact CZ-OE2 3.16Å; R300-E335 IonicContact NE-OE2 3.98Å; R300-E335 IonicContact NH1-OE1 3.23Å; R300-E335 PolarHBondContact NH1-OE1 3.22Å; R300-E335 IonicContact NH1-OE2 3.21Å; R300-E335 PolarHBondContact NH1-OE2 2.94Å; F315-E335 HydrophobicContact CD1-CB 4.21Å; F315-E335 HydrophobicContact CD2-CB 3.98Å; F315-E335 HydrophobicContact CE1-CB 3.64Å; F315-E335 HydrophobicContact CE1-CG 3.74Å; F315-E335 HydrophobicContact CE2-CB 3.39Å; F315-E335 HydrophobicContact CE2-CG 4.2Å; F315-E335 HydrophobicContact CG-CB 4.38Å; F315-E335 HydrophobicContact CZ-CB 3.21Å; F315-E335 HydrophobicContact CZ-CG 3.5Å; F315-E335 VanDerWaalsContact CZ-CG 3.5Å; L331-E335 WeakPolarHBondContact O-CG 3.42Å; L331-E335 PolarHBondContact O-N 2.85Å; C332-E335 PolarHBondContact O-N 3.4Å; E335-W338 PolarHBondContact O-N 3.39Å; E335-A339 WeakPolarHBondContact O-CB 3.46Å; E335-A339 PolarHBondContact O-N 3.38Å
336	L	98.7	Very high	96.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.3	-43.3	176.1	-75.9	166.5	0	0	0	111.6	Q312 F315 L316 I319 C332 F333 W338 A339 Y340 Y352	Q312-L336 HydrophobicContact CB-CD2 3.97Å; Q312-L336 HydrophobicContact CG-CD2 3.89Å; F315-L336 HydrophobicContact CB-CD1 3.95Å; F315-L336 HydrophobicContact CB-CD2 3.85Å; F315-L336 HydrophobicContact CB-CG 3.74Å; F315-L336 HydrophobicContact CD2-CD2 4.24Å; F315-L336 HydrophobicContact CD2-CG 4.27Å; F315-L336 HydrophobicContact CG-CD2 4.49Å; F315-L336 HydrophobicContact CG-CG 4.28Å; L316-L336 HydrophobicContact CD2-CD1 4.13Å; L316-L336 HydrophobicContact CG-CD1 4.44Å; I319-L336 HydrophobicContact CD1-CD1 3.79Å; C332-L336 VanDerWaalsContact O-CB 3.31Å; C332-L336 WeakPolarHBondContact O-CB 3.46Å; C332-L336 VanDerWaalsContact O-CG 3.27Å; C332-L336 WeakPolarHBondContact O-CG 3.29Å; C332-L336 PolarHBondContact O-N 3.01Å; F333-L336 PolarHBondContact O-N 3.41Å; L336-W338 VanDerWaalsContact C-N 3.28Å; L336-W338 PolarHBondContact O-N 3.5Å; L336-A339 PolarHBondContact O-N 3.26Å; L336-Y340 HydrophobicContact CB-CD2 4.48Å; L336-Y340 HydrophobicContact CB-CE2 4.44Å; L336-Y340 HydrophobicContact CD2-CE2 4.13Å; L336-Y340 WeakPolarHBondContact O-CD2 3.47Å; L336-Y340 PolarHBondContact O-N 3.39Å; L336-Y352 HydrophobicContact CB-CD1 4.11Å; L336-Y352 HydrophobicContact CB-CD2 3.76Å; L336-Y352 HydrophobicContact CB-CE1 4.22Å; L336-Y352 HydrophobicContact CB-CE2 3.95Å; L336-Y352 HydrophobicContact CB-CG 3.87Å; L336-Y352 HydrophobicContact CD1-CD1 4.06Å; L336-Y352 HydrophobicContact CD1-CE1 3.52Å; L336-Y352 HydrophobicContact CD1-CE2 4.34Å; L336-Y352 HydrophobicContact CG-CE1 4.47Å
337	M	98.6	Very high	96.8	Very high	2 Å²	2	22 Å²	22	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-53.6	-46.4	174.2	177.8	-164.6	71.9	0	0	111.2	F333 W334 S341 A349 A353 L356 Q370 I374	F333-M337 VanDerWaalsContact O-CB 3.24Å; F333-M337 WeakPolarHBondContact O-CB 3.36Å; F333-M337 PolarHBondContact O-N 2.88Å; W334-M337 HydrophobicContact CD2-CE 4.26Å; W334-M337 HydrophobicContact CE3-CE 3.85Å; W334-M337 HydrophobicContact CH2-CE 4.42Å; W334-M337 HydrophobicContact CZ3-CE 3.94Å; M337-S341 WeakPolarHBondContact O-CB 3.41Å; M337-S341 PolarHBondContact O-N 3.36Å; M337-S341 PolarHBondContact O-OG 3.25Å; M337-A349 WeakPolarHBondContact O-CB 3.49Å; M337-A353 HydrophobicContact CG-CB 4.17Å; M337-A353 HydrophobicContact SD-CB 3.81Å; M337-L356 HydrophobicContact SD-CD1 4.34Å; M337-Q370 HydrophobicContact CE-CG 3.71Å; M337-Q370 HydrophobicContact SD-CB 4.43Å; M337-Q370 HydrophobicContact SD-CG 3.53Å; M337-Q370 VanDerWaalsContact SD-CG 3.53Å; M337-I374 HydrophobicContact CG-CD1 3.63Å; M337-I374 HydrophobicContact SD-CD1 3.9Å
338	W	97.9	Very high	97.3	Very high	11 Å²	11	23.4 Å²	23.4	4%	0.042	11%	0.114	C	C	.	.	H	α-helix	trans	-71.1	-42.7	177.4	-76.3	116.3	0	0	0	113	W334 E335 L336 Y340 S341 F342 Q370 M437 M438 W441	W334-W338 AromaticContact CD2-NE1 3.94Å; W334-W338 AromaticContact CE2-CD1 3.7Å; W334-W338 AromaticContact CE2-NE1 3.3Å; W334-W338 VanDerWaalsContact CE2-NE1 3.3Å; W334-W338 AromaticContact CH2-NE1 3.75Å; W334-W338 AromaticContact CZ2-NE1 3.2Å; W334-W338 AromaticContact NE1-CD1 3.61Å; W334-W338 AromaticContact NE1-NE1 3.66Å; W334-W338 VanDerWaalsContact O-CD1 3.24Å; W334-W338 PolarHBondContact O-N 2.8Å; E335-W338 PolarHBondContact O-N 3.39Å; L336-W338 VanDerWaalsContact C-N 3.28Å; L336-W338 PolarHBondContact O-N 3.5Å; W338-Y340 VanDerWaalsContact C-N 3.33Å; W338-Y340 PolarHBondContact O-N 3.33Å; W338-S341 CarbonylContact O-C 3.58Å; W338-S341 WeakPolarHBondContact O-CA 3.37Å; W338-S341 WeakPolarHBondContact O-CB 3.31Å; W338-S341 PolarHBondContact O-N 3.19Å; W338-F342 HydrophobicContact CB-CE2 4.04Å; W338-F342 HydrophobicContact CB-CZ 4.08Å; W338-F342 HydrophobicContact CE3-CE1 4.41Å; W338-F342 WeakPolarHBondContact O-CD2 3.46Å; W338-F342 VanDerWaalsContact O-CG 3.25Å; W338-F342 WeakPolarHBondContact O-CG 3.41Å; W338-F342 PolarHBondContact O-N 3.23Å; W338-Q370 VanDerWaalsContact CH2-NE2 3.27Å; W338-M437 HydrophobicContact CH2-CB 4.03Å; W338-M438 HydrophobicContact CH2-CB 4.45Å; W338-M438 HydrophobicContact CZ3-CB 3.8Å; W338-M438 HydrophobicContact CZ3-CG 4.15Å; W338-W441 AromaticContact CE2-CD1 3.99Å; W338-W441 AromaticContact CH2-CD1 3.74Å; W338-W441 HydrophobicContact CZ2-CB 4.33Å; W338-W441 AromaticContact CZ2-CD1 3.18Å; W338-W441 AromaticContact CZ2-CG 3.91Å; W338-W441 HydrophobicContact CZ2-CG 3.91Å; W338-W441 AromaticContact CZ2-NE1 3.8Å
339	A	98.1	Very high	97.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-56.5	-46.6	177.6	0	0	0	0	0	111.6	Q312 E335 L336 F342 E343	Q312-A339 HydrophobicContact CG-CB 4.09Å; E335-A339 WeakPolarHBondContact O-CB 3.46Å; E335-A339 PolarHBondContact O-N 3.38Å; L336-A339 PolarHBondContact O-N 3.26Å; A339-F342 PolarHBondContact O-N 3.09Å; A339-E343 PolarHBondContact O-N 3.2Å
340	Y	98.6	Very high	97.7	Very high	24 Å²	24	24.6 Å²	24.6	9%	0.094	12%	0.118	C	C	.	.	H	α-helix	trans	-68.5	-34.1	174.5	-73.5	-60.1	0	0	0	112.9	Q312 L336 W338 F342 E343 Q344 N345 E348 Y352	Q312-Y340 VanDerWaalsContact CD-CE1 3.48Å; Q312-Y340 HydrophobicContact CG-CE1 4.37Å; Q312-Y340 HydrophobicContact CG-CE2 4.35Å; L336-Y340 HydrophobicContact CB-CD2 4.48Å; L336-Y340 HydrophobicContact CB-CE2 4.44Å; L336-Y340 HydrophobicContact CD2-CE2 4.13Å; L336-Y340 WeakPolarHBondContact O-CD2 3.47Å; L336-Y340 PolarHBondContact O-N 3.39Å; W338-Y340 VanDerWaalsContact C-N 3.33Å; W338-Y340 PolarHBondContact O-N 3.33Å; Y340-F342 VanDerWaalsContact C-N 3.34Å; Y340-F342 PolarHBondContact O-N 3.07Å; Y340-E343 CarbonylContact O-C 3.51Å; Y340-E343 PolarHBondContact O-N 2.88Å; Y340-Q344 PolarHBondContact O-N 2.82Å; Y340-Q344 VanDerWaalsContact O-N 3.14Å; Y340-N345 HydrophobicContact CD1-CB 4.06Å; Y340-N345 PolarHBondContact O-N 2.88Å; Y340-E348 HydrophobicContact CD1-CB 3.74Å; Y340-E348 HydrophobicContact CD1-CG 4.41Å; Y340-E348 HydrophobicContact CD2-CB 3.71Å; Y340-E348 HydrophobicContact CE1-CB 3.96Å; Y340-E348 HydrophobicContact CE1-CG 4.23Å; Y340-E348 HydrophobicContact CE2-CB 3.97Å; Y340-E348 HydrophobicContact CG-CB 3.6Å; Y340-Y352 AromaticContact CD2-CD2 3.91Å; Y340-Y352 HydrophobicContact CD2-CD2 3.91Å; Y340-Y352 AromaticContact CD2-CE2 3.75Å; Y340-Y352 HydrophobicContact CD2-CE2 3.75Å; Y340-Y352 HydrophobicContact CE2-CD2 4.03Å; Y340-Y352 AromaticContact CE2-CE2 3.39Å; Y340-Y352 HydrophobicContact CE2-CE2 3.39Å
341	S	98.4	Very high	97.9	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.007	14%	0.141	C	C	.	.	H	α-helix	trans	-64.4	-37	174.6	-61	0	0	0	0	112.3	M337 W338 E343 Q344	M337-S341 WeakPolarHBondContact O-CB 3.41Å; M337-S341 PolarHBondContact O-N 3.36Å; M337-S341 PolarHBondContact O-OG 3.25Å; W338-S341 CarbonylContact O-C 3.58Å; W338-S341 WeakPolarHBondContact O-CA 3.37Å; W338-S341 WeakPolarHBondContact O-CB 3.31Å; W338-S341 PolarHBondContact O-N 3.19Å; S341-E343 PolarHBondContact O-N 2.86Å; S341-Q344 PolarHBondContact O-N 2.86Å
342	F	97.8	Very high	98.1	Very high	7 Å²	7	28.6 Å²	28.6	3%	0.031	13%	0.128	C	C	.	.	H	α-helix	trans	-64.2	-31.6	174.8	-60.4	-40.7	0	0	0	112.4	V303 F308 W338 A339 Y340 Q344 M438 V446 V447	V303-F342 HydrophobicContact CG1-CE2 4.08Å; F308-F342 HydrophobicContact CD1-CD2 4.13Å; F308-F342 HydrophobicContact CD2-CB 4.35Å; F308-F342 HydrophobicContact CE1-CB 4.33Å; F308-F342 AromaticContact CE1-CD2 3.51Å; F308-F342 HydrophobicContact CE1-CD2 3.51Å; F308-F342 HydrophobicContact CE1-CE2 4.23Å; F308-F342 HydrophobicContact CE1-CG 4.25Å; F308-F342 HydrophobicContact CE2-CB 3.84Å; F308-F342 HydrophobicContact CZ-CB 3.83Å; F308-F342 AromaticContact CZ-CD2 3.74Å; F308-F342 HydrophobicContact CZ-CD2 3.74Å; F308-F342 HydrophobicContact CZ-CG 4.02Å; W338-F342 HydrophobicContact CB-CE2 4.04Å; W338-F342 HydrophobicContact CB-CZ 4.08Å; W338-F342 HydrophobicContact CE3-CE1 4.41Å; W338-F342 WeakPolarHBondContact O-CD2 3.46Å; W338-F342 VanDerWaalsContact O-CG 3.25Å; W338-F342 WeakPolarHBondContact O-CG 3.41Å; W338-F342 PolarHBondContact O-N 3.23Å; A339-F342 PolarHBondContact O-N 3.09Å; Y340-F342 VanDerWaalsContact C-N 3.34Å; Y340-F342 PolarHBondContact O-N 3.07Å; F342-Q344 VanDerWaalsContact C-N 3.27Å; F342-M438 HydrophobicContact CD1-CG 4.27Å; F342-M438 HydrophobicContact CD1-SD 3.62Å; F342-M438 HydrophobicContact CE1-CG 3.82Å; F342-M438 HydrophobicContact CE1-SD 3.81Å; F342-V446 HydrophobicContact CD2-CG1 4.28Å; F342-V446 HydrophobicContact CE2-CB 4.33Å; F342-V446 HydrophobicContact CE2-CG1 3.86Å; F342-V446 HydrophobicContact CZ-CB 4.21Å; F342-V446 HydrophobicContact CZ-CG1 4.24Å; F342-V447 HydrophobicContact CB-CB 4.38Å; F342-V447 HydrophobicContact CB-CG2 4.17Å; F342-V447 HydrophobicContact CD1-CB 4.18Å; F342-V447 HydrophobicContact CG-CB 4.46Å
343	E	97.7	Very high	98.1	Very high	56 Å²	56	28.6 Å²	28.6	26%	0.262	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	1	173.8	-64.3	-179.3	135.9	0	0	113	F308 Q312 A339 Y340 S341 N345 L453	F308-E343 HydrophobicContact CB-CG 4.37Å; F308-E343 HydrophobicContact CD2-CG 4.08Å; Q312-E343 PolarHBondContact NE2-OE2 3.39Å; A339-E343 PolarHBondContact O-N 3.2Å; Y340-E343 CarbonylContact O-C 3.51Å; Y340-E343 PolarHBondContact O-N 2.88Å; S341-E343 PolarHBondContact O-N 2.86Å; E343-N345 PolarHBondContact O-N 3.21Å; E343-N345 VanDerWaalsContact O-N 3.16Å; E343-L453 HydrophobicContact CG-CD1 4Å
344	Q	97.7	Very high	98	Very high	42 Å²	42	29 Å²	29	20%	0.196	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	25.1	-171.8	-57.8	-174.6	89.8	0	0	113.6	Y340 S341 F342 W346 G456 I457 T460	Y340-Q344 PolarHBondContact O-N 2.82Å; Y340-Q344 VanDerWaalsContact O-N 3.14Å; S341-Q344 PolarHBondContact O-N 2.86Å; F342-Q344 VanDerWaalsContact C-N 3.27Å; Q344-W346 HydrophobicContact CB-CZ2 3.98Å; Q344-W346 HydrophobicContact CG-CZ2 3.82Å; Q344-W346 VanDerWaalsContact O-CD1 3.26Å; Q344-W346 PolarHBondContact O-N 2.92Å; Q344-W346 PolarHBondContact O-NE1 3.41Å; Q344-G456 PolarHBondContact NE2-O 2.99Å; Q344-G456 VanDerWaalsContact NE2-O 3.15Å; Q344-I457 HydrophobicContact CG-CG1 4.05Å; Q344-T460 PolarHBondContact OE1-OG1 3.43Å
345	N	97.9	Very high	98	Very high	61 Å²	61	28.3 Å²	28.3	33%	0.326	13%	0.133	S	C	.	.			trans	-82.5	74.2	170.1	-173	-13.4	0	0	0	109.4	Y340 E343 T347 E348 A349	Y340-N345 HydrophobicContact CD1-CB 4.06Å; Y340-N345 PolarHBondContact O-N 2.88Å; E343-N345 PolarHBondContact O-N 3.21Å; E343-N345 VanDerWaalsContact O-N 3.16Å; N345-T347 PolarHBondContact O-N 3.37Å; N345-E348 PolarHBondContact O-N 3.39Å; N345-E348 PolarHBondContact OD1-N 3.18Å; N345-A349 WeakPolarHBondContact O-CB 3.48Å; N345-A349 PolarHBondContact O-N 2.99Å
346	W	98.3	Very high	97.9	Very high	25 Å²	25	28.1 Å²	28.1	10%	0.095	13%	0.132	C	C	.	.	H	α-helix	trans	-63.4	-28.6	-173.4	-54.3	118.2	0	0	0	113.4	Q344 Y350 I374 M377 L378 A434 L435	Q344-W346 HydrophobicContact CB-CZ2 3.98Å; Q344-W346 HydrophobicContact CG-CZ2 3.82Å; Q344-W346 VanDerWaalsContact O-CD1 3.26Å; Q344-W346 PolarHBondContact O-N 2.92Å; Q344-W346 PolarHBondContact O-NE1 3.41Å; W346-Y350 VanDerWaalsContact O-CB 3.23Å; W346-Y350 WeakPolarHBondContact O-CB 3.39Å; W346-Y350 PolarHBondContact O-N 3.07Å; W346-I374 HydrophobicContact CB-CG2 4.29Å; W346-I374 HydrophobicContact CE3-CG2 4.26Å; W346-I374 VanDerWaalsContact O-CG2 3.29Å; W346-I374 WeakPolarHBondContact O-CG2 3.44Å; W346-M377 HydrophobicContact CD2-CB 3.56Å; W346-M377 HydrophobicContact CD2-CG 4.09Å; W346-M377 HydrophobicContact CE3-CB 4.07Å; W346-M377 HydrophobicContact CE3-CG 4.13Å; W346-M377 HydrophobicContact CG-CB 3.8Å; W346-M377 HydrophobicContact CH2-CG 4.13Å; W346-M377 HydrophobicContact CZ2-CB 4.08Å; W346-M377 HydrophobicContact CZ2-CE 4.02Å; W346-M377 HydrophobicContact CZ2-CG 4.07Å; W346-M377 HydrophobicContact CZ3-CG 4.16Å; W346-L378 HydrophobicContact CB-CD1 4.42Å; W346-L378 HydrophobicContact CB-CD2 3.65Å; W346-L378 HydrophobicContact CB-CG 3.71Å; W346-A434 HydrophobicContact CH2-CB 4.11Å; W346-A434 HydrophobicContact CZ3-CB 3.78Å; W346-L435 HydrophobicContact CH2-CD2 3.91Å; W346-L435 HydrophobicContact CZ2-CD2 4.33Å
347	T	97.8	Very high	97.7	Very high	68 Å²	68	28.9 Å²	28.9	42%	0.417	14%	0.137	S	C	.	.	H	α-helix	trans	-67	-48.9	178.4	-55.7	0	0	0	0	111.8	N345 Y350 R351	N345-T347 PolarHBondContact O-N 3.37Å; T347-Y350 WeakPolarHBondContact O-CB 3.29Å; T347-Y350 PolarHBondContact O-N 3.23Å; T347-R351 PolarHBondContact O-N 2.88Å
348	E	97.9	Very high	97.4	Very high	52 Å²	52	35.8 Å²	35.8	24%	0.243	17%	0.167	C	C	.	.	H	α-helix	trans	-70.6	-37.4	175.8	-71.5	-57.4	122.4	0	0	111.3	Y340 N345 Y350 R351 Y352	Y340-E348 HydrophobicContact CD1-CB 3.74Å; Y340-E348 HydrophobicContact CD1-CG 4.41Å; Y340-E348 HydrophobicContact CD2-CB 3.71Å; Y340-E348 HydrophobicContact CE1-CB 3.96Å; Y340-E348 HydrophobicContact CE1-CG 4.23Å; Y340-E348 HydrophobicContact CE2-CB 3.97Å; Y340-E348 HydrophobicContact CG-CB 3.6Å; N345-E348 PolarHBondContact O-N 3.39Å; N345-E348 PolarHBondContact OD1-N 3.18Å; E348-Y350 VanDerWaalsContact C-N 3.28Å; E348-Y350 PolarHBondContact O-N 3.21Å; E348-R351 WeakPolarHBondContact O-CB 3.36Å; E348-R351 PolarHBondContact O-N 2.88Å; E348-R351 VanDerWaalsContact O-N 3.15Å; E348-R351 IonicContact OE2-NH1 3.3Å; E348-Y352 WeakPolarHBondContact O-CD2 3.37Å; E348-Y352 PolarHBondContact O-N 3.37Å
349	A	98.6	Very high	97.1	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-57.7	-42.9	173.6	0	0	0	0	0	111.7	M337 N345 R351 Y352 A353 I374	M337-A349 WeakPolarHBondContact O-CB 3.49Å; N345-A349 WeakPolarHBondContact O-CB 3.48Å; N345-A349 PolarHBondContact O-N 2.99Å; A349-R351 VanDerWaalsContact C-N 3.35Å; A349-R351 PolarHBondContact O-N 2.99Å; A349-Y352 PolarHBondContact O-N 2.95Å; A349-A353 WeakPolarHBondContact O-CB 3.08Å; A349-A353 PolarHBondContact O-N 2.93Å; A349-I374 HydrophobicContact CB-CD1 4.16Å; A349-I374 HydrophobicContact CB-CG2 4.06Å
350	Y	98.4	Very high	96.6	Very high	28 Å²	28	39.3 Å²	39.3	11%	0.11	18%	0.184	C	C	.	.	H	α-helix	trans	-59.3	-43.6	175.8	160.5	-103.6	0	0	0	111.9	W346 T347 E348 Y352 A353 D354 K371 L375 T386 E388	W346-Y350 VanDerWaalsContact O-CB 3.23Å; W346-Y350 WeakPolarHBondContact O-CB 3.39Å; W346-Y350 PolarHBondContact O-N 3.07Å; T347-Y350 WeakPolarHBondContact O-CB 3.29Å; T347-Y350 PolarHBondContact O-N 3.23Å; E348-Y350 VanDerWaalsContact C-N 3.28Å; E348-Y350 PolarHBondContact O-N 3.21Å; Y350-Y352 VanDerWaalsContact C-N 3.3Å; Y350-Y352 PolarHBondContact O-N 3.28Å; Y350-A353 PolarHBondContact O-N 3.24Å; Y350-A353 VanDerWaalsContact O-N 3.16Å; Y350-D354 HydrophobicContact CE2-CB 4.2Å; Y350-D354 WeakPolarHBondContact O-CB 3.27Å; Y350-D354 PolarHBondContact O-N 2.9Å; Y350-K371 HydrophobicContact CD2-CG 4.17Å; Y350-K371 HydrophobicContact CE2-CD 4.41Å; Y350-K371 HydrophobicContact CE2-CG 4.09Å; Y350-L375 HydrophobicContact CD2-CD1 4.1Å; Y350-L375 HydrophobicContact CD2-CD2 3.48Å; Y350-L375 VanDerWaalsContact CD2-CD2 3.48Å; Y350-L375 HydrophobicContact CD2-CG 3.66Å; Y350-L375 HydrophobicContact CE2-CD1 3.9Å; Y350-L375 HydrophobicContact CE2-CD2 3.68Å; Y350-L375 HydrophobicContact CE2-CG 3.94Å; Y350-L375 HydrophobicContact CG-CD2 4Å; Y350-T386 HydrophobicContact CD1-CG2 4.2Å; Y350-T386 HydrophobicContact CE1-CG2 3.71Å; Y350-E388 HydrophobicContact CE2-CG 3.99Å; Y350-E388 WeakPolarHBondContact OH-CG 3.5Å; Y350-E388 PolarHBondContact OH-OE1 2.96Å
351	R	98.1	Very high	96	Very high	144 Å²	144	43.7 Å²	43.7	54%	0.543	20%	0.204	S	C	.	.	H	α-helix	trans	-54.8	-46.2	180	-175.7	-177.7	-179.8	173.9	1	111.9	T347 E348 A349 D354 C355	T347-R351 PolarHBondContact O-N 2.88Å; E348-R351 WeakPolarHBondContact O-CB 3.36Å; E348-R351 PolarHBondContact O-N 2.88Å; E348-R351 VanDerWaalsContact O-N 3.15Å; E348-R351 IonicContact OE2-NH1 3.3Å; A349-R351 VanDerWaalsContact C-N 3.35Å; A349-R351 PolarHBondContact O-N 2.99Å; R351-D354 PolarHBondContact O-N 3.22Å; R351-C355 PolarHBondContact O-N 2.92Å; R351-C355 VanDerWaalsContact O-N 3.12Å; R351-C355 PolarHBondContact O-SG 2.64Å; R351-C355 VanDerWaalsContact O-SG 3.41Å
352	Y	98.3	Very high	95.3	Very high	18 Å²	18	47.6 Å²	47.6	7%	0.071	22%	0.218	C	C	.	.	H	α-helix	trans	-75.4	-34.6	178.7	-64.7	-71.2	0	0	0	112.9	L316 F333 L336 Y340 E348 A349 Y350 D354 C355 L356	L316-Y352 WeakPolarHBondContact CD2-OH 3.44Å; F333-Y352 HydrophobicContact CB-CD1 4.11Å; F333-Y352 AromaticContact CD1-CD1 3.55Å; F333-Y352 HydrophobicContact CD1-CD1 3.55Å; F333-Y352 AromaticContact CD1-CE1 3.94Å; F333-Y352 HydrophobicContact CD1-CE1 3.94Å; F333-Y352 HydrophobicContact CE1-CD1 4.26Å; F333-Y352 HydrophobicContact CE1-CE1 4.33Å; F333-Y352 HydrophobicContact CG-CD1 4.03Å; F333-Y352 WeakPolarHBondContact O-CB 3.45Å; L336-Y352 HydrophobicContact CB-CD1 4.11Å; L336-Y352 HydrophobicContact CB-CD2 3.76Å; L336-Y352 HydrophobicContact CB-CE1 4.22Å; L336-Y352 HydrophobicContact CB-CE2 3.95Å; L336-Y352 HydrophobicContact CB-CG 3.87Å; L336-Y352 HydrophobicContact CD1-CD1 4.06Å; L336-Y352 HydrophobicContact CD1-CE1 3.52Å; L336-Y352 HydrophobicContact CD1-CE2 4.34Å; L336-Y352 HydrophobicContact CG-CE1 4.47Å; Y340-Y352 AromaticContact CD2-CD2 3.91Å; Y340-Y352 HydrophobicContact CD2-CD2 3.91Å; Y340-Y352 AromaticContact CD2-CE2 3.75Å; Y340-Y352 HydrophobicContact CD2-CE2 3.75Å; Y340-Y352 HydrophobicContact CE2-CD2 4.03Å; Y340-Y352 AromaticContact CE2-CE2 3.39Å; Y340-Y352 HydrophobicContact CE2-CE2 3.39Å; E348-Y352 WeakPolarHBondContact O-CD2 3.37Å; E348-Y352 PolarHBondContact O-N 3.37Å; A349-Y352 PolarHBondContact O-N 2.95Å; Y350-Y352 VanDerWaalsContact C-N 3.3Å; Y350-Y352 PolarHBondContact O-N 3.28Å; Y352-D354 VanDerWaalsContact C-N 3.28Å; Y352-D354 PolarHBondContact O-N 3.1Å; Y352-C355 PolarHBondContact O-N 3.17Å; Y352-L356 WeakPolarHBondContact O-CG 3.49Å; Y352-L356 PolarHBondContact O-N 3.47Å
353	A	97.9	Very high	94.9	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-60.8	-39	172	0	0	0	0	0	111.9	M337 A349 Y350 L356 C357 K371 I374	M337-A353 HydrophobicContact CG-CB 4.17Å; M337-A353 HydrophobicContact SD-CB 3.81Å; A349-A353 WeakPolarHBondContact O-CB 3.08Å; A349-A353 PolarHBondContact O-N 2.93Å; Y350-A353 PolarHBondContact O-N 3.24Å; Y350-A353 VanDerWaalsContact O-N 3.16Å; A353-L356 PolarHBondContact O-N 3.34Å; A353-C357 PolarHBondContact O-N 3.29Å; A353-C357 PolarHBondContact O-SG 3.45Å; A353-K371 HydrophobicContact CB-CB 4.09Å; A353-I374 HydrophobicContact CB-CD1 3.93Å
354	D	97.7	Very high	94.7	Very high	19 Å²	19	47.2 Å²	47.2	10%	0.102	22%	0.217	C	C	.	.	H	α-helix	trans	-67.2	-44.4	175.8	-178	51.7	0	0	0	112.3	Y350 R351 Y352 L356 C357 K358 K371	Y350-D354 HydrophobicContact CE2-CB 4.2Å; Y350-D354 WeakPolarHBondContact O-CB 3.27Å; Y350-D354 PolarHBondContact O-N 2.9Å; R351-D354 PolarHBondContact O-N 3.22Å; Y352-D354 VanDerWaalsContact C-N 3.28Å; Y352-D354 PolarHBondContact O-N 3.1Å; D354-L356 VanDerWaalsContact C-N 3.32Å; D354-L356 PolarHBondContact O-N 3.39Å; D354-C357 PolarHBondContact O-N 3.01Å; D354-K358 WeakPolarHBondContact O-CB 3.16Å; D354-K358 WeakPolarHBondContact O-CG 3.25Å; D354-K358 PolarHBondContact O-N 3.28Å; D354-K358 WeakPolarHBondContact OD1-CE 3.39Å; D354-K358 IonicContact OD1-NZ 2.66Å; D354-K358 PolarHBondContact OD1-NZ 2.9Å; D354-K358 VanDerWaalsContact OD2-CE 3.32Å; D354-K358 WeakPolarHBondContact OD2-CE 3.27Å; D354-K358 IonicContact OD2-NZ 2.85Å; D354-K358 PolarHBondContact OD2-NZ 2.88Å; D354-K371 HydrophobicContact CB-CD 4.46Å; D354-K371 WeakPolarHBondContact OD1-CE 3.45Å; D354-K371 IonicContact OD1-NZ 3.08Å; D354-K371 PolarHBondContact OD1-NZ 2.97Å
355	C	96.6	Very high	94.6	Very high	31 Å²	31	45.2 Å²	45.2	21%	0.209	21%	0.208	C	C	.	.	H	α-helix	trans	-55.9	-45.7	172.1	-72.8	0	0	0	0	111.9	F333 R351 Y352 K358 E359	F333-C355 HydrophobicContact CD2-CB 3.66Å; F333-C355 HydrophobicContact CE2-CB 3.78Å; F333-C355 HydrophobicContact CG-CB 4.33Å; R351-C355 PolarHBondContact O-N 2.92Å; R351-C355 VanDerWaalsContact O-N 3.12Å; R351-C355 PolarHBondContact O-SG 2.64Å; R351-C355 VanDerWaalsContact O-SG 3.41Å; Y352-C355 PolarHBondContact O-N 3.17Å; C355-K358 PolarHBondContact O-N 2.89Å; C355-E359 VanDerWaalsContact O-CB 3.3Å; C355-E359 WeakPolarHBondContact O-CB 3.31Å; C355-E359 WeakPolarHBondContact O-CG 3.46Å; C355-E359 PolarHBondContact O-N 3.26Å
356	L	95.3	Very high	94.5	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-60.8	-46	176.5	-75.4	168.5	0	0	0	112.4	H330 F333 W334 M337 Y352 A353 D354 K358 N360 Y367	H330-L356 HydrophobicContact CB-CD2 4.06Å; H330-L356 WeakPolarHBondContact O-CD2 3.32Å; F333-L356 HydrophobicContact CB-CD1 4.37Å; F333-L356 HydrophobicContact CB-CD2 4.05Å; F333-L356 HydrophobicContact CB-CG 3.89Å; W334-L356 HydrophobicContact CB-CD1 4.23Å; W334-L356 HydrophobicContact CE3-CD1 4.09Å; M337-L356 HydrophobicContact SD-CD1 4.34Å; Y352-L356 WeakPolarHBondContact O-CG 3.49Å; Y352-L356 PolarHBondContact O-N 3.47Å; A353-L356 PolarHBondContact O-N 3.34Å; D354-L356 VanDerWaalsContact C-N 3.32Å; D354-L356 PolarHBondContact O-N 3.39Å; L356-K358 VanDerWaalsContact C-N 3.3Å; L356-K358 PolarHBondContact O-N 3.36Å; L356-N360 HydrophobicContact CD2-CB 4.38Å; L356-N360 PolarHBondContact O-N 2.97Å; L356-Y367 HydrophobicContact CB-CD1 4.22Å; L356-Y367 HydrophobicContact CB-CD2 4.45Å; L356-Y367 HydrophobicContact CB-CG 4.13Å; L356-Y367 HydrophobicContact CD1-CD1 4.35Å; L356-Y367 HydrophobicContact CD1-CE1 4.49Å; L356-Y367 HydrophobicContact CD2-CE1 4.46Å
357	C	94	Very high	94.4	Very high	16 Å²	16	42.1 Å²	42.1	11%	0.108	19%	0.193	C	C	.	.	H	α-helix	trans	-59.7	-41.8	178	-69.3	0	0	0	0	112.1	A353 D354 Q364 Y367 K371	A353-C357 PolarHBondContact O-N 3.29Å; A353-C357 PolarHBondContact O-SG 3.45Å; D354-C357 PolarHBondContact O-N 3.01Å; C357-Q364 PolarHBondContact O-NE2 2.96Å; C357-Y367 PolarHBondContact SG-O 3.4Å; C357-K371 HydrophobicContact CB-CD 4.31Å
358	K	92.8	Very high	94.4	Very high	147 Å²	147	39.1 Å²	39.1	64%	0.639	17%	0.174	S	C	*	.	H	α-helix	trans	-76.9	-35.8	-176.6	-73.4	172.1	175.8	165.9	0	113.1	D354 C355 L356	D354-K358 WeakPolarHBondContact O-CB 3.16Å; D354-K358 WeakPolarHBondContact O-CG 3.25Å; D354-K358 PolarHBondContact O-N 3.28Å; D354-K358 WeakPolarHBondContact OD1-CE 3.39Å; D354-K358 IonicContact OD1-NZ 2.66Å; D354-K358 PolarHBondContact OD1-NZ 2.9Å; D354-K358 VanDerWaalsContact OD2-CE 3.32Å; D354-K358 WeakPolarHBondContact OD2-CE 3.27Å; D354-K358 IonicContact OD2-NZ 2.85Å; D354-K358 PolarHBondContact OD2-NZ 2.88Å; C355-K358 PolarHBondContact O-N 2.89Å; L356-K358 VanDerWaalsContact C-N 3.3Å; L356-K358 PolarHBondContact O-N 3.36Å
359	E	91.2	Very high	94.4	Very high	77 Å²	77	36.7 Å²	36.7	36%	0.36	16%	0.163	S	C	.	.	H	α-helix	trans	-108.5	-24.8	-166.8	-58.4	-175.1	-159.4	0	0	114.8	R326 H330 C355	R326-E359 IonicContact CZ-OE1 3.05Å; R326-E359 IonicContact CZ-OE2 3.14Å; R326-E359 IonicContact NE-OE2 2.72Å; R326-E359 PolarHBondContact NE-OE2 3.22Å; R326-E359 IonicContact NH2-OE1 3.89Å; R326-E359 PolarHBondContact NH2-OE1 3.35Å; R326-E359 IonicContact NH2-OE2 2.7Å; R326-E359 PolarHBondContact NH2-OE2 3.47Å; H330-E359 IonicContact CD2-OE2 3.23Å; H330-E359 PolarHBondContact CE1-O 2.81Å; H330-E359 WeakPolarHBondContact NE2-CB 3.17Å; H330-E359 IonicContact NE2-OE2 3.7Å; H330-E359 PolarHBondContact NE2-OE2 3.41Å; C355-E359 VanDerWaalsContact O-CB 3.3Å; C355-E359 WeakPolarHBondContact O-CB 3.31Å; C355-E359 WeakPolarHBondContact O-CG 3.46Å; C355-E359 PolarHBondContact O-N 3.26Å
360	N	88.3	Confident	94.4	Very high	8 Å²	8	36.7 Å²	36.7	4%	0.043	16%	0.163	C	C	.	.			trans	-116.2	123.6	-170.3	-170.2	-20.5	0	0	0	113.4	H330 L356 W362 Q364 Y367	H330-N360 HydrophobicContact CB-CB 4.28Å; H330-N360 WeakPolarHBondContact CB-ND2 3.44Å; L356-N360 HydrophobicContact CD2-CB 4.38Å; L356-N360 PolarHBondContact O-N 2.97Å; N360-W362 WeakPolarHBondContact OD1-CB 3.12Å; N360-W362 PolarHBondContact OD1-N 3.22Å; N360-Q364 PolarHBondContact O-NE2 3.4Å; N360-Y367 HydrophobicContact CB-CD2 4.5Å; N360-Y367 HydrophobicContact CB-CE2 3.86Å; N360-Y367 PolarHBondContact ND2-OH 3.24Å; N360-Y367 WeakPolarHBondContact O-CD2 3.49Å; N360-Y367 WeakPolarHBondContact O-CE2 3.29Å
361	K	84.6	Confident	94.4	Very high	116 Å²	116	35.8 Å²	35.8	50%	0.504	16%	0.159	S	C	.	.			trans	-89.4	-6.1	-178.8	-62.7	179.4	-171.2	164.4	0	115.2	D85 S363	D85-K361 IonicContact OD2-NZ 3.89Å; D85-K361 PolarHBondContact OD2-NZ 3.06Å; K361-S363 PolarHBondContact O-N 2.8Å
362	W	84.9	Confident	94.4	Very high	83 Å²	83	29 Å²	29	31%	0.314	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-37.8	-170.9	176.7	-88.1	0	0	0	115.2	A81 F84 L152 N360 Y367 L402	A81-W362 WeakPolarHBondContact O-CZ3 3.39Å; F84-W362 HydrophobicContact CB-CB 4.4Å; F84-W362 HydrophobicContact CB-CD2 4.33Å; F84-W362 HydrophobicContact CB-CE3 3.6Å; F84-W362 HydrophobicContact CB-CZ3 4.19Å; F84-W362 HydrophobicContact CD2-CD2 4.41Å; F84-W362 AromaticContact CD2-CE3 3.54Å; F84-W362 HydrophobicContact CD2-CE3 3.54Å; F84-W362 AromaticContact CD2-CH2 3.94Å; F84-W362 HydrophobicContact CD2-CH2 3.94Å; F84-W362 AromaticContact CD2-CZ3 3.26Å; F84-W362 HydrophobicContact CD2-CZ3 3.26Å; F84-W362 HydrophobicContact CE2-CE3 4.48Å; F84-W362 HydrophobicContact CE2-CH2 4.15Å; F84-W362 AromaticContact CE2-CZ3 3.92Å; F84-W362 HydrophobicContact CE2-CZ3 3.92Å; F84-W362 AromaticContact CG-CE3 3.93Å; F84-W362 HydrophobicContact CG-CE3 3.93Å; F84-W362 HydrophobicContact CG-CZ3 4.12Å; L152-W362 HydrophobicContact CD1-CH2 4.4Å; L152-W362 HydrophobicContact CD2-CH2 4.41Å; N360-W362 WeakPolarHBondContact OD1-CB 3.12Å; N360-W362 PolarHBondContact OD1-N 3.22Å; W362-Y367 HydrophobicContact CB-CE2 4.48Å; W362-L402 WeakPolarHBondContact O-CD1 3.45Å
363	S	89.7	Confident	94.4	Very high	9 Å²	9	28.1 Å²	28.1	6%	0.063	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-152.3	64.8	177.5	-170.5	0	0	0	0	110.9	K361 A365 T366 Y367 E412	K361-S363 PolarHBondContact O-N 2.8Å; S363-A365 VanDerWaalsContact C-N 3.3Å; S363-A365 PolarHBondContact O-N 3.33Å; S363-T366 WeakPolarHBondContact O-CB 3.24Å; S363-T366 PolarHBondContact O-N 3.26Å; S363-T366 VanDerWaalsContact OG-CB 3.23Å; S363-T366 WeakPolarHBondContact OG-CB 3.23Å; S363-T366 PolarHBondContact OG-OG1 3.02Å; S363-Y367 WeakPolarHBondContact O-CD2 3.45Å; S363-Y367 PolarHBondContact O-N 3.31Å; S363-E412 WeakPolarHBondContact CA-OE1 3.3Å; S363-E412 WeakPolarHBondContact CB-OE1 3.46Å; S363-E412 PolarHBondContact OG-OE1 3.4Å
364	Q	92.4	Very high	94.4	Very high	45 Å²	45	28 Å²	28	21%	0.21	13%	0.13	C	C	.	.	H	α-helix	trans	-54.6	-41.6	-175.2	-82.8	-74.5	-33.8	0	0	113.5	C357 N360 T366 Y367 V368 L400	C357-Q364 PolarHBondContact O-NE2 2.96Å; N360-Q364 PolarHBondContact O-NE2 3.4Å; Q364-T366 VanDerWaalsContact C-N 3.33Å; Q364-T366 PolarHBondContact O-N 3.39Å; Q364-Y367 PolarHBondContact O-N 3.38Å; Q364-V368 WeakPolarHBondContact O-CB 3.48Å; Q364-V368 WeakPolarHBondContact O-CG2 3.14Å; Q364-V368 PolarHBondContact O-N 3.44Å; Q364-L400 HydrophobicContact CB-CB 4.25Å; Q364-L400 HydrophobicContact CB-CD2 4.47Å
365	A	95.4	Very high	94.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59.3	-42.6	174.9	0	0	0	0	0	112.4	S363 F369 V397 L400 R401 E412	S363-A365 VanDerWaalsContact C-N 3.3Å; S363-A365 PolarHBondContact O-N 3.33Å; A365-F369 VanDerWaalsContact O-CB 3.26Å; A365-F369 WeakPolarHBondContact O-CB 3.34Å; A365-F369 PolarHBondContact O-N 2.96Å; A365-F369 VanDerWaalsContact O-N 3.08Å; A365-V397 HydrophobicContact CB-CG1 4.24Å; A365-L400 HydrophobicContact CB-CB 3.99Å; A365-R401 HydrophobicContact CB-CG 4.17Å; A365-E412 HydrophobicContact CB-CB 4.06Å; A365-E412 HydrophobicContact CB-CG 3.94Å
366	T	95.4	Very high	94.6	Very high	3 Å²	3	27.8 Å²	27.8	2%	0.018	13%	0.13	C	C	.	.	H	α-helix	trans	-67.5	-46.8	177.1	-57.3	0	0	0	0	111.1	W334 S363 Q364 V368 F369 Q370 E412 W441	W334-T366 HydrophobicContact CH2-CG2 4.21Å; W334-T366 HydrophobicContact CZ3-CG2 4.32Å; S363-T366 WeakPolarHBondContact O-CB 3.24Å; S363-T366 PolarHBondContact O-N 3.26Å; S363-T366 VanDerWaalsContact OG-CB 3.23Å; S363-T366 WeakPolarHBondContact OG-CB 3.23Å; S363-T366 PolarHBondContact OG-OG1 3.02Å; Q364-T366 VanDerWaalsContact C-N 3.33Å; Q364-T366 PolarHBondContact O-N 3.39Å; T366-V368 PolarHBondContact O-N 3.19Å; T366-F369 PolarHBondContact O-N 3.28Å; T366-Q370 VanDerWaalsContact O-CB 3.29Å; T366-Q370 WeakPolarHBondContact O-CB 3.41Å; T366-Q370 PolarHBondContact O-N 3.16Å; T366-E412 WeakPolarHBondContact OG1-CG 3.34Å; T366-W441 HydrophobicContact CG2-CZ2 4.3Å
367	Y	96.3	Very high	94.7	Very high	19 Å²	19	29.2 Å²	29.2	8%	0.075	14%	0.137	C	C	.	.	H	α-helix	trans	-61.3	-47.2	-178	-57.7	-34.2	0	0	0	111.5	W334 L356 C357 N360 W362 S363 Q364 Q370 K371	W334-Y367 HydrophobicContact CE3-CD1 4.26Å; W334-Y367 AromaticContact CE3-CE1 3.83Å; W334-Y367 HydrophobicContact CE3-CE1 3.83Å; W334-Y367 HydrophobicContact CZ3-CD1 4.04Å; W334-Y367 AromaticContact CZ3-CE1 3.85Å; W334-Y367 HydrophobicContact CZ3-CE1 3.85Å; L356-Y367 HydrophobicContact CB-CD1 4.22Å; L356-Y367 HydrophobicContact CB-CD2 4.45Å; L356-Y367 HydrophobicContact CB-CG 4.13Å; L356-Y367 HydrophobicContact CD1-CD1 4.35Å; L356-Y367 HydrophobicContact CD1-CE1 4.49Å; L356-Y367 HydrophobicContact CD2-CE1 4.46Å; C357-Y367 PolarHBondContact SG-O 3.4Å; N360-Y367 HydrophobicContact CB-CD2 4.5Å; N360-Y367 HydrophobicContact CB-CE2 3.86Å; N360-Y367 PolarHBondContact ND2-OH 3.24Å; N360-Y367 WeakPolarHBondContact O-CD2 3.49Å; N360-Y367 WeakPolarHBondContact O-CE2 3.29Å; W362-Y367 HydrophobicContact CB-CE2 4.48Å; S363-Y367 WeakPolarHBondContact O-CD2 3.45Å; S363-Y367 PolarHBondContact O-N 3.31Å; Q364-Y367 PolarHBondContact O-N 3.38Å; Y367-Q370 PolarHBondContact O-N 2.99Å; Y367-K371 WeakPolarHBondContact O-CB 3.37Å; Y367-K371 PolarHBondContact O-N 3.18Å
368	V	98	Very high	94.8	Very high	5 Å²	5	29.5 Å²	29.5	3%	0.03	14%	0.137	C	C	.	.	H	α-helix	trans	-63.8	-43.9	178.4	169.3	0	0	0	0	111.6	Q364 T366 Q370 K371 A372 L393 Q396 V397 L400	Q364-V368 WeakPolarHBondContact O-CB 3.48Å; Q364-V368 WeakPolarHBondContact O-CG2 3.14Å; Q364-V368 PolarHBondContact O-N 3.44Å; T366-V368 PolarHBondContact O-N 3.19Å; V368-Q370 VanDerWaalsContact C-N 3.33Å; V368-Q370 PolarHBondContact O-N 3.36Å; V368-K371 PolarHBondContact O-N 2.71Å; V368-A372 WeakPolarHBondContact O-CB 3.37Å; V368-A372 PolarHBondContact O-N 3.49Å; V368-L393 HydrophobicContact CG1-CB 4.27Å; V368-L393 HydrophobicContact CG1-CD2 4.38Å; V368-L393 WeakPolarHBondContact CG1-O 3.48Å; V368-Q396 HydrophobicContact CG1-CG 3.83Å; V368-V397 HydrophobicContact CG1-CG2 3.93Å; V368-L400 HydrophobicContact CB-CD1 4.11Å; V368-L400 HydrophobicContact CG1-CD1 4.38Å; V368-L400 HydrophobicContact CG2-CD1 3.68Å
369	F	98.4	Very high	95	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61	-44.7	176.5	-176.6	-86	0	0	0	111.2	A365 T366 A372 A373 F394 V397 A415 K418 A419 L430 M437	A365-F369 VanDerWaalsContact O-CB 3.26Å; A365-F369 WeakPolarHBondContact O-CB 3.34Å; A365-F369 PolarHBondContact O-N 2.96Å; A365-F369 VanDerWaalsContact O-N 3.08Å; T366-F369 PolarHBondContact O-N 3.28Å; F369-A372 PolarHBondContact O-N 2.82Å; F369-A373 HydrophobicContact CD1-CB 4.43Å; F369-A373 HydrophobicContact CE1-CB 4.27Å; F369-A373 VanDerWaalsContact O-CB 3.22Å; F369-A373 WeakPolarHBondContact O-CB 3.48Å; F369-A373 PolarHBondContact O-N 2.63Å; F369-F394 AromaticContact CD2-CD1 3.86Å; F369-F394 HydrophobicContact CD2-CD1 3.86Å; F369-F394 AromaticContact CD2-CE1 3.71Å; F369-F394 HydrophobicContact CD2-CE1 3.71Å; F369-F394 AromaticContact CE2-CD1 3.94Å; F369-F394 HydrophobicContact CE2-CD1 3.94Å; F369-F394 AromaticContact CE2-CE1 3.57Å; F369-F394 HydrophobicContact CE2-CE1 3.57Å; F369-F394 HydrophobicContact CG-CE1 4.34Å; F369-F394 HydrophobicContact CZ-CE1 4.09Å; F369-V397 HydrophobicContact CB-CG1 4.26Å; F369-V397 HydrophobicContact CB-CG2 4.04Å; F369-V397 HydrophobicContact CD2-CG1 4.42Å; F369-V397 HydrophobicContact CD2-CG2 4.34Å; F369-A415 HydrophobicContact CB-CB 3.8Å; F369-A415 HydrophobicContact CD1-CB 4.08Å; F369-A415 HydrophobicContact CD2-CB 3.74Å; F369-A415 VanDerWaalsContact CD2-O 3.31Å; F369-A415 WeakPolarHBondContact CD2-O 3.49Å; F369-A415 HydrophobicContact CE2-CB 4.36Å; F369-A415 VanDerWaalsContact CE2-O 3.27Å; F369-A415 WeakPolarHBondContact CE2-O 3.19Å; F369-A415 HydrophobicContact CG-CB 3.59Å; F369-K418 HydrophobicContact CE2-CB 3.6Å; F369-K418 HydrophobicContact CZ-CB 3.75Å; F369-K418 HydrophobicContact CZ-CG 4.37Å; F369-A419 HydrophobicContact CD2-CB 4.36Å; F369-L430 HydrophobicContact CE2-CD1 4.24Å; F369-L430 HydrophobicContact CZ-CD1 4.06Å; F369-M437 HydrophobicContact CD1-CG 3.95Å; F369-M437 HydrophobicContact CD1-SD 4.05Å; F369-M437 HydrophobicContact CE1-CG 3.5Å; F369-M437 HydrophobicContact CE1-SD 3.7Å
370	Q	98	Very high	95.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.5	-40.9	-179.9	-165.6	67.9	44.4	0	0	111.7	M337 W338 T366 Y367 V368 A373 I374 M437	M337-Q370 HydrophobicContact CE-CG 3.71Å; M337-Q370 HydrophobicContact SD-CB 4.43Å; M337-Q370 HydrophobicContact SD-CG 3.53Å; M337-Q370 VanDerWaalsContact SD-CG 3.53Å; W338-Q370 VanDerWaalsContact CH2-NE2 3.27Å; T366-Q370 VanDerWaalsContact O-CB 3.29Å; T366-Q370 WeakPolarHBondContact O-CB 3.41Å; T366-Q370 PolarHBondContact O-N 3.16Å; Y367-Q370 PolarHBondContact O-N 2.99Å; V368-Q370 VanDerWaalsContact C-N 3.33Å; V368-Q370 PolarHBondContact O-N 3.36Å; Q370-A373 PolarHBondContact O-N 3.2Å; Q370-I374 HydrophobicContact CG-CD1 3.99Å; Q370-I374 WeakPolarHBondContact O-CB 3.11Å; Q370-I374 VanDerWaalsContact O-CG1 3.27Å; Q370-I374 WeakPolarHBondContact O-CG1 3.48Å; Q370-I374 PolarHBondContact O-N 2.84Å; Q370-M437 VanDerWaalsContact OE1-CB 3.28Å
371	K	98.6	Very high	95.4	Very high	10 Å²	10	36.5 Å²	36.5	4%	0.043	18%	0.179	C	C	.	.	H	α-helix	trans	-57.6	-49.7	172.4	-180	-177.4	177.8	179.5	0	111.1	Y350 A353 D354 C357 Y367 V368 A373 I374 L375 E388 L393	Y350-K371 HydrophobicContact CD2-CG 4.17Å; Y350-K371 HydrophobicContact CE2-CD 4.41Å; Y350-K371 HydrophobicContact CE2-CG 4.09Å; A353-K371 HydrophobicContact CB-CB 4.09Å; D354-K371 HydrophobicContact CB-CD 4.46Å; D354-K371 WeakPolarHBondContact OD1-CE 3.45Å; D354-K371 IonicContact OD1-NZ 3.08Å; D354-K371 PolarHBondContact OD1-NZ 2.97Å; C357-K371 HydrophobicContact CB-CD 4.31Å; Y367-K371 WeakPolarHBondContact O-CB 3.37Å; Y367-K371 PolarHBondContact O-N 3.18Å; V368-K371 PolarHBondContact O-N 2.71Å; K371-A373 PolarHBondContact O-N 3.21Å; K371-I374 PolarHBondContact O-N 3.29Å; K371-L375 HydrophobicContact CG-CD1 4.27Å; K371-L375 WeakPolarHBondContact O-CG 3.4Å; K371-L375 PolarHBondContact O-N 3.46Å; K371-E388 VanDerWaalsContact CE-CD 3.42Å; K371-E388 WeakPolarHBondContact CE-OE1 3.43Å; K371-E388 WeakPolarHBondContact CE-OE2 3.4Å; K371-E388 IonicContact NZ-OE1 3.51Å; K371-E388 PolarHBondContact NZ-OE1 2.81Å; K371-E388 IonicContact NZ-OE2 2.82Å; K371-E388 PolarHBondContact NZ-OE2 3.14Å; K371-E388 VanDerWaalsContact NZ-OE2 3.08Å; K371-L393 HydrophobicContact CD-CD1 4.2Å; K371-L393 HydrophobicContact CD-CD2 4.47Å; K371-L393 HydrophobicContact CG-CD1 4.24Å
372	A	98.6	Very high	96	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.2	-41.7	177.9	0	0	0	0	0	112	V368 F369 L375 S376 V390 L393 F394	V368-A372 WeakPolarHBondContact O-CB 3.37Å; V368-A372 PolarHBondContact O-N 3.49Å; F369-A372 PolarHBondContact O-N 2.82Å; A372-L375 PolarHBondContact O-N 3.09Å; A372-S376 PolarHBondContact O-N 3.19Å; A372-S376 PolarHBondContact O-OG 3.15Å; A372-V390 HydrophobicContact CB-CG1 4.49Å; A372-L393 HydrophobicContact CB-CB 3.8Å; A372-L393 HydrophobicContact CB-CD1 4.33Å; A372-F394 HydrophobicContact CB-CD1 3.89Å; A372-F394 HydrophobicContact CB-CD2 3.84Å; A372-F394 HydrophobicContact CB-CE1 3.68Å; A372-F394 HydrophobicContact CB-CE2 3.64Å; A372-F394 HydrophobicContact CB-CG 3.97Å; A372-F394 HydrophobicContact CB-CZ 3.55Å
373	A	98.6	Very high	96.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.9	-43.4	177.8	0	0	0	0	0	112.4	F369 Q370 K371 S376 M377 P433 A434	F369-A373 HydrophobicContact CD1-CB 4.43Å; F369-A373 HydrophobicContact CE1-CB 4.27Å; F369-A373 VanDerWaalsContact O-CB 3.22Å; F369-A373 WeakPolarHBondContact O-CB 3.48Å; F369-A373 PolarHBondContact O-N 2.63Å; Q370-A373 PolarHBondContact O-N 3.2Å; K371-A373 PolarHBondContact O-N 3.21Å; A373-S376 WeakPolarHBondContact O-CB 3.47Å; A373-S376 PolarHBondContact O-N 3.39Å; A373-M377 WeakPolarHBondContact O-CG 3.16Å; A373-M377 PolarHBondContact O-N 3.41Å; A373-P433 HydrophobicContact CB-CB 3.75Å; A373-P433 HydrophobicContact CB-CG 4.07Å; A373-A434 HydrophobicContact CB-CB 4.43Å
374	I	98.8	Very high	96.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65.7	-44.6	176.2	-70.8	163.9	0	0	0	110.5	M337 W346 A349 A353 Q370 K371 S376 M377 A434	M337-I374 HydrophobicContact CG-CD1 3.63Å; M337-I374 HydrophobicContact SD-CD1 3.9Å; W346-I374 HydrophobicContact CB-CG2 4.29Å; W346-I374 HydrophobicContact CE3-CG2 4.26Å; W346-I374 VanDerWaalsContact O-CG2 3.29Å; W346-I374 WeakPolarHBondContact O-CG2 3.44Å; A349-I374 HydrophobicContact CB-CD1 4.16Å; A349-I374 HydrophobicContact CB-CG2 4.06Å; A353-I374 HydrophobicContact CB-CD1 3.93Å; Q370-I374 HydrophobicContact CG-CD1 3.99Å; Q370-I374 WeakPolarHBondContact O-CB 3.11Å; Q370-I374 VanDerWaalsContact O-CG1 3.27Å; Q370-I374 WeakPolarHBondContact O-CG1 3.48Å; Q370-I374 PolarHBondContact O-N 2.84Å; K371-I374 PolarHBondContact O-N 3.29Å; I374-S376 PolarHBondContact O-N 2.85Å; I374-M377 WeakPolarHBondContact O-CB 3.26Å; I374-M377 PolarHBondContact O-N 2.87Å; I374-A434 HydrophobicContact CG1-CB 4.43Å
375	L	98.6	Very high	97	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.7	-34.8	174.6	-74	168.8	0	0	0	112.1	Y350 K371 A372 M377 L378 V383 T386 E388 V390 L393	Y350-L375 HydrophobicContact CD2-CD1 4.1Å; Y350-L375 HydrophobicContact CD2-CD2 3.48Å; Y350-L375 VanDerWaalsContact CD2-CD2 3.48Å; Y350-L375 HydrophobicContact CD2-CG 3.66Å; Y350-L375 HydrophobicContact CE2-CD1 3.9Å; Y350-L375 HydrophobicContact CE2-CD2 3.68Å; Y350-L375 HydrophobicContact CE2-CG 3.94Å; Y350-L375 HydrophobicContact CG-CD2 4Å; K371-L375 HydrophobicContact CG-CD1 4.27Å; K371-L375 WeakPolarHBondContact O-CG 3.4Å; K371-L375 PolarHBondContact O-N 3.46Å; A372-L375 PolarHBondContact O-N 3.09Å; L375-M377 PolarHBondContact O-N 2.95Å; L375-L378 HydrophobicContact CD2-CD1 4.19Å; L375-L378 PolarHBondContact O-N 2.9Å; L375-L378 VanDerWaalsContact O-N 3.13Å; L375-V383 HydrophobicContact CB-CG2 4.49Å; L375-V383 HydrophobicContact CD2-CG1 4.47Å; L375-V383 HydrophobicContact CD2-CG2 4.43Å; L375-V383 VanDerWaalsContact O-CG2 3.24Å; L375-V383 WeakPolarHBondContact O-CG2 3.4Å; L375-T386 HydrophobicContact CD2-CG2 4.09Å; L375-E388 HydrophobicContact CD1-CB 3.76Å; L375-E388 HydrophobicContact CD1-CG 4.06Å; L375-V390 HydrophobicContact CB-CG2 3.7Å; L375-V390 HydrophobicContact CD1-CG2 4.08Å; L375-L393 HydrophobicContact CD1-CD1 3.7Å
376	S	98.1	Very high	97	Very high	44 Å²	44	41.2 Å²	41.2	31%	0.308	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-15	174.9	-63.6	0	0	0	0	114.2	A372 A373 I374	A372-S376 PolarHBondContact O-N 3.19Å; A372-S376 PolarHBondContact O-OG 3.15Å; A373-S376 WeakPolarHBondContact O-CB 3.47Å; A373-S376 PolarHBondContact O-N 3.39Å; I374-S376 PolarHBondContact O-N 2.85Å
377	M	97.9	Very high	97	Very high	31 Å²	31	44.5 Å²	44.5	15%	0.153	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-9.4	174.4	-52.6	-57.4	-59.7	0	0	113	W346 A373 I374 L375 V432 A434 L435 T460	W346-M377 HydrophobicContact CD2-CB 3.56Å; W346-M377 HydrophobicContact CD2-CG 4.09Å; W346-M377 HydrophobicContact CE3-CB 4.07Å; W346-M377 HydrophobicContact CE3-CG 4.13Å; W346-M377 HydrophobicContact CG-CB 3.8Å; W346-M377 HydrophobicContact CH2-CG 4.13Å; W346-M377 HydrophobicContact CZ2-CB 4.08Å; W346-M377 HydrophobicContact CZ2-CE 4.02Å; W346-M377 HydrophobicContact CZ2-CG 4.07Å; W346-M377 HydrophobicContact CZ3-CG 4.16Å; A373-M377 WeakPolarHBondContact O-CG 3.16Å; A373-M377 PolarHBondContact O-N 3.41Å; I374-M377 WeakPolarHBondContact O-CB 3.26Å; I374-M377 PolarHBondContact O-N 2.87Å; L375-M377 PolarHBondContact O-N 2.95Å; M377-V432 HydrophobicContact CE-CB 4.44Å; M377-V432 HydrophobicContact CE-CG1 4.27Å; M377-A434 HydrophobicContact CG-CB 3.44Å; M377-A434 VanDerWaalsContact CG-CB 3.44Å; M377-A434 HydrophobicContact SD-CB 3.96Å; M377-L435 HydrophobicContact CE-CD1 4.22Å; M377-L435 HydrophobicContact CE-CG 4.12Å; M377-T460 HydrophobicContact CE-CG2 3.99Å
378	L	97.2	Very high	97	Very high	23 Å²	23	46 Å²	46	12%	0.12	26%	0.262	C	S	.	.	S	Bend	trans	-87.7	152.9	177.7	-76.9	167.9	0	0	0	111.5	W346 L375 E382 V383	W346-L378 HydrophobicContact CB-CD1 4.42Å; W346-L378 HydrophobicContact CB-CD2 3.65Å; W346-L378 HydrophobicContact CB-CG 3.71Å; L375-L378 HydrophobicContact CD2-CD1 4.19Å; L375-L378 PolarHBondContact O-N 2.9Å; L375-L378 VanDerWaalsContact O-N 3.13Å; L378-E382 HydrophobicContact CB-CB 4.43Å; L378-E382 HydrophobicContact CD2-CB 4.38Å; L378-V383 HydrophobicContact CB-CG2 3.78Å
379	P	95.4	Very high	96.9	Very high	82 Å²	82	50.3 Å²	50.3	53%	0.532	29%	0.285	S	S	.	.			trans	-56.9	144.2	166.1	-21.6	33	0	0	0	111.4	E381 E382 V383	P379-E381 PolarHBondContact O-N 3.23Å; P379-E381 VanDerWaalsContact O-N 3.12Å; P379-E382 HydrophobicContact CB-CG 4.46Å; P379-E382 HydrophobicContact CG-CG 4.39Å; P379-E382 PolarHBondContact O-N 2.95Å; P379-V383 PolarHBondContact O-N 3.27Å; P379-V383 VanDerWaalsContact O-N 3.11Å
380	E	93.9	Very high	96.9	Very high	143 Å²	143	51.4 Å²	51.4	67%	0.668	29%	0.292	S	S	*	.	H	α-helix	trans	-57.3	-32.3	-176.9	-64.5	-169.6	160.7	0	0	112.7	V383 A384 K429	E380-V383 PolarHBondContact O-N 3.07Å; E380-A384 PolarHBondContact O-N 2.96Å; E380-K429 IonicContact OE1-NZ 3.49Å; E380-K429 PolarHBondContact OE1-NZ 3.28Å
381	E	95.4	Very high	96.9	Very high	154 Å²	154	53.2 Å²	53.2	72%	0.72	30%	0.303	S	S	*	.	H	α-helix	trans	-64.3	-39.4	175.4	-63	-178.5	-174.7	0	0	113.1	P379 A384 K385	P379-E381 PolarHBondContact O-N 3.23Å; P379-E381 VanDerWaalsContact O-N 3.12Å; E381-A384 PolarHBondContact O-N 3.3Å; E381-K385 PolarHBondContact O-N 2.73Å
382	E	96	Very high	96.9	Very high	70 Å²	70	55 Å²	55	33%	0.327	32%	0.319	S	S	.	.	H	α-helix	trans	-72.7	-38.1	177	-65.6	-56.2	143.8	0	0	110.8	L378 P379 A384 K385	L378-E382 HydrophobicContact CB-CB 4.43Å; L378-E382 HydrophobicContact CD2-CB 4.38Å; P379-E382 HydrophobicContact CB-CG 4.46Å; P379-E382 HydrophobicContact CG-CG 4.39Å; P379-E382 PolarHBondContact O-N 2.95Å; E382-A384 VanDerWaalsContact C-N 3.3Å; E382-A384 PolarHBondContact O-N 3.48Å; E382-K385 WeakPolarHBondContact O-CB 3.44Å; E382-K385 PolarHBondContact O-N 2.9Å; E382-K385 IonicContact OE1-NZ 2.64Å; E382-K385 PolarHBondContact OE1-NZ 3.29Å; E382-K385 WeakPolarHBondContact OE2-CD 3.11Å; E382-K385 IonicContact OE2-NZ 3.01Å; E382-K385 PolarHBondContact OE2-NZ 3.38Å
383	V	96.6	Very high	96.9	Very high	19 Å²	19	55.6 Å²	55.6	12%	0.115	32%	0.322	C	S	.	.	H	α-helix	trans	-59.3	-43.4	173.1	178.2	0	0	0	0	110.5	L375 L378 P379 E380 K385 T386 V390	L375-V383 HydrophobicContact CB-CG2 4.49Å; L375-V383 HydrophobicContact CD2-CG1 4.47Å; L375-V383 HydrophobicContact CD2-CG2 4.43Å; L375-V383 VanDerWaalsContact O-CG2 3.24Å; L375-V383 WeakPolarHBondContact O-CG2 3.4Å; L378-V383 HydrophobicContact CB-CG2 3.78Å; P379-V383 PolarHBondContact O-N 3.27Å; P379-V383 VanDerWaalsContact O-N 3.11Å; E380-V383 PolarHBondContact O-N 3.07Å; V383-K385 VanDerWaalsContact C-N 3.25Å; V383-K385 PolarHBondContact O-N 3.45Å; V383-T386 WeakPolarHBondContact O-CB 3.1Å; V383-T386 PolarHBondContact O-N 3.17Å; V383-T386 PolarHBondContact O-OG1 3.02Å; V383-V390 HydrophobicContact CG1-CG2 3.81Å
384	A	95.3	Very high	96.9	Very high	75 Å²	75	55.6 Å²	55.6	62%	0.62	32%	0.322	S	S	*	.	H	α-helix	trans	-58.6	-35.4	179	0	0	0	0	0	113	E380 E381 E382 T386 G387	E380-A384 PolarHBondContact O-N 2.96Å; E381-A384 PolarHBondContact O-N 3.3Å; E382-A384 VanDerWaalsContact C-N 3.3Å; E382-A384 PolarHBondContact O-N 3.48Å; A384-T386 PolarHBondContact O-N 2.97Å; A384-G387 PolarHBondContact O-N 3.27Å
385	K	96	Very high	96.8	Very high	146 Å²	146	61.2 Å²	61.2	64%	0.635	34%	0.343	S	S	*	.	H	α-helix	trans	-65.5	-24.6	176.9	-64.6	172.6	-167.5	169.4	0	113.3	E381 E382 V383 G387	E381-K385 PolarHBondContact O-N 2.73Å; E382-K385 WeakPolarHBondContact O-CB 3.44Å; E382-K385 PolarHBondContact O-N 2.9Å; E382-K385 IonicContact OE1-NZ 2.64Å; E382-K385 PolarHBondContact OE1-NZ 3.29Å; E382-K385 WeakPolarHBondContact OE2-CD 3.11Å; E382-K385 IonicContact OE2-NZ 3.01Å; E382-K385 PolarHBondContact OE2-NZ 3.38Å; V383-K385 VanDerWaalsContact C-N 3.25Å; V383-K385 PolarHBondContact O-N 3.45Å; K385-G387 VanDerWaalsContact C-N 3.31Å
386	T	95.3	Very high	96.7	Very high	42 Å²	42	65.3 Å²	65.3	26%	0.258	36%	0.363	S	S	.	.	H	α-helix	trans	-75.3	-21.3	178.4	71.8	0	0	0	0	113	Y350 L375 V383 A384 E388	Y350-T386 HydrophobicContact CD1-CG2 4.2Å; Y350-T386 HydrophobicContact CE1-CG2 3.71Å; L375-T386 HydrophobicContact CD2-CG2 4.09Å; V383-T386 WeakPolarHBondContact O-CB 3.1Å; V383-T386 PolarHBondContact O-N 3.17Å; V383-T386 PolarHBondContact O-OG1 3.02Å; A384-T386 PolarHBondContact O-N 2.97Å; T386-E388 PolarHBondContact O-N 3.48Å; T386-E388 WeakPolarHBondContact OG1-CB 3.49Å; T386-E388 WeakPolarHBondContact OG1-CG 3.47Å; T386-E388 PolarHBondContact OG1-N 3.41Å
387	G	95.6	Very high	96.7	Very high	72 Å²	72	63.2 Å²	63.2	74%	0.742	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	4.9	-171.7	0	0	0	0	0	114.4	A384 K385	A384-G387 PolarHBondContact O-N 3.27Å; K385-G387 VanDerWaalsContact C-N 3.31Å
388	E	97.1	Very high	96.5	Very high	49 Å²	49	64.8 Å²	64.8	23%	0.229	36%	0.357	C	S	.	.			trans	-79.9	149.7	-179.6	-65.3	-69.1	162.5	0	0	112.3	Y350 K371 L375 T386 L393	Y350-E388 HydrophobicContact CE2-CG 3.99Å; Y350-E388 WeakPolarHBondContact OH-CG 3.5Å; Y350-E388 PolarHBondContact OH-OE1 2.96Å; K371-E388 VanDerWaalsContact CE-CD 3.42Å; K371-E388 WeakPolarHBondContact CE-OE1 3.43Å; K371-E388 WeakPolarHBondContact CE-OE2 3.4Å; K371-E388 IonicContact NZ-OE1 3.51Å; K371-E388 PolarHBondContact NZ-OE1 2.81Å; K371-E388 IonicContact NZ-OE2 2.82Å; K371-E388 PolarHBondContact NZ-OE2 3.14Å; K371-E388 VanDerWaalsContact NZ-OE2 3.08Å; L375-E388 HydrophobicContact CD1-CB 3.76Å; L375-E388 HydrophobicContact CD1-CG 4.06Å; T386-E388 PolarHBondContact O-N 3.48Å; T386-E388 WeakPolarHBondContact OG1-CB 3.49Å; T386-E388 WeakPolarHBondContact OG1-CG 3.47Å; T386-E388 PolarHBondContact OG1-N 3.41Å; E388-L393 HydrophobicContact CB-CD1 4.41Å
389	N	96.7	Very high	96.4	Very high	97 Å²	97	67.2 Å²	67.2	52%	0.519	39%	0.388	S	S	.	.			trans	-111.1	97.6	171.7	-175.7	-32	0	0	0	109.7	V391 A392 L393	N389-V391 PolarHBondContact O-N 3.45Å; N389-V391 WeakPolarHBondContact OD1-CB 3.46Å; N389-V391 PolarHBondContact OD1-N 3.25Å; N389-A392 HydrophobicContact CB-CB 3.84Å; N389-A392 WeakPolarHBondContact O-CB 3.48Å; N389-A392 PolarHBondContact O-N 3.09Å; N389-A392 PolarHBondContact OD1-N 3.27Å; N389-L393 WeakPolarHBondContact O-CG 3.34Å; N389-L393 PolarHBondContact O-N 3.02Å
390	V	97.7	Very high	96.3	Very high	22 Å²	22	65.9 Å²	65.9	13%	0.133	38%	0.375	C	S	.	.	H	α-helix	trans	-54.2	-40.8	-177.9	177.7	0	0	0	0	112.3	A372 L375 V383 L393 F394	A372-V390 HydrophobicContact CB-CG1 4.49Å; L375-V390 HydrophobicContact CB-CG2 3.7Å; L375-V390 HydrophobicContact CD1-CG2 4.08Å; V383-V390 HydrophobicContact CG1-CG2 3.81Å; V390-L393 PolarHBondContact O-N 3.2Å; V390-F394 HydrophobicContact CG1-CD2 3.8Å; V390-F394 HydrophobicContact CG1-CE2 3.58Å; V390-F394 VanDerWaalsContact O-CD2 3.31Å; V390-F394 WeakPolarHBondContact O-CD2 3.35Å; V390-F394 PolarHBondContact O-N 3.02Å
391	V	97.9	Very high	96.2	Very high	39 Å²	39	62.6 Å²	62.6	24%	0.236	36%	0.357	C	S	.	.	H	α-helix	trans	-65.2	-44	178.8	178.5	0	0	0	0	110.8	N389 L393 F394 R395 Y422 P427	N389-V391 PolarHBondContact O-N 3.45Å; N389-V391 WeakPolarHBondContact OD1-CB 3.46Å; N389-V391 PolarHBondContact OD1-N 3.25Å; V391-L393 VanDerWaalsContact C-N 3.33Å; V391-F394 PolarHBondContact O-N 2.88Å; V391-R395 WeakPolarHBondContact O-CB 3.46Å; V391-R395 VanDerWaalsContact O-CG 3.29Å; V391-R395 WeakPolarHBondContact O-CG 3.32Å; V391-R395 PolarHBondContact O-N 3.34Å; V391-Y422 HydrophobicContact CB-CD1 4.48Å; V391-Y422 HydrophobicContact CG1-CD1 4.4Å; V391-Y422 HydrophobicContact CG2-CD1 4.22Å; V391-P427 HydrophobicContact CB-CG 4.48Å; V391-P427 HydrophobicContact CG1-CG 3.73Å; V391-P427 HydrophobicContact CG2-CB 4.49Å; V391-P427 HydrophobicContact CG2-CG 3.85Å
392	A	97.8	Very high	95.7	Very high	46 Å²	46	57 Å²	57	38%	0.38	33%	0.332	S	S	.	.	H	α-helix	trans	-63.6	-40.2	176.5	0	0	0	0	0	111.7	N389 R395 Q396	N389-A392 HydrophobicContact CB-CB 3.84Å; N389-A392 WeakPolarHBondContact O-CB 3.48Å; N389-A392 PolarHBondContact O-N 3.09Å; N389-A392 PolarHBondContact OD1-N 3.27Å; A392-R395 PolarHBondContact O-N 2.99Å; A392-Q396 PolarHBondContact O-N 3.27Å
393	L	98.3	Very high	95	Very high	13 Å²	13	59.9 Å²	59.9	7%	0.068	34%	0.34	C	S	.	.	H	α-helix	trans	-60.8	-46.2	176.2	-67.5	173.7	0	0	0	111.8	V368 K371 A372 L375 E388 N389 V390 V391 R395 Q396 V397	V368-L393 HydrophobicContact CG1-CB 4.27Å; V368-L393 HydrophobicContact CG1-CD2 4.38Å; V368-L393 WeakPolarHBondContact CG1-O 3.48Å; K371-L393 HydrophobicContact CD-CD1 4.2Å; K371-L393 HydrophobicContact CD-CD2 4.47Å; K371-L393 HydrophobicContact CG-CD1 4.24Å; A372-L393 HydrophobicContact CB-CB 3.8Å; A372-L393 HydrophobicContact CB-CD1 4.33Å; L375-L393 HydrophobicContact CD1-CD1 3.7Å; E388-L393 HydrophobicContact CB-CD1 4.41Å; N389-L393 WeakPolarHBondContact O-CG 3.34Å; N389-L393 PolarHBondContact O-N 3.02Å; V390-L393 PolarHBondContact O-N 3.2Å; V391-L393 VanDerWaalsContact C-N 3.33Å; L393-R395 PolarHBondContact O-N 3.15Å; L393-Q396 WeakPolarHBondContact O-CG 3.27Å; L393-V397 WeakPolarHBondContact O-CG2 3.13Å
394	F	98.5	Very high	93.7	Very high	1 Å²	1	61.6 Å²	61.6	0%	0.004	35%	0.348	C	S	.	.	H	α-helix	trans	-64.5	-39.7	175.7	-78.4	-61.9	0	0	0	112.2	F369 A372 V390 V391 Q396 V397 A419 Y422 L430	F369-F394 AromaticContact CD2-CD1 3.86Å; F369-F394 HydrophobicContact CD2-CD1 3.86Å; F369-F394 AromaticContact CD2-CE1 3.71Å; F369-F394 HydrophobicContact CD2-CE1 3.71Å; F369-F394 AromaticContact CE2-CD1 3.94Å; F369-F394 HydrophobicContact CE2-CD1 3.94Å; F369-F394 AromaticContact CE2-CE1 3.57Å; F369-F394 HydrophobicContact CE2-CE1 3.57Å; F369-F394 HydrophobicContact CG-CE1 4.34Å; F369-F394 HydrophobicContact CZ-CE1 4.09Å; A372-F394 HydrophobicContact CB-CD1 3.89Å; A372-F394 HydrophobicContact CB-CD2 3.84Å; A372-F394 HydrophobicContact CB-CE1 3.68Å; A372-F394 HydrophobicContact CB-CE2 3.64Å; A372-F394 HydrophobicContact CB-CG 3.97Å; A372-F394 HydrophobicContact CB-CZ 3.55Å; V390-F394 HydrophobicContact CG1-CD2 3.8Å; V390-F394 HydrophobicContact CG1-CE2 3.58Å; V390-F394 VanDerWaalsContact O-CD2 3.31Å; V390-F394 WeakPolarHBondContact O-CD2 3.35Å; V390-F394 PolarHBondContact O-N 3.02Å; V391-F394 PolarHBondContact O-N 2.88Å; F394-Q396 VanDerWaalsContact C-N 3.27Å; F394-Q396 PolarHBondContact O-N 3.18Å; F394-V397 WeakPolarHBondContact O-CB 3.45Å; F394-V397 WeakPolarHBondContact O-CG2 3.3Å; F394-V397 PolarHBondContact O-N 2.98Å; F394-A419 HydrophobicContact CB-CB 4.32Å; F394-A419 HydrophobicContact CD1-CB 4.21Å; F394-A419 VanDerWaalsContact O-CB 3.25Å; F394-A419 WeakPolarHBondContact O-CB 3.48Å; F394-Y422 HydrophobicContact CB-CD1 4.16Å; F394-Y422 HydrophobicContact CB-CD2 3.54Å; F394-Y422 HydrophobicContact CB-CE2 4.16Å; F394-Y422 HydrophobicContact CB-CG 3.53Å; F394-Y422 HydrophobicContact CD1-CD2 4.17Å; F394-Y422 HydrophobicContact CD1-CE2 4.09Å; F394-Y422 AromaticContact CD2-CD1 3.79Å; F394-Y422 HydrophobicContact CD2-CD1 3.79Å; F394-Y422 AromaticContact CD2-CD2 3.6Å; F394-Y422 HydrophobicContact CD2-CD2 3.6Å; F394-Y422 AromaticContact CD2-CE1 3.54Å; F394-Y422 HydrophobicContact CD2-CE1 3.54Å; F394-Y422 AromaticContact CD2-CE2 3.31Å; F394-Y422 HydrophobicContact CD2-CE2 3.31Å; F394-Y422 AromaticContact CD2-CG 3.83Å; F394-Y422 HydrophobicContact CD2-CG 3.83Å; F394-Y422 AromaticContact CD2-CZ 3.28Å; F394-Y422 HydrophobicContact CE1-CE2 4.32Å; F394-Y422 HydrophobicContact CE2-CD2 4.32Å; F394-Y422 AromaticContact CE2-CE1 3.97Å; F394-Y422 HydrophobicContact CE2-CE1 3.97Å; F394-Y422 AromaticContact CE2-CE2 3.56Å; F394-Y422 HydrophobicContact CE2-CE2 3.56Å; F394-Y422 AromaticContact CE2-CZ 3.36Å; F394-Y422 WeakPolarHBondContact CE2-OH 3.48Å; F394-Y422 HydrophobicContact CG-CD1 4.31Å; F394-Y422 AromaticContact CG-CD2 3.51Å; F394-Y422 HydrophobicContact CG-CD2 3.51Å; F394-Y422 HydrophobicContact CG-CE1 4.41Å; F394-Y422 AromaticContact CG-CE2 3.6Å; F394-Y422 HydrophobicContact CG-CE2 3.6Å; F394-Y422 AromaticContact CG-CG 3.89Å; F394-Y422 HydrophobicContact CG-CG 3.89Å; F394-Y422 HydrophobicContact CZ-CE2 4.07Å; F394-L430 HydrophobicContact CE1-CD1 4.07Å; F394-L430 HydrophobicContact CZ-CD1 4.15Å
395	R	98	Very high	92.4	Very high	118 Å²	118	59.1 Å²	59.1	45%	0.445	33%	0.327	S	S	.	.	H	α-helix	trans	-62.8	-28	-178	-77.3	174.2	177	162.6	2.1	114.2	V391 A392 L393 Y422 P424	V391-R395 WeakPolarHBondContact O-CB 3.46Å; V391-R395 VanDerWaalsContact O-CG 3.29Å; V391-R395 WeakPolarHBondContact O-CG 3.32Å; V391-R395 PolarHBondContact O-N 3.34Å; A392-R395 PolarHBondContact O-N 2.99Å; L393-R395 PolarHBondContact O-N 3.15Å; R395-Y422 WeakPolarHBondContact CG-O 3.46Å; R395-Y422 PolarHBondContact NE-O 2.58Å; R395-Y422 PolarHBondContact NH2-O 3.06Å; R395-P424 PolarHBondContact NH2-O 3.12Å
396	Q	97.1	Very high	91.2	Very high	86 Å²	86	54.5 Å²	54.5	40%	0.402	32%	0.321	S	S	.	.	H	α-helix	trans	-83.1	-15.6	178.9	61.4	176.9	8.5	0	0	114.1	V368 A392 L393 F394 D398 G399 L400	V368-Q396 HydrophobicContact CG1-CG 3.83Å; A392-Q396 PolarHBondContact O-N 3.27Å; L393-Q396 WeakPolarHBondContact O-CG 3.27Å; F394-Q396 VanDerWaalsContact C-N 3.27Å; F394-Q396 PolarHBondContact O-N 3.18Å; Q396-D398 VanDerWaalsContact C-N 3.35Å; Q396-D398 PolarHBondContact O-N 2.91Å; Q396-G399 PolarHBondContact O-N 2.99Å; Q396-G399 VanDerWaalsContact O-N 3.17Å; Q396-L400 HydrophobicContact CB-CD1 4.42Å; Q396-L400 HydrophobicContact CG-CD1 4.08Å; Q396-L400 WeakPolarHBondContact O-CG 3.39Å
397	V	97.2	Very high	90.4	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-55.8	-43.5	-171.4	175.2	0	0	0	0	113	A365 V368 F369 L393 F394 G399 L400 A415 A416 A419	A365-V397 HydrophobicContact CB-CG1 4.24Å; V368-V397 HydrophobicContact CG1-CG2 3.93Å; F369-V397 HydrophobicContact CB-CG1 4.26Å; F369-V397 HydrophobicContact CB-CG2 4.04Å; F369-V397 HydrophobicContact CD2-CG1 4.42Å; F369-V397 HydrophobicContact CD2-CG2 4.34Å; L393-V397 WeakPolarHBondContact O-CG2 3.13Å; F394-V397 WeakPolarHBondContact O-CB 3.45Å; F394-V397 WeakPolarHBondContact O-CG2 3.3Å; F394-V397 PolarHBondContact O-N 2.98Å; V397-G399 VanDerWaalsContact C-N 3.26Å; V397-G399 PolarHBondContact O-N 3.42Å; V397-L400 PolarHBondContact O-N 3.36Å; V397-L400 VanDerWaalsContact O-N 3.15Å; V397-A415 HydrophobicContact CG1-CB 4.16Å; V397-A416 HydrophobicContact CG1-CB 4.24Å; V397-A419 HydrophobicContact CB-CB 3.79Å; V397-A419 HydrophobicContact CG1-CB 4.2Å; V397-A419 HydrophobicContact CG2-CB 4.1Å
398	D	94.6	Very high	89.6	Confident	64 Å²	64	58.2 Å²	58.2	34%	0.342	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-63	-34.3	-176	-168.8	72.8	0	0	0	112.9	Q396 L400 R401 A416	Q396-D398 VanDerWaalsContact C-N 3.35Å; Q396-D398 PolarHBondContact O-N 2.91Å; D398-L400 VanDerWaalsContact C-N 3.3Å; D398-L400 PolarHBondContact O-N 2.93Å; D398-R401 VanDerWaalsContact CG-NH2 3.26Å; D398-R401 PolarHBondContact O-NE 3.31Å; D398-R401 IonicContact OD1-CZ 2.83Å; D398-R401 IonicContact OD1-NE 3.48Å; D398-R401 PolarHBondContact OD1-NE 3.14Å; D398-R401 IonicContact OD1-NH1 3.69Å; D398-R401 IonicContact OD1-NH2 2.96Å; D398-R401 PolarHBondContact OD1-NH2 3.49Å; D398-R401 IonicContact OD2-CZ 3.32Å; D398-R401 IonicContact OD2-NH2 3.08Å; D398-R401 PolarHBondContact OD2-NH2 3.32Å; D398-A416 HydrophobicContact CB-CB 4.26Å; D398-A416 WeakPolarHBondContact OD1-CB 3.47Å
399	G	94.4	Very high	89.1	Confident	74 Å²	74	57.6 Å²	57.6	76%	0.763	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-78	-10.6	179.4	0	0	0	0	0	114.5	Q396 V397	Q396-G399 PolarHBondContact O-N 2.99Å; Q396-G399 VanDerWaalsContact O-N 3.17Å; V397-G399 VanDerWaalsContact C-N 3.26Å; V397-G399 PolarHBondContact O-N 3.42Å
400	L	93.8	Very high	88.7	Confident	53 Å²	53	56 Å²	56	28%	0.277	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-99.8	4	-177.6	-65.6	172	0	0	0	113.5	Q364 A365 V368 Q396 V397 D398 L402	Q364-L400 HydrophobicContact CB-CB 4.25Å; Q364-L400 HydrophobicContact CB-CD2 4.47Å; A365-L400 HydrophobicContact CB-CB 3.99Å; V368-L400 HydrophobicContact CB-CD1 4.11Å; V368-L400 HydrophobicContact CG1-CD1 4.38Å; V368-L400 HydrophobicContact CG2-CD1 3.68Å; Q396-L400 HydrophobicContact CB-CD1 4.42Å; Q396-L400 HydrophobicContact CG-CD1 4.08Å; Q396-L400 WeakPolarHBondContact O-CG 3.39Å; V397-L400 PolarHBondContact O-N 3.36Å; V397-L400 VanDerWaalsContact O-N 3.15Å; D398-L400 VanDerWaalsContact C-N 3.3Å; D398-L400 PolarHBondContact O-N 2.93Å; L400-L402 PolarHBondContact O-N 2.87Å
401	R	91.1	Very high	88.4	Confident	75 Å²	75	55.6 Å²	55.6	28%	0.283	31%	0.307	S	S	.	.			trans	-69.2	128.7	-176.2	-67.4	-176.8	-72.1	172.3	-4.5	111.6	A365 D398 E412 A416	A365-R401 HydrophobicContact CB-CG 4.17Å; D398-R401 VanDerWaalsContact CG-NH2 3.26Å; D398-R401 PolarHBondContact O-NE 3.31Å; D398-R401 IonicContact OD1-CZ 2.83Å; D398-R401 IonicContact OD1-NE 3.48Å; D398-R401 PolarHBondContact OD1-NE 3.14Å; D398-R401 IonicContact OD1-NH1 3.69Å; D398-R401 IonicContact OD1-NH2 2.96Å; D398-R401 PolarHBondContact OD1-NH2 3.49Å; D398-R401 IonicContact OD2-CZ 3.32Å; D398-R401 IonicContact OD2-NH2 3.08Å; D398-R401 PolarHBondContact OD2-NH2 3.32Å; R401-E412 WeakPolarHBondContact CA-OE2 3.49Å; R401-E412 HydrophobicContact CG-CB 4.22Å; R401-A416 HydrophobicContact CG-CB 4.19Å
402	L	85.6	Confident	88.2	Confident	37 Å²	37	53.8 Å²	53.8	19%	0.194	30%	0.296	C	S	.	.			trans	-77.6	153.2	167.8	-65.6	174.5	0	0	0	110.6	F84 W362 L400 S408 I409 E412	F84-L402 HydrophobicContact CD1-CD1 4.35Å; F84-L402 HydrophobicContact CE1-CD1 4.4Å; W362-L402 WeakPolarHBondContact O-CD1 3.45Å; L400-L402 PolarHBondContact O-N 2.87Å; L402-S408 VanDerWaalsContact O-CA 3.31Å; L402-S408 WeakPolarHBondContact O-CA 3.42Å; L402-I409 HydrophobicContact CB-CD1 4.19Å; L402-I409 HydrophobicContact CD1-CD1 4.45Å; L402-E412 PolarHBondContact N-OE2 3.27Å
403	R	80.6	Confident	88	Confident	129 Å²	129	57.5 Å²	57.5	49%	0.487	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	136.6	173.7	-63.5	-179.4	-179.1	-174.8	1	109.3	E154 K407	E154-R403 VanDerWaalsContact CG-O 3.3Å; E154-R403 WeakPolarHBondContact CG-O 3.42Å; R403-K407 CarbonylContact C-O 3.57Å; R403-K407 WeakPolarHBondContact CA-O 3.29Å
404	I	69.4	Low	87.9	Confident	55 Å²	55	57 Å²	57	28%	0.282	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	123.2	173	-61.7	178	0	0	0	106.6	F151 G406 K407 I409	F151-I404 WeakPolarHBondContact O-CG2 3.35Å; I404-G406 PolarHBondContact O-N 3.43Å; I404-K407 PolarHBondContact N-O 3.05Å; I404-K407 PolarHBondContact O-N 2.89Å; I404-K407 VanDerWaalsContact O-O 3.11Å; I404-I409 HydrophobicContact CD1-CD1 4.18Å; I404-I409 HydrophobicContact CD1-CG1 4.04Å; I404-I409 HydrophobicContact CG1-CG1 4.46Å
405	A	67.2	Low	87.8	Confident	23 Å²	23	57 Å²	57	19%	0.19	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	41.1	-172.5	0	0	0	0	0	113.5	D153 E154 F159 K407	D153-A405 PolarHBondContact O-N 2.95Å; E154-A405 CarbonylContact O-C 3.45Å; E154-A405 VanDerWaalsContact O-C 3.26Å; E154-A405 WeakPolarHBondContact O-CA 3.11Å; E154-A405 PolarHBondContact O-N 2.88Å; F159-A405 HydrophobicContact CB-CB 3.85Å; F159-A405 HydrophobicContact CD2-CB 4.01Å; F159-A405 HydrophobicContact CG-CB 4.09Å; A405-K407 PolarHBondContact O-N 3.49Å
406	G	70.9	Confident	87.7	Confident	50 Å²	50	51.3 Å²	51.3	52%	0.515	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	2.9	-178.5	0	0	0	0	0	115.4	E154 I404	E154-G406 PolarHBondContact O-N 3.21Å; I404-G406 PolarHBondContact O-N 3.43Å
407	K	78.8	Confident	87.6	Confident	164 Å²	164	50.6 Å²	50.6	71%	0.713	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.1	134.4	178.2	-66.3	-173.2	177.5	-178	0	110.8	R403 I404 A405	R403-K407 CarbonylContact C-O 3.57Å; R403-K407 WeakPolarHBondContact CA-O 3.29Å; I404-K407 PolarHBondContact N-O 3.05Å; I404-K407 PolarHBondContact O-N 2.89Å; I404-K407 VanDerWaalsContact O-O 3.11Å; A405-K407 PolarHBondContact O-N 3.49Å
408	S	78.9	Confident	87.6	Confident	27 Å²	27	50.9 Å²	50.9	19%	0.189	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	147.6	172.7	-61.7	0	0	0	0	111.9	L402	L402-S408 VanDerWaalsContact O-CA 3.31Å; L402-S408 WeakPolarHBondContact O-CA 3.42Å
409	I	85.8	Confident	87.8	Confident	37 Å²	37	48 Å²	48	19%	0.19	26%	0.262	C	S	.	.			trans	-57.1	132	172.8	-58.2	176.3	0	0	0	108.4	L402 I404 T411 E412 K413	L402-I409 HydrophobicContact CB-CD1 4.19Å; L402-I409 HydrophobicContact CD1-CD1 4.45Å; I404-I409 HydrophobicContact CD1-CD1 4.18Å; I404-I409 HydrophobicContact CD1-CG1 4.04Å; I404-I409 HydrophobicContact CG1-CG1 4.46Å; I409-T411 VanDerWaalsContact C-N 3.28Å; I409-T411 WeakPolarHBondContact CG2-OG1 3.25Å; I409-T411 PolarHBondContact O-N 2.69Å; I409-E412 HydrophobicContact CB-CB 4.3Å; I409-E412 HydrophobicContact CB-CG 4.06Å; I409-E412 PolarHBondContact O-N 3.08Å; I409-E412 VanDerWaalsContact O-N 3.07Å; I409-K413 PolarHBondContact O-N 3.35Å
410	P	88.3	Confident	87.9	Confident	63 Å²	63	50 Å²	50	41%	0.409	25%	0.251	S	S	.	.	H	α-helix	trans	-53.6	-41.8	-174.2	-30.4	36.1	0	0	0	114.2	K413 F414 M559	P410-K413 PolarHBondContact O-N 2.89Å; P410-F414 PolarHBondContact O-N 2.77Å; P410-M559 HydrophobicContact CB-CE 4.23Å; P410-M559 HydrophobicContact CB-SD 3.59Å; P410-M559 VanDerWaalsContact CB-SD 3.59Å
411	T	91.8	Very high	88	Confident	14 Å²	14	48.1 Å²	48.1	9%	0.086	24%	0.24	C	C	.	.	H	α-helix	trans	-65.9	-39.4	179.1	48.8	0	0	0	0	112.2	I409 F414 A415 V440 W441 M559	I409-T411 VanDerWaalsContact C-N 3.28Å; I409-T411 WeakPolarHBondContact CG2-OG1 3.25Å; I409-T411 PolarHBondContact O-N 2.69Å; T411-F414 WeakPolarHBondContact O-CB 3.31Å; T411-F414 PolarHBondContact O-N 2.63Å; T411-A415 WeakPolarHBondContact O-CB 3.49Å; T411-A415 PolarHBondContact O-N 2.82Å; T411-V440 HydrophobicContact CG2-CG1 4.21Å; T411-W441 HydrophobicContact CG2-CH2 4.12Å; T411-W441 HydrophobicContact CG2-CZ2 4.03Å; T411-M559 HydrophobicContact CG2-CE 3.57Å; T411-M559 HydrophobicContact CG2-SD 4.17Å
412	E	93.8	Very high	88.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-69.9	-36.2	176.4	-64.6	-171.7	168	0	0	111.8	S363 A365 T366 R401 L402 I409 F414 A415 A416	S363-E412 WeakPolarHBondContact CA-OE1 3.3Å; S363-E412 WeakPolarHBondContact CB-OE1 3.46Å; S363-E412 PolarHBondContact OG-OE1 3.4Å; A365-E412 HydrophobicContact CB-CB 4.06Å; A365-E412 HydrophobicContact CB-CG 3.94Å; T366-E412 WeakPolarHBondContact OG1-CG 3.34Å; R401-E412 WeakPolarHBondContact CA-OE2 3.49Å; R401-E412 HydrophobicContact CG-CB 4.22Å; L402-E412 PolarHBondContact N-OE2 3.27Å; I409-E412 HydrophobicContact CB-CB 4.3Å; I409-E412 HydrophobicContact CB-CG 4.06Å; I409-E412 PolarHBondContact O-N 3.08Å; I409-E412 VanDerWaalsContact O-N 3.07Å; E412-F414 VanDerWaalsContact C-N 3.33Å; E412-A415 PolarHBondContact O-N 3.02Å; E412-A416 VanDerWaalsContact O-CB 3.25Å; E412-A416 WeakPolarHBondContact O-CB 3.41Å; E412-A416 PolarHBondContact O-N 3.48Å
413	K	93.9	Very high	88.8	Confident	124 Å²	124	46.4 Å²	46.4	54%	0.539	25%	0.247	S	C	.	.	H	α-helix	trans	-63.2	-41	172.4	-173.5	-178.6	177.8	-175.1	0	111.2	I409 P410 K417	I409-K413 PolarHBondContact O-N 3.35Å; P410-K413 PolarHBondContact O-N 2.89Å; K413-K417 WeakPolarHBondContact O-CB 3.46Å; K413-K417 PolarHBondContact O-N 3.48Å
414	F	95.6	Very high	89.4	Confident	3 Å²	3	42.9 Å²	42.9	1%	0.013	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-51.5	174.9	177.9	-98.6	0	0	0	111.4	P410 T411 E412 A416 K417 K418 E436 M437 V440 Y521 M559	P410-F414 PolarHBondContact O-N 2.77Å; T411-F414 WeakPolarHBondContact O-CB 3.31Å; T411-F414 PolarHBondContact O-N 2.63Å; E412-F414 VanDerWaalsContact C-N 3.33Å; F414-A416 PolarHBondContact O-N 3.36Å; F414-K417 PolarHBondContact O-N 2.91Å; F414-K418 HydrophobicContact CE1-CG 4.13Å; F414-K418 HydrophobicContact CE2-CG 4.46Å; F414-K418 HydrophobicContact CZ-CG 4.11Å; F414-K418 PolarHBondContact O-N 3.24Å; F414-E436 HydrophobicContact CZ-CG 4.31Å; F414-M437 HydrophobicContact CD1-SD 4.04Å; F414-M437 HydrophobicContact CE1-SD 3.9Å; F414-V440 HydrophobicContact CD1-CG2 4.31Å; F414-V440 HydrophobicContact CE1-CG2 3.91Å; F414-V440 HydrophobicContact CZ-CG2 4.36Å; F414-Y521 AromaticContact CE2-CD1 3.89Å; F414-Y521 HydrophobicContact CE2-CD1 3.89Å; F414-Y521 AromaticContact CE2-CE1 3.62Å; F414-Y521 HydrophobicContact CE2-CE1 3.62Å; F414-Y521 HydrophobicContact CE2-CE2 4.43Å; F414-Y521 HydrophobicContact CE2-CG 4.42Å; F414-Y521 AromaticContact CE2-CZ 3.95Å; F414-Y521 HydrophobicContact CZ-CE1 4.17Å; F414-M559 HydrophobicContact CB-CG 4.06Å; F414-M559 HydrophobicContact CB-SD 4.11Å; F414-M559 HydrophobicContact CD2-CG 4.21Å; F414-M559 HydrophobicContact CG-CG 4.21Å
415	A	96.8	Very high	90.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-55.8	-47.5	176.8	0	0	0	0	0	112.1	F369 V397 T411 E412 K417 K418 A419	F369-A415 HydrophobicContact CB-CB 3.8Å; F369-A415 HydrophobicContact CD1-CB 4.08Å; F369-A415 HydrophobicContact CD2-CB 3.74Å; F369-A415 VanDerWaalsContact CD2-O 3.31Å; F369-A415 WeakPolarHBondContact CD2-O 3.49Å; F369-A415 HydrophobicContact CE2-CB 4.36Å; F369-A415 VanDerWaalsContact CE2-O 3.27Å; F369-A415 WeakPolarHBondContact CE2-O 3.19Å; F369-A415 HydrophobicContact CG-CB 3.59Å; V397-A415 HydrophobicContact CG1-CB 4.16Å; T411-A415 WeakPolarHBondContact O-CB 3.49Å; T411-A415 PolarHBondContact O-N 2.82Å; E412-A415 PolarHBondContact O-N 3.02Å; A415-K417 PolarHBondContact O-N 3.36Å; A415-K418 PolarHBondContact O-N 3.45Å; A415-A419 WeakPolarHBondContact O-CB 3.19Å; A415-A419 PolarHBondContact O-N 3.46Å
416	A	96.2	Very high	91.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-42.9	177.6	0	0	0	0	0	112.5	V397 D398 R401 E412 F414 K418 A419 Q420	V397-A416 HydrophobicContact CG1-CB 4.24Å; D398-A416 HydrophobicContact CB-CB 4.26Å; D398-A416 WeakPolarHBondContact OD1-CB 3.47Å; R401-A416 HydrophobicContact CG-CB 4.19Å; E412-A416 VanDerWaalsContact O-CB 3.25Å; E412-A416 WeakPolarHBondContact O-CB 3.41Å; E412-A416 PolarHBondContact O-N 3.48Å; F414-A416 PolarHBondContact O-N 3.36Å; A416-K418 VanDerWaalsContact C-N 3.32Å; A416-K418 PolarHBondContact O-N 3.03Å; A416-A419 PolarHBondContact O-N 3.01Å; A416-Q420 WeakPolarHBondContact O-CG 3.48Å; A416-Q420 PolarHBondContact O-N 3.44Å; A416-Q420 VanDerWaalsContact O-N 3.15Å
417	K	95.9	Very high	92.9	Very high	71 Å²	71	52 Å²	52	31%	0.309	28%	0.277	S	S	.	.	H	α-helix	trans	-59.5	-42.8	175.6	-174.6	179.2	174.9	-171.9	0	111.3	K413 F414 A415 Q420 H518	K413-K417 WeakPolarHBondContact O-CB 3.46Å; K413-K417 PolarHBondContact O-N 3.48Å; F414-K417 PolarHBondContact O-N 2.91Å; A415-K417 PolarHBondContact O-N 3.36Å; K417-Q420 WeakPolarHBondContact O-CB 3.36Å; K417-Q420 PolarHBondContact O-N 3.15Å; K417-H518 WeakPolarHBondContact CE-O 3.34Å; K417-H518 PolarHBondContact NZ-O 3.49Å
418	K	97.1	Very high	93.6	Very high	5 Å²	5	46.4 Å²	46.4	2%	0.022	25%	0.254	C	S	.	.	H	α-helix	trans	-65.5	-42.8	175.4	-72.3	-64.1	-151.9	167.6	0	112.4	F369 F414 A415 A416 Q420 R421 L430 E436 D519	F369-K418 HydrophobicContact CE2-CB 3.6Å; F369-K418 HydrophobicContact CZ-CB 3.75Å; F369-K418 HydrophobicContact CZ-CG 4.37Å; F414-K418 HydrophobicContact CE1-CG 4.13Å; F414-K418 HydrophobicContact CE2-CG 4.46Å; F414-K418 HydrophobicContact CZ-CG 4.11Å; F414-K418 PolarHBondContact O-N 3.24Å; A415-K418 PolarHBondContact O-N 3.45Å; A416-K418 VanDerWaalsContact C-N 3.32Å; A416-K418 PolarHBondContact O-N 3.03Å; K418-Q420 PolarHBondContact O-N 3.1Å; K418-R421 PolarHBondContact O-N 3.45Å; K418-L430 HydrophobicContact CB-CD1 4.21Å; K418-L430 HydrophobicContact CB-CD2 4.45Å; K418-L430 HydrophobicContact CD-CD2 4.01Å; K418-E436 WeakPolarHBondContact CE-OE1 3.41Å; K418-E436 WeakPolarHBondContact CE-OE2 3.11Å; K418-E436 VanDerWaalsContact NZ-CD 3.3Å; K418-E436 IonicContact NZ-OE1 3.39Å; K418-E436 PolarHBondContact NZ-OE1 2.94Å; K418-E436 IonicContact NZ-OE2 2.58Å; K418-E436 PolarHBondContact NZ-OE2 3.35Å; K418-E436 VanDerWaalsContact NZ-OE2 3.16Å; K418-D519 VanDerWaalsContact NZ-CG 3.34Å; K418-D519 IonicContact NZ-OD1 2.96Å; K418-D519 PolarHBondContact NZ-OD1 2.92Å; K418-D519 IonicContact NZ-OD2 2.71Å; K418-D519 PolarHBondContact NZ-OD2 2.91Å
419	A	97.5	Very high	94.4	Very high	5 Å²	5	51.5 Å²	51.5	4%	0.041	27%	0.273	C	S	.	.	H	α-helix	trans	-61.6	-23.4	178.3	0	0	0	0	0	113.9	F369 F394 V397 A415 A416 R421 Y422	F369-A419 HydrophobicContact CD2-CB 4.36Å; F394-A419 HydrophobicContact CB-CB 4.32Å; F394-A419 HydrophobicContact CD1-CB 4.21Å; F394-A419 VanDerWaalsContact O-CB 3.25Å; F394-A419 WeakPolarHBondContact O-CB 3.48Å; V397-A419 HydrophobicContact CB-CB 3.79Å; V397-A419 HydrophobicContact CG1-CB 4.2Å; V397-A419 HydrophobicContact CG2-CB 4.1Å; A415-A419 WeakPolarHBondContact O-CB 3.19Å; A415-A419 PolarHBondContact O-N 3.46Å; A416-A419 PolarHBondContact O-N 3.01Å; A419-R421 PolarHBondContact O-N 3.1Å; A419-R421 VanDerWaalsContact O-N 3.1Å; A419-Y422 WeakPolarHBondContact O-CB 3.36Å; A419-Y422 PolarHBondContact O-N 2.9Å
420	Q	96.3	Very high	94.9	Very high	114 Å²	114	50.2 Å²	50.2	53%	0.533	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-57.2	-25.9	177.2	-73.4	171.4	-0.3	0	0	113.4	A416 K417 K418 Y422 A423	A416-Q420 WeakPolarHBondContact O-CG 3.48Å; A416-Q420 PolarHBondContact O-N 3.44Å; A416-Q420 VanDerWaalsContact O-N 3.15Å; K417-Q420 WeakPolarHBondContact O-CB 3.36Å; K417-Q420 PolarHBondContact O-N 3.15Å; K418-Q420 PolarHBondContact O-N 3.1Å; Q420-Y422 PolarHBondContact O-N 3.12Å; Q420-Y422 VanDerWaalsContact O-N 3.1Å; Q420-A423 VanDerWaalsContact O-CB 3.29Å; Q420-A423 WeakPolarHBondContact O-CB 3.33Å; Q420-A423 PolarHBondContact O-N 2.91Å
421	R	96.6	Very high	95.3	Very high	14 Å²	14	49 Å²	49	5%	0.053	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-59.9	-18.5	173.3	-75.6	177.5	64.2	156.2	6.4	114	K418 A419 L428 K429 F477 D481	K418-R421 PolarHBondContact O-N 3.45Å; A419-R421 PolarHBondContact O-N 3.1Å; A419-R421 VanDerWaalsContact O-N 3.1Å; R421-L428 HydrophobicContact CB-CB 4.17Å; R421-L428 VanDerWaalsContact CB-O 3.31Å; R421-L428 WeakPolarHBondContact CB-O 3.42Å; R421-L428 HydrophobicContact CG-CB 4.49Å; R421-L428 PolarHBondContact NE-O 3.02Å; R421-L428 PolarHBondContact O-N 2.53Å; R421-K429 PolarHBondContact NH2-O 2.89Å; R421-F477 HydrophobicContact CG-CD1 4.38Å; R421-F477 HydrophobicContact CG-CD2 4.45Å; R421-F477 HydrophobicContact CG-CE1 3.91Å; R421-F477 HydrophobicContact CG-CE2 4.04Å; R421-F477 HydrophobicContact CG-CZ 3.74Å; R421-D481 IonicContact CZ-OD1 2.6Å; R421-D481 IonicContact CZ-OD2 3.61Å; R421-D481 IonicContact NH1-OD1 3.49Å; R421-D481 PolarHBondContact NH1-OD1 3.37Å; R421-D481 IonicContact NH1-OD2 3.08Å; R421-D481 PolarHBondContact NH1-OD2 3.02Å; R421-D481 IonicContact NH2-OD1 3.8Å; R421-D481 IonicContact NH2-OD2 3.28Å; R421-D481 PolarHBondContact NH2-OD2 2.81Å
422	Y	97.4	Very high	95.6	Very high	5 Å²	5	48.6 Å²	48.6	2%	0.02	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-96	-2.9	177.3	-66.8	-96.3	0	0	0	113.5	V391 F394 R395 A419 Q420 P427 L430	V391-Y422 HydrophobicContact CB-CD1 4.48Å; V391-Y422 HydrophobicContact CG1-CD1 4.4Å; V391-Y422 HydrophobicContact CG2-CD1 4.22Å; F394-Y422 HydrophobicContact CB-CD1 4.16Å; F394-Y422 HydrophobicContact CB-CD2 3.54Å; F394-Y422 HydrophobicContact CB-CE2 4.16Å; F394-Y422 HydrophobicContact CB-CG 3.53Å; F394-Y422 HydrophobicContact CD1-CD2 4.17Å; F394-Y422 HydrophobicContact CD1-CE2 4.09Å; F394-Y422 AromaticContact CD2-CD1 3.79Å; F394-Y422 HydrophobicContact CD2-CD1 3.79Å; F394-Y422 AromaticContact CD2-CD2 3.6Å; F394-Y422 HydrophobicContact CD2-CD2 3.6Å; F394-Y422 AromaticContact CD2-CE1 3.54Å; F394-Y422 HydrophobicContact CD2-CE1 3.54Å; F394-Y422 AromaticContact CD2-CE2 3.31Å; F394-Y422 HydrophobicContact CD2-CE2 3.31Å; F394-Y422 AromaticContact CD2-CG 3.83Å; F394-Y422 HydrophobicContact CD2-CG 3.83Å; F394-Y422 AromaticContact CD2-CZ 3.28Å; F394-Y422 HydrophobicContact CE1-CE2 4.32Å; F394-Y422 HydrophobicContact CE2-CD2 4.32Å; F394-Y422 AromaticContact CE2-CE1 3.97Å; F394-Y422 HydrophobicContact CE2-CE1 3.97Å; F394-Y422 AromaticContact CE2-CE2 3.56Å; F394-Y422 HydrophobicContact CE2-CE2 3.56Å; F394-Y422 AromaticContact CE2-CZ 3.36Å; F394-Y422 WeakPolarHBondContact CE2-OH 3.48Å; F394-Y422 HydrophobicContact CG-CD1 4.31Å; F394-Y422 AromaticContact CG-CD2 3.51Å; F394-Y422 HydrophobicContact CG-CD2 3.51Å; F394-Y422 HydrophobicContact CG-CE1 4.41Å; F394-Y422 AromaticContact CG-CE2 3.6Å; F394-Y422 HydrophobicContact CG-CE2 3.6Å; F394-Y422 AromaticContact CG-CG 3.89Å; F394-Y422 HydrophobicContact CG-CG 3.89Å; F394-Y422 HydrophobicContact CZ-CE2 4.07Å; R395-Y422 WeakPolarHBondContact CG-O 3.46Å; R395-Y422 PolarHBondContact NE-O 2.58Å; R395-Y422 PolarHBondContact NH2-O 3.06Å; A419-Y422 WeakPolarHBondContact O-CB 3.36Å; A419-Y422 PolarHBondContact O-N 2.9Å; Q420-Y422 PolarHBondContact O-N 3.12Å; Q420-Y422 VanDerWaalsContact O-N 3.1Å; Y422-P427 HydrophobicContact CD1-CB 3.58Å; Y422-P427 HydrophobicContact CD1-CG 4.38Å; Y422-P427 HydrophobicContact CE1-CB 4.13Å; Y422-P427 HydrophobicContact CG-CB 4.28Å; Y422-L430 HydrophobicContact CE2-CD1 3.97Å; Y422-L430 HydrophobicContact CE2-CG 3.96Å; Y422-L430 PolarHBondContact OH-N 2.94Å
423	A	95.4	Very high	95.8	Very high	71 Å²	71	48.6 Å²	48.6	59%	0.587	26%	0.255	S	S	*	.	S	Bend	trans	-64.2	-41.5	178.5	0	0	0	0	0	113.8	Q420	Q420-A423 VanDerWaalsContact O-CB 3.29Å; Q420-A423 WeakPolarHBondContact O-CB 3.33Å; Q420-A423 PolarHBondContact O-N 2.91Å
424	P	94.4	Very high	96	Very high	55 Å²	55	42.8 Å²	42.8	36%	0.357	23%	0.23	S	C	.	.	S	Bend	trans	-64	160.5	179	-22.2	34.6	0	0	0	113.4	R395 K426	R395-P424 PolarHBondContact NH2-O 3.12Å; P424-K426 VanDerWaalsContact C-N 3.33Å; P424-K426 PolarHBondContact O-N 3.41Å
425	P	92.9	Very high	96.1	Very high	129 Å²	129	42.6 Å²	42.6	84%	0.838	23%	0.23	S	C	*	.	S	Bend	trans	-58.3	-40.2	176.4	-26.5	35.4	0	0	0	113.9	P427	P425-P427 WeakPolarHBondContact O-CD 3.44Å
426	K	93.7	Very high	96.2	Very high	154 Å²	154	42.9 Å²	42.9	67%	0.67	23%	0.231	S	C	*	.	S	Bend	trans	-95.2	103.2	168.5	-175.6	-176.6	178.4	-171	0	107.9	P424	P424-K426 VanDerWaalsContact C-N 3.33Å; P424-K426 PolarHBondContact O-N 3.41Å
427	P	93.6	Very high	96.2	Very high	37 Å²	37	42.9 Å²	42.9	24%	0.24	23%	0.231	C	C	.	.			trans	-67.3	144	-178	-20.6	35	0	0	0	112	V391 Y422 P425 K429	V391-P427 HydrophobicContact CB-CG 4.48Å; V391-P427 HydrophobicContact CG1-CG 3.73Å; V391-P427 HydrophobicContact CG2-CB 4.49Å; V391-P427 HydrophobicContact CG2-CG 3.85Å; Y422-P427 HydrophobicContact CD1-CB 3.58Å; Y422-P427 HydrophobicContact CD1-CG 4.38Å; Y422-P427 HydrophobicContact CE1-CB 4.13Å; Y422-P427 HydrophobicContact CG-CB 4.28Å; P425-P427 WeakPolarHBondContact O-CD 3.44Å; P427-K429 PolarHBondContact O-N 3.34Å
428	L	94.3	Very high	96.2	Very high	46 Å²	46	39.6 Å²	39.6	24%	0.241	22%	0.217	C	C	.	.			trans	-95.7	89.6	173.1	-61.3	171.9	0	0	0	108.4	R421 F477	R421-L428 HydrophobicContact CB-CB 4.17Å; R421-L428 VanDerWaalsContact CB-O 3.31Å; R421-L428 WeakPolarHBondContact CB-O 3.42Å; R421-L428 HydrophobicContact CG-CB 4.49Å; R421-L428 PolarHBondContact NE-O 3.02Å; R421-L428 PolarHBondContact O-N 2.53Å; L428-F477 HydrophobicContact CD1-CD2 3.79Å; L428-F477 HydrophobicContact CD1-CE2 3.48Å; L428-F477 VanDerWaalsContact CD1-CE2 3.48Å
429	K	94.6	Very high	96.2	Very high	134 Å²	134	39.7 Å²	39.7	58%	0.583	22%	0.217	S	C	*	.			trans	-53.9	140.8	-173.4	-65.4	-174.5	179	-176.8	0	111.6	E380 R421 P427	E380-K429 IonicContact OE1-NZ 3.49Å; E380-K429 PolarHBondContact OE1-NZ 3.28Å; R421-K429 PolarHBondContact NH2-O 2.89Å; P427-K429 PolarHBondContact O-N 3.34Å
430	L	97	Very high	95.9	Very high	11 Å²	11	40 Å²	40	6%	0.058	22%	0.218	C	C	.	.			trans	-76.6	141.7	171.4	-67.1	166.1	0	0	0	109.4	F369 F394 K418 Y422 P433	F369-L430 HydrophobicContact CE2-CD1 4.24Å; F369-L430 HydrophobicContact CZ-CD1 4.06Å; F394-L430 HydrophobicContact CE1-CD1 4.07Å; F394-L430 HydrophobicContact CZ-CD1 4.15Å; K418-L430 HydrophobicContact CB-CD1 4.21Å; K418-L430 HydrophobicContact CB-CD2 4.45Å; K418-L430 HydrophobicContact CD-CD2 4.01Å; Y422-L430 HydrophobicContact CE2-CD1 3.97Å; Y422-L430 HydrophobicContact CE2-CG 3.96Å; Y422-L430 PolarHBondContact OH-N 2.94Å; L430-P433 HydrophobicContact CB-CB 3.89Å; L430-P433 HydrophobicContact CB-CG 4.03Å; L430-P433 HydrophobicContact CD1-CB 3.89Å
431	V	96.3	Very high	95.7	Very high	38 Å²	38	36.9 Å²	36.9	23%	0.23	20%	0.202	C	C	.	.	S	Bend	trans	-71.3	-52.2	-172.4	59.8	0	0	0	0	114.3	A464 L468 D481 V485	V431-A464 HydrophobicContact CG2-CB 3.83Å; V431-L468 HydrophobicContact CG2-CD1 4Å; V431-L468 HydrophobicContact CG2-CG 4.26Å; V431-D481 HydrophobicContact CB-CB 4.34Å; V431-D481 HydrophobicContact CG1-CB 3.95Å; V431-V485 HydrophobicContact CG1-CG2 4.02Å; V431-V485 HydrophobicContact CG2-CG2 3.93Å
432	V	97.8	Very high	95.4	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.024	20%	0.2	C	C	.	.	S	Bend	trans	-141.5	59.7	178.9	-72.8	0	0	0	0	111.8	M377 A434 L435 E436 L461 A464 V484 V485 L488	M377-V432 HydrophobicContact CE-CB 4.44Å; M377-V432 HydrophobicContact CE-CG1 4.27Å; V432-A434 VanDerWaalsContact C-N 3.3Å; V432-A434 PolarHBondContact O-N 3.15Å; V432-L435 HydrophobicContact CB-CB 4.21Å; V432-L435 HydrophobicContact CB-CD1 4.13Å; V432-L435 HydrophobicContact CB-CG 4.39Å; V432-L435 HydrophobicContact CG1-CD1 4.24Å; V432-L435 HydrophobicContact CG2-CB 4.38Å; V432-L435 PolarHBondContact O-N 2.76Å; V432-L435 VanDerWaalsContact O-N 3.11Å; V432-E436 PolarHBondContact O-N 3.39Å; V432-L461 HydrophobicContact CG1-CD2 4.39Å; V432-L461 HydrophobicContact CG2-CD2 3.93Å; V432-A464 HydrophobicContact CG1-CB 3.94Å; V432-V484 HydrophobicContact CG2-CG1 4.39Å; V432-V485 HydrophobicContact CG2-CG2 4.41Å; V432-L488 HydrophobicContact CG2-CD1 3.72Å
433	P	98.1	Very high	95.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.6	-32.3	-166.3	25.8	-35.9	0	0	0	114	A373 L430 M437	A373-P433 HydrophobicContact CB-CB 3.75Å; A373-P433 HydrophobicContact CB-CG 4.07Å; L430-P433 HydrophobicContact CB-CB 3.89Å; L430-P433 HydrophobicContact CB-CG 4.03Å; L430-P433 HydrophobicContact CD1-CB 3.89Å; P433-M437 WeakPolarHBondContact O-CG 3.3Å; P433-M437 PolarHBondContact O-N 3.12Å
434	A	98.3	Very high	95.3	Very high	2 Å²	2	33.1 Å²	33.1	2%	0.017	17%	0.173	C	C	.	.	H	α-helix	trans	-70.2	-39.7	177.7	0	0	0	0	0	112.3	W346 A373 I374 M377 V432 M437 M438	W346-A434 HydrophobicContact CH2-CB 4.11Å; W346-A434 HydrophobicContact CZ3-CB 3.78Å; A373-A434 HydrophobicContact CB-CB 4.43Å; I374-A434 HydrophobicContact CG1-CB 4.43Å; M377-A434 HydrophobicContact CG-CB 3.44Å; M377-A434 VanDerWaalsContact CG-CB 3.44Å; M377-A434 HydrophobicContact SD-CB 3.96Å; V432-A434 VanDerWaalsContact C-N 3.3Å; V432-A434 PolarHBondContact O-N 3.15Å; A434-M437 PolarHBondContact O-N 2.68Å; A434-M438 WeakPolarHBondContact O-CB 3.08Å; A434-M438 PolarHBondContact O-N 2.94Å
435	L	98.6	Very high	95.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-71	-34.7	178	-60.2	-178.6	0	0	0	111.5	W346 M377 V432 M438 Y439 F444 I457 T460 L461 L488	W346-L435 HydrophobicContact CH2-CD2 3.91Å; W346-L435 HydrophobicContact CZ2-CD2 4.33Å; M377-L435 HydrophobicContact CE-CD1 4.22Å; M377-L435 HydrophobicContact CE-CG 4.12Å; V432-L435 HydrophobicContact CB-CB 4.21Å; V432-L435 HydrophobicContact CB-CD1 4.13Å; V432-L435 HydrophobicContact CB-CG 4.39Å; V432-L435 HydrophobicContact CG1-CD1 4.24Å; V432-L435 HydrophobicContact CG2-CB 4.38Å; V432-L435 PolarHBondContact O-N 2.76Å; V432-L435 VanDerWaalsContact O-N 3.11Å; L435-M438 HydrophobicContact CD2-CE 3.77Å; L435-M438 HydrophobicContact CD2-SD 4.45Å; L435-M438 VanDerWaalsContact O-CB 3.32Å; L435-M438 WeakPolarHBondContact O-CB 3.31Å; L435-M438 PolarHBondContact O-N 3.09Å; L435-Y439 PolarHBondContact O-N 3.23Å; L435-F444 WeakPolarHBondContact O-CE2 3.48Å; L435-I457 HydrophobicContact CD1-CG2 3.97Å; L435-I457 HydrophobicContact CD2-CG1 4.43Å; L435-I457 HydrophobicContact CD2-CG2 3.96Å; L435-T460 HydrophobicContact CD1-CG2 4.11Å; L435-L461 HydrophobicContact CD1-CD2 3.89Å; L435-L461 HydrophobicContact CD1-CG 4.04Å; L435-L488 HydrophobicContact CB-CD1 4.06Å
436	E	97.9	Very high	95.3	Very high	5 Å²	5	26.9 Å²	26.9	2%	0.023	13%	0.129	C	C	.	.	H	α-helix	trans	-63.2	-44.4	171.6	-175.9	176.5	-154.9	0	0	111.6	F414 K418 V432 M438 Y439 V440 V484 L488 Y521	F414-E436 HydrophobicContact CZ-CG 4.31Å; K418-E436 WeakPolarHBondContact CE-OE1 3.41Å; K418-E436 WeakPolarHBondContact CE-OE2 3.11Å; K418-E436 VanDerWaalsContact NZ-CD 3.3Å; K418-E436 IonicContact NZ-OE1 3.39Å; K418-E436 PolarHBondContact NZ-OE1 2.94Å; K418-E436 IonicContact NZ-OE2 2.58Å; K418-E436 PolarHBondContact NZ-OE2 3.35Å; K418-E436 VanDerWaalsContact NZ-OE2 3.16Å; V432-E436 PolarHBondContact O-N 3.39Å; E436-M438 VanDerWaalsContact C-N 3.31Å; E436-M438 PolarHBondContact O-N 2.92Å; E436-Y439 WeakPolarHBondContact O-CB 3.36Å; E436-Y439 PolarHBondContact O-N 3.27Å; E436-V440 PolarHBondContact O-N 3.08Å; E436-V440 VanDerWaalsContact O-N 3.09Å; E436-V484 HydrophobicContact CB-CG1 4.46Å; E436-V484 HydrophobicContact CG-CG1 4.43Å; E436-L488 HydrophobicContact CB-CD1 4.49Å; E436-Y521 PolarHBondContact OE1-OH 3.21Å
437	M	96.8	Very high	95.4	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-66	-34.5	173.4	-71.6	-58	-61.5	0	0	112.4	W338 F369 Q370 F414 P433 A434 Y439 V440 W441	W338-M437 HydrophobicContact CH2-CB 4.03Å; F369-M437 HydrophobicContact CD1-CG 3.95Å; F369-M437 HydrophobicContact CD1-SD 4.05Å; F369-M437 HydrophobicContact CE1-CG 3.5Å; F369-M437 HydrophobicContact CE1-SD 3.7Å; Q370-M437 VanDerWaalsContact OE1-CB 3.28Å; F414-M437 HydrophobicContact CD1-SD 4.04Å; F414-M437 HydrophobicContact CE1-SD 3.9Å; P433-M437 WeakPolarHBondContact O-CG 3.3Å; P433-M437 PolarHBondContact O-N 3.12Å; A434-M437 PolarHBondContact O-N 2.68Å; M437-Y439 PolarHBondContact O-N 3.27Å; M437-V440 HydrophobicContact CE-CB 4.5Å; M437-V440 HydrophobicContact CE-CG1 4.42Å; M437-V440 WeakPolarHBondContact O-CA 3.36Å; M437-V440 WeakPolarHBondContact O-CB 3.3Å; M437-V440 PolarHBondContact O-N 3.12Å; M437-V440 HydrophobicContact SD-CG2 4.33Å; M437-W441 PolarHBondContact O-N 3.3Å
438	M	96.4	Very high	95.5	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.01	9%	0.091	C	C	.	.	H	α-helix	trans	-57.8	-40	173	-171.3	174.7	69.3	0	0	111.1	W338 F342 A434 L435 E436 W441 N442 G443 F444 I457	W338-M438 HydrophobicContact CH2-CB 4.45Å; W338-M438 HydrophobicContact CZ3-CB 3.8Å; W338-M438 HydrophobicContact CZ3-CG 4.15Å; F342-M438 HydrophobicContact CD1-CG 4.27Å; F342-M438 HydrophobicContact CD1-SD 3.62Å; F342-M438 HydrophobicContact CE1-CG 3.82Å; F342-M438 HydrophobicContact CE1-SD 3.81Å; A434-M438 WeakPolarHBondContact O-CB 3.08Å; A434-M438 PolarHBondContact O-N 2.94Å; L435-M438 HydrophobicContact CD2-CE 3.77Å; L435-M438 HydrophobicContact CD2-SD 4.45Å; L435-M438 VanDerWaalsContact O-CB 3.32Å; L435-M438 WeakPolarHBondContact O-CB 3.31Å; L435-M438 PolarHBondContact O-N 3.09Å; E436-M438 VanDerWaalsContact C-N 3.31Å; E436-M438 PolarHBondContact O-N 2.92Å; M438-W441 CarbonylContact O-C 3.58Å; M438-W441 PolarHBondContact O-N 3.03Å; M438-N442 PolarHBondContact O-N 3.33Å; M438-G443 WeakPolarHBondContact O-CA 3.28Å; M438-G443 PolarHBondContact O-N 2.89Å; M438-F444 HydrophobicContact CB-CE2 4.31Å; M438-F444 HydrophobicContact CE-CD1 4.09Å; M438-F444 HydrophobicContact CE-CD2 3.81Å; M438-F444 HydrophobicContact CE-CE1 3.66Å; M438-F444 HydrophobicContact CE-CE2 3.35Å; M438-F444 HydrophobicContact CE-CG 4.16Å; M438-F444 HydrophobicContact CE-CZ 3.27Å; M438-F444 HydrophobicContact CG-CD2 4.46Å; M438-F444 HydrophobicContact CG-CE2 4.38Å; M438-I457 HydrophobicContact CE-CD1 3.91Å; M438-I457 HydrophobicContact CE-CG2 4.36Å; M438-I457 HydrophobicContact SD-CD1 4.47Å
439	Y	95.6	Very high	95.6	Very high	6 Å²	6	21 Å²	21	2%	0.024	10%	0.101	C	C	.	.	H	α-helix	trans	-63.2	-45.7	171.5	175	-112.6	0	0	0	112.4	L435 E436 M437 W441 N442 F444 M487 L488 L491 F525 E529 R566	L435-Y439 PolarHBondContact O-N 3.23Å; E436-Y439 WeakPolarHBondContact O-CB 3.36Å; E436-Y439 PolarHBondContact O-N 3.27Å; M437-Y439 PolarHBondContact O-N 3.27Å; Y439-W441 PolarHBondContact O-N 3.45Å; Y439-W441 VanDerWaalsContact O-N 3.09Å; Y439-N442 PolarHBondContact O-N 3.46Å; Y439-F444 HydrophobicContact CD2-CD2 4.4Å; Y439-M487 HydrophobicContact CD1-CE 3.42Å; Y439-M487 VanDerWaalsContact CD1-CE 3.42Å; Y439-M487 HydrophobicContact CE1-CE 3.46Å; Y439-M487 VanDerWaalsContact CE1-CE 3.46Å; Y439-M487 HydrophobicContact CE1-SD 4.22Å; Y439-M487 HydrophobicContact CG-CE 3.99Å; Y439-L488 HydrophobicContact CG-CD2 4.28Å; Y439-L491 HydrophobicContact CD2-CD1 3.26Å; Y439-L491 HydrophobicContact CD2-CD2 4.37Å; Y439-L491 HydrophobicContact CD2-CG 4.46Å; Y439-L491 HydrophobicContact CE2-CD1 3.55Å; Y439-L491 HydrophobicContact CE2-CD2 4.09Å; Y439-L491 HydrophobicContact CE2-CG 4.46Å; Y439-L491 HydrophobicContact CG-CD1 4.01Å; Y439-F525 HydrophobicContact CE1-CB 4.33Å; Y439-F525 AromaticContact CE1-CD1 3.55Å; Y439-F525 HydrophobicContact CE1-CD1 3.55Å; Y439-F525 HydrophobicContact CE1-CE1 4.25Å; Y439-F525 HydrophobicContact CE1-CG 4.32Å; Y439-F525 AromaticContact CZ-CD1 3.88Å; Y439-F525 WeakPolarHBondContact OH-CD1 3.27Å; Y439-E529 HydrophobicContact CE2-CG 4.12Å; Y439-E529 WeakPolarHBondContact CE2-OE1 3.36Å; Y439-E529 WeakPolarHBondContact OH-CG 3.3Å; Y439-E529 PolarHBondContact OH-OE1 2.98Å; Y439-R566 PolarHBondContact OH-NH1 2.95Å
440	V	92.3	Very high	95.7	Very high	11 Å²	11	18.2 Å²	18.2	7%	0.067	9%	0.087	C	C	.	.	H	α-helix	trans	-54.1	-32.9	176.9	172.6	0	0	0	0	111.7	T411 F414 E436 M437 M559 R562	T411-V440 HydrophobicContact CG2-CG1 4.21Å; F414-V440 HydrophobicContact CD1-CG2 4.31Å; F414-V440 HydrophobicContact CE1-CG2 3.91Å; F414-V440 HydrophobicContact CZ-CG2 4.36Å; E436-V440 PolarHBondContact O-N 3.08Å; E436-V440 VanDerWaalsContact O-N 3.09Å; M437-V440 HydrophobicContact CE-CB 4.5Å; M437-V440 HydrophobicContact CE-CG1 4.42Å; M437-V440 WeakPolarHBondContact O-CA 3.36Å; M437-V440 WeakPolarHBondContact O-CB 3.3Å; M437-V440 PolarHBondContact O-N 3.12Å; M437-V440 HydrophobicContact SD-CG2 4.33Å; V440-M559 HydrophobicContact CG1-CE 4.23Å; V440-R562 PolarHBondContact O-NE 2.73Å; V440-R562 PolarHBondContact O-NH1 3.1Å; V440-R562 PolarHBondContact O-NH2 3.1Å
441	W	91.2	Very high	95.8	Very high	50 Å²	50	21.1 Å²	21.1	19%	0.189	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	14.4	178.5	-63.1	107.5	0	0	0	115	I266 W334 W338 T366 T411 M437 M438 Y439 G443	I266-W441 HydrophobicContact CD1-CE3 4.44Å; I266-W441 HydrophobicContact CG2-CE3 4.44Å; I266-W441 HydrophobicContact CG2-CZ3 4.47Å; W334-W441 HydrophobicContact CH2-CD2 4.45Å; W334-W441 AromaticContact CH2-CE2 3.78Å; W334-W441 HydrophobicContact CH2-CH2 4.4Å; W334-W441 AromaticContact CH2-CZ2 3.77Å; W334-W441 HydrophobicContact CH2-CZ2 3.77Å; W334-W441 AromaticContact CH2-NE1 3.93Å; W334-W441 HydrophobicContact CZ2-CD2 4Å; W334-W441 AromaticContact CZ2-CE2 3.8Å; W334-W441 HydrophobicContact CZ2-CE3 4.3Å; W334-W441 HydrophobicContact CZ2-CH2 4.26Å; W334-W441 AromaticContact CZ2-CZ2 3.95Å; W334-W441 HydrophobicContact CZ2-CZ2 3.95Å; W334-W441 HydrophobicContact CZ2-CZ3 4.43Å; W338-W441 AromaticContact CE2-CD1 3.99Å; W338-W441 AromaticContact CH2-CD1 3.74Å; W338-W441 HydrophobicContact CZ2-CB 4.33Å; W338-W441 AromaticContact CZ2-CD1 3.18Å; W338-W441 AromaticContact CZ2-CG 3.91Å; W338-W441 HydrophobicContact CZ2-CG 3.91Å; W338-W441 AromaticContact CZ2-NE1 3.8Å; T366-W441 HydrophobicContact CG2-CZ2 4.3Å; T411-W441 HydrophobicContact CG2-CH2 4.12Å; T411-W441 HydrophobicContact CG2-CZ2 4.03Å; M437-W441 PolarHBondContact O-N 3.3Å; M438-W441 CarbonylContact O-C 3.58Å; M438-W441 PolarHBondContact O-N 3.03Å; Y439-W441 PolarHBondContact O-N 3.45Å; Y439-W441 VanDerWaalsContact O-N 3.09Å; W441-G443 PolarHBondContact O-N 3.19Å
442	N	91.7	Very high	95.9	Very high	4 Å²	4	23.9 Å²	23.9	2%	0.021	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	28.4	-178.1	-64.9	-16.2	0	0	0	114.2	V265 I266 M438 Y439 F444 M445 R566	V265-N442 WeakPolarHBondContact O-CB 3.32Å; V265-N442 PolarHBondContact O-ND2 3.38Å; I266-N442 PolarHBondContact O-ND2 2.85Å; M438-N442 PolarHBondContact O-N 3.33Å; Y439-N442 PolarHBondContact O-N 3.46Å; N442-F444 VanDerWaalsContact C-N 3.29Å; N442-F444 PolarHBondContact O-N 2.89Å; N442-M445 PolarHBondContact O-N 3.47Å; N442-R566 PolarHBondContact OD1-NH1 2.83Å; N442-R566 PolarHBondContact OD1-NH2 3.5Å
443	G	94.5	Very high	95.9	Very high	2 Å²	2	25.2 Å²	25.2	2%	0.021	12%	0.123	C	C	.	.	H	α-helix	trans	-66.2	-24.8	-178.3	0	0	0	0	0	114.7	M438 W441 M445 V446 V447	M438-G443 WeakPolarHBondContact O-CA 3.28Å; M438-G443 PolarHBondContact O-N 2.89Å; W441-G443 PolarHBondContact O-N 3.19Å; G443-M445 VanDerWaalsContact C-N 3.29Å; G443-M445 PolarHBondContact O-N 3.17Å; G443-V446 WeakPolarHBondContact O-CB 3.36Å; G443-V446 PolarHBondContact O-N 3.19Å; G443-V447 PolarHBondContact O-N 3.42Å
444	F	95.5	Very high	95.9	Very high	4 Å²	4	25.2 Å²	25.2	2%	0.018	12%	0.123	C	C	.	.	H	α-helix	trans	-63.6	-32.3	178.1	-76.5	-93.6	0	0	0	113.1	L435 M438 Y439 N442 V446 G448 I457 L488 L491 C492 Q495	L435-F444 WeakPolarHBondContact O-CE2 3.48Å; M438-F444 HydrophobicContact CB-CE2 4.31Å; M438-F444 HydrophobicContact CE-CD1 4.09Å; M438-F444 HydrophobicContact CE-CD2 3.81Å; M438-F444 HydrophobicContact CE-CE1 3.66Å; M438-F444 HydrophobicContact CE-CE2 3.35Å; M438-F444 HydrophobicContact CE-CG 4.16Å; M438-F444 HydrophobicContact CE-CZ 3.27Å; M438-F444 HydrophobicContact CG-CD2 4.46Å; M438-F444 HydrophobicContact CG-CE2 4.38Å; Y439-F444 HydrophobicContact CD2-CD2 4.4Å; N442-F444 VanDerWaalsContact C-N 3.29Å; N442-F444 PolarHBondContact O-N 2.89Å; F444-V446 VanDerWaalsContact C-N 3.25Å; F444-V446 PolarHBondContact O-N 2.92Å; F444-G448 PolarHBondContact O-N 2.9Å; F444-I457 HydrophobicContact CE1-CG2 4.14Å; F444-L488 HydrophobicContact CE2-CD2 3.71Å; F444-L488 HydrophobicContact CZ-CB 4.21Å; F444-L488 HydrophobicContact CZ-CD2 3.76Å; F444-L488 HydrophobicContact CZ-CG 4.45Å; F444-L491 HydrophobicContact CB-CB 4.34Å; F444-L491 HydrophobicContact CD1-CB 3.82Å; F444-L491 HydrophobicContact CD2-CD1 4.24Å; F444-L491 HydrophobicContact CE1-CB 4.29Å; F444-L491 HydrophobicContact CE2-CD1 4.49Å; F444-L491 HydrophobicContact CG-CB 4.03Å; F444-L491 HydrophobicContact CG-CD1 4.35Å; F444-C492 VanDerWaalsContact CE1-SG 3.6Å; F444-Q495 WeakPolarHBondContact O-CG 3.37Å
445	M	92.4	Very high	95.9	Very high	45 Å²	45	28 Å²	28	22%	0.222	14%	0.136	C	C	.	.	H	α-helix	trans	-68	-28.2	174	-68	-58.1	-60	0	0	112.5	E271 N442 G443 Q495	E271-M445 HydrophobicContact CG-CE 4.27Å; N442-M445 PolarHBondContact O-N 3.47Å; G443-M445 VanDerWaalsContact C-N 3.29Å; G443-M445 PolarHBondContact O-N 3.17Å; M445-Q495 PolarHBondContact SD-NE2 2.9Å
446	V	94.2	Very high	95.9	Very high	9 Å²	9	29.2 Å²	29.2	6%	0.055	15%	0.148	C	C	.	.	H	α-helix	trans	-80.5	-54.2	-180	-177.3	0	0	0	0	110	V303 L304 F308 F342 G443 F444 G448 K449	V303-V446 HydrophobicContact CG1-CG1 3.85Å; V303-V446 WeakPolarHBondContact O-CG1 3.34Å; L304-V446 HydrophobicContact CD2-CG2 3.87Å; F308-V446 HydrophobicContact CE1-CG1 3.79Å; F308-V446 HydrophobicContact CZ-CG1 4.01Å; F342-V446 HydrophobicContact CD2-CG1 4.28Å; F342-V446 HydrophobicContact CE2-CB 4.33Å; F342-V446 HydrophobicContact CE2-CG1 3.86Å; F342-V446 HydrophobicContact CZ-CB 4.21Å; F342-V446 HydrophobicContact CZ-CG1 4.24Å; G443-V446 WeakPolarHBondContact O-CB 3.36Å; G443-V446 PolarHBondContact O-N 3.19Å; F444-V446 VanDerWaalsContact C-N 3.25Å; F444-V446 PolarHBondContact O-N 2.92Å; V446-G448 PolarHBondContact O-N 3.49Å; V446-K449 WeakPolarHBondContact O-CB 3.4Å; V446-K449 WeakPolarHBondContact O-CG 3.46Å; V446-K449 PolarHBondContact O-N 2.97Å
447	V	96	Very high	96	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-66.3	-25.9	179.1	75.6	0	0	0	0	112.4	F342 G443 K449 R450 L453 T454 I457	F342-V447 HydrophobicContact CB-CB 4.38Å; F342-V447 HydrophobicContact CB-CG2 4.17Å; F342-V447 HydrophobicContact CD1-CB 4.18Å; F342-V447 HydrophobicContact CG-CB 4.46Å; G443-V447 PolarHBondContact O-N 3.42Å; V447-K449 PolarHBondContact O-N 3.38Å; V447-R450 CarbonylContact O-C 3.43Å; V447-R450 WeakPolarHBondContact O-CA 3.5Å; V447-R450 PolarHBondContact O-N 3.33Å; V447-R450 VanDerWaalsContact O-O 3.12Å; V447-L453 HydrophobicContact CG2-CB 3.71Å; V447-T454 PolarHBondContact O-OG1 2.97Å; V447-I457 HydrophobicContact CB-CD1 4.29Å; V447-I457 HydrophobicContact CG1-CD1 3.86Å; V447-I457 HydrophobicContact CG2-CD1 3.7Å
448	G	95.9	Very high	96.1	Very high	10 Å²	10	29 Å²	29	10%	0.103	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-18.2	173.5	0	0	0	0	0	114.7	F444 V446 R450 T454	F444-G448 PolarHBondContact O-N 2.9Å; V446-G448 PolarHBondContact O-N 3.49Å; G448-R450 PolarHBondContact O-N 3.29Å; G448-T454 WeakPolarHBondContact CA-OG1 3.44Å
449	K	95.6	Very high	96.2	Very high	104 Å²	104	31.9 Å²	31.9	45%	0.452	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-9.2	171.2	-53.8	-55.4	178.5	-172.5	0	113.3	V446 V447	V446-K449 WeakPolarHBondContact O-CB 3.4Å; V446-K449 WeakPolarHBondContact O-CG 3.46Å; V446-K449 PolarHBondContact O-N 2.97Å; V447-K449 PolarHBondContact O-N 3.38Å
450	R	98.1	Very high	96.3	Very high	75 Å²	75	33.5 Å²	33.5	28%	0.283	18%	0.178	S	C	.	.			trans	-126.3	85.7	-179.7	-59.8	-60.2	-67.2	-101.9	-3.1	108.8	G306 F308 V447 G448 E452 L453 T454	G306-R450 VanDerWaalsContact O-CD 3.25Å; G306-R450 WeakPolarHBondContact O-CD 3.44Å; G306-R450 WeakPolarHBondContact O-CG 3.24Å; G306-R450 PolarHBondContact O-NH1 3.41Å; F308-R450 HydrophobicContact CD2-CG 4.44Å; F308-R450 HydrophobicContact CE2-CG 3.87Å; V447-R450 CarbonylContact O-C 3.43Å; V447-R450 WeakPolarHBondContact O-CA 3.5Å; V447-R450 PolarHBondContact O-N 3.33Å; V447-R450 VanDerWaalsContact O-O 3.12Å; G448-R450 PolarHBondContact O-N 3.29Å; R450-E452 WeakPolarHBondContact CA-OE2 3.48Å; R450-E452 IonicContact CZ-OE1 3Å; R450-E452 IonicContact NE-OE1 2.67Å; R450-E452 PolarHBondContact NE-OE1 3.29Å; R450-E452 IonicContact NE-OE2 3.2Å; R450-E452 IonicContact NH2-OE1 3.95Å; R450-E452 PolarHBondContact NH2-OE1 3.25Å; R450-E452 PolarHBondContact O-N 3.14Å; R450-L453 HydrophobicContact CB-CB 4.09Å; R450-L453 HydrophobicContact CB-CD1 3.86Å; R450-L453 HydrophobicContact CB-CG 4.04Å; R450-L453 HydrophobicContact CG-CD1 4.21Å; R450-L453 PolarHBondContact O-N 2.68Å; R450-L453 VanDerWaalsContact O-N 3.08Å; R450-T454 PolarHBondContact O-N 2.92Å; R450-T454 PolarHBondContact O-OG1 3.08Å; R450-T454 VanDerWaalsContact O-OG1 3.12Å
451	P	98.1	Very high	96.6	Very high	72 Å²	72	33 Å²	33	47%	0.468	18%	0.175	S	C	.	.	H	α-helix	trans	-53.2	-37.9	-177.1	-28.4	36.2	0	0	0	113.2	L453 T454 E455 L496	P451-L453 PolarHBondContact O-N 3.36Å; P451-T454 PolarHBondContact O-N 2.91Å; P451-E455 WeakPolarHBondContact O-CG 3.46Å; P451-E455 PolarHBondContact O-N 3.05Å; P451-L496 HydrophobicContact CB-CD2 4.03Å
452	E	98.1	Very high	97	Very high	96 Å²	96	34.9 Å²	34.9	45%	0.449	19%	0.186	S	C	.	.	H	α-helix	trans	-62.4	-38.5	178.7	74	-74.6	-170.4	0	0	113.3	R450 G456	R450-E452 WeakPolarHBondContact CA-OE2 3.48Å; R450-E452 IonicContact CZ-OE1 3Å; R450-E452 IonicContact NE-OE1 2.67Å; R450-E452 PolarHBondContact NE-OE1 3.29Å; R450-E452 IonicContact NE-OE2 3.2Å; R450-E452 IonicContact NH2-OE1 3.95Å; R450-E452 PolarHBondContact NH2-OE1 3.25Å; R450-E452 PolarHBondContact O-N 3.14Å; E452-G456 PolarHBondContact O-N 2.96Å; E452-G456 VanDerWaalsContact O-N 3.16Å
453	L	98.4	Very high	97.3	Very high	31 Å²	31	37.1 Å²	37.1	16%	0.162	21%	0.205	C	C	.	.	H	α-helix	trans	-75.9	-35.7	176.3	-62.9	-179.9	0	0	0	110.9	F308 E343 V447 R450 P451 G456 I457	F308-L453 HydrophobicContact CD2-CD1 3.67Å; F308-L453 HydrophobicContact CE2-CD1 3.59Å; E343-L453 HydrophobicContact CG-CD1 4Å; V447-L453 HydrophobicContact CG2-CB 3.71Å; R450-L453 HydrophobicContact CB-CB 4.09Å; R450-L453 HydrophobicContact CB-CD1 3.86Å; R450-L453 HydrophobicContact CB-CG 4.04Å; R450-L453 HydrophobicContact CG-CD1 4.21Å; R450-L453 PolarHBondContact O-N 2.68Å; R450-L453 VanDerWaalsContact O-N 3.08Å; P451-L453 PolarHBondContact O-N 3.36Å; L453-G456 PolarHBondContact O-N 3.42Å; L453-I457 WeakPolarHBondContact O-CG1 3.43Å; L453-I457 PolarHBondContact O-N 2.95Å
454	T	98.6	Very high	97.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.3	-41.3	175.5	-56.5	0	0	0	0	111.7	V447 G448 R450 P451 G456 I457 L458 C492 Q495 L496	V447-T454 PolarHBondContact O-OG1 2.97Å; G448-T454 WeakPolarHBondContact CA-OG1 3.44Å; R450-T454 PolarHBondContact O-N 2.92Å; R450-T454 PolarHBondContact O-OG1 3.08Å; R450-T454 VanDerWaalsContact O-OG1 3.12Å; P451-T454 PolarHBondContact O-N 2.91Å; T454-G456 VanDerWaalsContact C-N 3.34Å; T454-I457 PolarHBondContact O-N 3.11Å; T454-L458 PolarHBondContact O-N 3.22Å; T454-C492 HydrophobicContact CG2-CB 3.94Å; T454-Q495 HydrophobicContact CG2-CB 4.16Å; T454-L496 HydrophobicContact CG2-CD1 4.05Å; T454-L496 HydrophobicContact CG2-CD2 4.07Å; T454-L496 HydrophobicContact CG2-CG 3.75Å
455	E	98.6	Very high	97.6	Very high	62 Å²	62	38.6 Å²	38.6	29%	0.29	21%	0.212	S	C	.	.	H	α-helix	trans	-61.2	-43.4	171.2	-69.8	-69.8	175.4	0	0	111	P451 I457 L458 S459 L496 R498	P451-E455 WeakPolarHBondContact O-CG 3.46Å; P451-E455 PolarHBondContact O-N 3.05Å; E455-I457 VanDerWaalsContact C-N 3.3Å; E455-I457 PolarHBondContact O-N 3.36Å; E455-L458 WeakPolarHBondContact O-CB 3.5Å; E455-L458 PolarHBondContact O-N 3.11Å; E455-L458 VanDerWaalsContact O-N 3.11Å; E455-S459 PolarHBondContact O-N 3.44Å; E455-S459 PolarHBondContact O-OG 2.99Å; E455-L496 HydrophobicContact CG-CD1 4.22Å; E455-L496 HydrophobicContact CG-CD2 3.95Å; E455-L496 WeakPolarHBondContact OE1-CD1 3.24Å; E455-R498 VanDerWaalsContact CD-NH2 3.28Å; E455-R498 IonicContact OE1-CZ 3.82Å; E455-R498 IonicContact OE1-NE 2.98Å; E455-R498 IonicContact OE1-NH2 2.61Å; E455-R498 PolarHBondContact OE1-NH2 3.05Å; E455-R498 IonicContact OE2-CZ 3Å; E455-R498 IonicContact OE2-NH2 2.83Å; E455-R498 PolarHBondContact OE2-NH2 3.1Å
456	G	98.6	Very high	97.9	Very high	24 Å²	24	41 Å²	41	25%	0.247	22%	0.223	C	C	.	.	H	α-helix	trans	-57.6	-41.9	175.4	0	0	0	0	0	112.8	Q344 E452 L453 T454 S459 T460	Q344-G456 PolarHBondContact NE2-O 2.99Å; Q344-G456 VanDerWaalsContact NE2-O 3.15Å; E452-G456 PolarHBondContact O-N 2.96Å; E452-G456 VanDerWaalsContact O-N 3.16Å; L453-G456 PolarHBondContact O-N 3.42Å; T454-G456 VanDerWaalsContact C-N 3.34Å; G456-S459 PolarHBondContact O-N 3.18Å; G456-T460 PolarHBondContact O-N 2.69Å; G456-T460 PolarHBondContact O-OG1 2.96Å
457	I	98.7	Very high	98	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-68.3	-39.7	176	-68.2	158.7	0	0	0	110.6	Q344 L435 M438 F444 V447 L453 T454 E455 S459 T460 L461	Q344-I457 HydrophobicContact CG-CG1 4.05Å; L435-I457 HydrophobicContact CD1-CG2 3.97Å; L435-I457 HydrophobicContact CD2-CG1 4.43Å; L435-I457 HydrophobicContact CD2-CG2 3.96Å; M438-I457 HydrophobicContact CE-CD1 3.91Å; M438-I457 HydrophobicContact CE-CG2 4.36Å; M438-I457 HydrophobicContact SD-CD1 4.47Å; F444-I457 HydrophobicContact CE1-CG2 4.14Å; V447-I457 HydrophobicContact CB-CD1 4.29Å; V447-I457 HydrophobicContact CG1-CD1 3.86Å; V447-I457 HydrophobicContact CG2-CD1 3.7Å; L453-I457 WeakPolarHBondContact O-CG1 3.43Å; L453-I457 PolarHBondContact O-N 2.95Å; T454-I457 PolarHBondContact O-N 3.11Å; E455-I457 VanDerWaalsContact C-N 3.3Å; E455-I457 PolarHBondContact O-N 3.36Å; I457-S459 VanDerWaalsContact C-N 3.33Å; I457-S459 PolarHBondContact O-N 3.04Å; I457-T460 WeakPolarHBondContact O-CB 3.34Å; I457-T460 PolarHBondContact O-N 3.25Å; I457-L461 HydrophobicContact CG2-CD1 4.05Å; I457-L461 WeakPolarHBondContact O-CG 3.24Å; I457-L461 PolarHBondContact O-N 3.45Å
458	L	98.8	Very high	98.1	Very high	1 Å²	1	48 Å²	48	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-59.6	-43.3	175.4	180	59.6	0	0	0	111.3	T454 E455 T460 L461 E462 K489 C492 L493 L496	T454-L458 PolarHBondContact O-N 3.22Å; E455-L458 WeakPolarHBondContact O-CB 3.5Å; E455-L458 PolarHBondContact O-N 3.11Å; E455-L458 VanDerWaalsContact O-N 3.11Å; L458-T460 VanDerWaalsContact C-N 3.35Å; L458-T460 PolarHBondContact O-N 2.92Å; L458-L461 WeakPolarHBondContact O-CB 3.25Å; L458-L461 PolarHBondContact O-N 3.48Å; L458-L461 VanDerWaalsContact O-N 3.14Å; L458-E462 HydrophobicContact CD1-CG 4.4Å; L458-E462 WeakPolarHBondContact O-CG 3.31Å; L458-E462 PolarHBondContact O-N 3.44Å; L458-K489 HydrophobicContact CD1-CB 4.19Å; L458-K489 HydrophobicContact CD1-CG 4Å; L458-C492 HydrophobicContact CB-CB 4.06Å; L458-C492 HydrophobicContact CD1-CB 4.2Å; L458-L493 HydrophobicContact CD1-CG 4.4Å; L458-L493 HydrophobicContact CD2-CD2 3.86Å; L458-L493 HydrophobicContact CD2-CG 4.47Å; L458-L496 HydrophobicContact CD2-CD1 3.95Å
459	S	98.7	Very high	98.1	Very high	64 Å²	64	55 Å²	55	45%	0.448	28%	0.279	S	S	.	.	H	α-helix	trans	-61.2	-41.1	175	-60.5	0	0	0	0	112.5	E455 G456 I457 L461 E462 A463	E455-S459 PolarHBondContact O-N 3.44Å; E455-S459 PolarHBondContact O-OG 2.99Å; G456-S459 PolarHBondContact O-N 3.18Å; I457-S459 VanDerWaalsContact C-N 3.33Å; I457-S459 PolarHBondContact O-N 3.04Å; S459-L461 VanDerWaalsContact C-N 3.3Å; S459-L461 PolarHBondContact O-N 3.21Å; S459-E462 PolarHBondContact O-N 2.69Å; S459-A463 PolarHBondContact O-N 3.45Å
460	T	98.6	Very high	98.1	Very high	40 Å²	40	53.7 Å²	53.7	25%	0.245	28%	0.283	C	S	.	.	H	α-helix	trans	-60	-41.4	173.6	-62.4	0	0	0	0	111.5	Q344 M377 L435 G456 I457 L458 A464	Q344-T460 PolarHBondContact OE1-OG1 3.43Å; M377-T460 HydrophobicContact CE-CG2 3.99Å; L435-T460 HydrophobicContact CD1-CG2 4.11Å; G456-T460 PolarHBondContact O-N 2.69Å; G456-T460 PolarHBondContact O-OG1 2.96Å; I457-T460 WeakPolarHBondContact O-CB 3.34Å; I457-T460 PolarHBondContact O-N 3.25Å; L458-T460 VanDerWaalsContact C-N 3.35Å; L458-T460 PolarHBondContact O-N 2.92Å; T460-A464 PolarHBondContact O-N 3.45Å; T460-A464 VanDerWaalsContact O-N 3.08Å
461	L	98.8	Very high	97.9	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-70	-36.1	177.5	-68.8	165.7	0	0	0	112.9	V432 L435 I457 L458 S459 A464 E465 V485 L488 K489	V432-L461 HydrophobicContact CG1-CD2 4.39Å; V432-L461 HydrophobicContact CG2-CD2 3.93Å; L435-L461 HydrophobicContact CD1-CD2 3.89Å; L435-L461 HydrophobicContact CD1-CG 4.04Å; I457-L461 HydrophobicContact CG2-CD1 4.05Å; I457-L461 WeakPolarHBondContact O-CG 3.24Å; I457-L461 PolarHBondContact O-N 3.45Å; L458-L461 WeakPolarHBondContact O-CB 3.25Å; L458-L461 PolarHBondContact O-N 3.48Å; L458-L461 VanDerWaalsContact O-N 3.14Å; S459-L461 VanDerWaalsContact C-N 3.3Å; S459-L461 PolarHBondContact O-N 3.21Å; L461-A464 PolarHBondContact O-N 3.31Å; L461-E465 PolarHBondContact O-N 3Å; L461-V485 HydrophobicContact CB-CG1 4.37Å; L461-V485 HydrophobicContact CD2-CG1 4.44Å; L461-V485 VanDerWaalsContact O-CG1 3.31Å; L461-V485 WeakPolarHBondContact O-CG1 3.36Å; L461-L488 HydrophobicContact CD1-CB 3.76Å; L461-L488 HydrophobicContact CD2-CB 3.74Å; L461-L488 HydrophobicContact CD2-CD1 3.99Å; L461-L488 HydrophobicContact CG-CB 4.44Å; L461-K489 HydrophobicContact CB-CD 4.4Å; L461-K489 HydrophobicContact CB-CG 3.65Å; L461-K489 HydrophobicContact CD1-CG 4.14Å; L461-K489 HydrophobicContact CG-CG 4.46Å
462	E	98.7	Very high	97.6	Very high	90 Å²	90	55.8 Å²	55.8	42%	0.421	30%	0.303	S	S	.	.	H	α-helix	trans	-66.3	-40.3	174.8	-73.4	173.7	161	0	0	111.8	L458 S459 A464 E465 E466	L458-E462 HydrophobicContact CD1-CG 4.4Å; L458-E462 WeakPolarHBondContact O-CG 3.31Å; L458-E462 PolarHBondContact O-N 3.44Å; S459-E462 PolarHBondContact O-N 2.69Å; E462-A464 VanDerWaalsContact C-N 3.35Å; E462-E465 PolarHBondContact O-N 3.48Å; E462-E466 PolarHBondContact O-N 3.1Å
463	A	98.4	Very high	97.4	Very high	51 Å²	51	56.6 Å²	56.6	42%	0.421	31%	0.31	S	S	.	.	H	α-helix	trans	-62.5	-42.6	173	0	0	0	0	0	111.7	S459 E466 Q467	S459-A463 PolarHBondContact O-N 3.45Å; A463-E466 PolarHBondContact O-N 3.16Å; A463-Q467 WeakPolarHBondContact O-CG 3.38Å; A463-Q467 PolarHBondContact O-N 3.42Å
464	A	98.3	Very high	97.1	Very high	5 Å²	5	58.4 Å²	58.4	4%	0.041	32%	0.324	C	S	.	.	H	α-helix	trans	-63.9	-39.7	175.6	0	0	0	0	0	112.5	V431 V432 T460 L461 E462 Q467 L468 V485	V431-A464 HydrophobicContact CG2-CB 3.83Å; V432-A464 HydrophobicContact CG1-CB 3.94Å; T460-A464 PolarHBondContact O-N 3.45Å; T460-A464 VanDerWaalsContact O-N 3.08Å; L461-A464 PolarHBondContact O-N 3.31Å; E462-A464 VanDerWaalsContact C-N 3.35Å; A464-Q467 PolarHBondContact O-N 2.93Å; A464-L468 WeakPolarHBondContact O-CG 3.25Å; A464-L468 PolarHBondContact O-N 2.69Å; A464-V485 HydrophobicContact CB-CG2 4.24Å
465	E	98.3	Very high	96.8	Very high	32 Å²	32	60.1 Å²	60.1	15%	0.15	34%	0.336	C	S	.	.	H	α-helix	trans	-61.1	-44.6	174.8	-172.9	-175.4	175.4	0	0	111.9	L461 E462 L468 R469 V485 Q486 K489	L461-E465 PolarHBondContact O-N 3Å; E462-E465 PolarHBondContact O-N 3.48Å; E465-L468 PolarHBondContact O-N 3.31Å; E465-R469 WeakPolarHBondContact O-CB 3.34Å; E465-R469 PolarHBondContact O-N 2.81Å; E465-R469 IonicContact OE1-NH2 2.94Å; E465-R469 PolarHBondContact OE1-NH2 3.32Å; E465-V485 HydrophobicContact CB-CG1 3.94Å; E465-Q486 PolarHBondContact OE1-NE2 2.94Å; E465-Q486 PolarHBondContact OE2-NE2 2.7Å; E465-K489 IonicContact OE2-NZ 3.54Å; E465-K489 PolarHBondContact OE2-NZ 3.13Å
466	E	98.1	Very high	96.6	Very high	95 Å²	95	63.1 Å²	63.1	44%	0.444	35%	0.35	S	S	.	.	H	α-helix	trans	-68.1	-37	179.8	-171.7	56.8	-151	0	0	111.9	E462 A463 R469 S470	E462-E466 PolarHBondContact O-N 3.1Å; A463-E466 PolarHBondContact O-N 3.16Å; E466-R469 PolarHBondContact O-N 3.26Å; E466-R469 IonicContact OE2-CZ 2.58Å; E466-R469 IonicContact OE2-NE 3.76Å; E466-R469 IonicContact OE2-NH1 2.7Å; E466-R469 PolarHBondContact OE2-NH1 2.8Å; E466-S470 WeakPolarHBondContact O-CB 3.22Å; E466-S470 PolarHBondContact O-N 2.9Å; E466-S470 PolarHBondContact O-OG 3.47Å
467	Q	96.7	Very high	96.5	Very high	138 Å²	138	63 Å²	63	65%	0.645	34%	0.343	S	S	*	.	H	α-helix	trans	-61.5	-44.9	172.6	-74.5	175.4	5.8	0	0	112	A463 A464 S470 D471	A463-Q467 WeakPolarHBondContact O-CG 3.38Å; A463-Q467 PolarHBondContact O-N 3.42Å; A464-Q467 PolarHBondContact O-N 2.93Å; Q467-S470 PolarHBondContact O-N 3.36Å; Q467-S470 PolarHBondContact O-OG 3.09Å; Q467-D471 PolarHBondContact O-N 3.05Å; Q467-D471 VanDerWaalsContact O-N 3.15Å
468	L	97.4	Very high	96.4	Very high	19 Å²	19	65.3 Å²	65.3	10%	0.099	35%	0.354	C	S	.	.	H	α-helix	trans	-61.8	-46.2	175.1	-72.9	171.2	0	0	0	110.8	V431 A464 E465 S470 D471 H478 D481 V482 V485	V431-L468 HydrophobicContact CG2-CD1 4Å; V431-L468 HydrophobicContact CG2-CG 4.26Å; A464-L468 WeakPolarHBondContact O-CG 3.25Å; A464-L468 PolarHBondContact O-N 2.69Å; E465-L468 PolarHBondContact O-N 3.31Å; L468-S470 VanDerWaalsContact C-N 3.26Å; L468-S470 PolarHBondContact O-N 3.41Å; L468-D471 VanDerWaalsContact O-CB 3.31Å; L468-D471 WeakPolarHBondContact O-CB 3.36Å; L468-D471 PolarHBondContact O-N 3.45Å; L468-H478 PolarHBondContact O-CE1 3.18Å; L468-D481 HydrophobicContact CD1-CB 4.03Å; L468-D481 HydrophobicContact CD2-CB 3.98Å; L468-V482 HydrophobicContact CB-CG2 4.16Å; L468-V482 HydrophobicContact CD1-CG2 3.9Å; L468-V485 HydrophobicContact CD1-CG2 4.06Å
469	R	96.3	Very high	96.3	Very high	156 Å²	156	67.4 Å²	67.4	59%	0.589	37%	0.366	S	S	*	.	H	α-helix	trans	-61.3	-34.9	-178.8	-172.9	-175.1	-60.1	166.2	-2.2	113.2	E465 E466	E465-R469 WeakPolarHBondContact O-CB 3.34Å; E465-R469 PolarHBondContact O-N 2.81Å; E465-R469 IonicContact OE1-NH2 2.94Å; E465-R469 PolarHBondContact OE1-NH2 3.32Å; E466-R469 PolarHBondContact O-N 3.26Å; E466-R469 IonicContact OE2-CZ 2.58Å; E466-R469 IonicContact OE2-NE 3.76Å; E466-R469 IonicContact OE2-NH1 2.7Å; E466-R469 PolarHBondContact OE2-NH1 2.8Å
470	S	95.6	Very high	96.3	Very high	77 Å²	77	64.4 Å²	64.4	54%	0.538	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	2.5	-178.8	57.3	0	0	0	0	113.9	E466 Q467 L468 P472	E466-S470 WeakPolarHBondContact O-CB 3.22Å; E466-S470 PolarHBondContact O-N 2.9Å; E466-S470 PolarHBondContact O-OG 3.47Å; Q467-S470 PolarHBondContact O-N 3.36Å; Q467-S470 PolarHBondContact O-OG 3.09Å; L468-S470 VanDerWaalsContact C-N 3.26Å; L468-S470 PolarHBondContact O-N 3.41Å; S470-P472 VanDerWaalsContact O-CD 3.29Å; S470-P472 WeakPolarHBondContact O-CD 3.34Å
471	D	93.8	Very high	96.3	Very high	60 Å²	60	62.9 Å²	62.9	32%	0.321	34%	0.336	S	S	.	.			trans	-64.7	115.6	179.6	-173	-2.3	0	0	0	111	Q467 L468 D473	Q467-D471 PolarHBondContact O-N 3.05Å; Q467-D471 VanDerWaalsContact O-N 3.15Å; L468-D471 VanDerWaalsContact O-CB 3.31Å; L468-D471 WeakPolarHBondContact O-CB 3.36Å; L468-D471 PolarHBondContact O-N 3.45Å; D471-D473 VanDerWaalsContact C-N 3.26Å; D471-D473 PolarHBondContact O-N 3.39Å; D471-D473 PolarHBondContact OD1-N 2.89Å
472	P	92.8	Very high	96.2	Very high	130 Å²	130	64 Å²	64	84%	0.844	34%	0.342	S	S	*	.	S	Bend	trans	-74.9	-14.6	179.7	32.2	-36.5	0	0	0	113.4	S470	S470-P472 VanDerWaalsContact O-CD 3.29Å; S470-P472 WeakPolarHBondContact O-CD 3.34Å
473	D	92.4	Very high	96.2	Very high	113 Å²	113	59.7 Å²	59.7	60%	0.604	32%	0.322	S	S	*	.	S	Bend	trans	-133.1	66.9	-179.4	-173.9	31.9	0	0	0	111.4	D471 S475	D471-D473 VanDerWaalsContact C-N 3.26Å; D471-D473 PolarHBondContact O-N 3.39Å; D471-D473 PolarHBondContact OD1-N 2.89Å; D473-S475 PolarHBondContact O-N 3.38Å
474	P	92.7	Very high	96.2	Very high	69 Å²	69	57.3 Å²	57.3	45%	0.448	30%	0.302	S	S	.	.			trans	-59.3	125.5	-176.8	-23.6	34.5	0	0	0	112.3	H478	P474-H478 HydrophobicContact CB-CB 3.83Å
475	S	93.2	Very high	96.3	Very high	37 Å²	37	57.1 Å²	57.1	26%	0.259	30%	0.301	S	S	.	.			trans	-69.7	169.4	175.9	80.1	0	0	0	0	112.8	D473 F477 H478	D473-S475 PolarHBondContact O-N 3.38Å; S475-F477 PolarHBondContact O-N 3.28Å; S475-F477 PolarHBondContact OG-N 3.42Å; S475-H478 VanDerWaalsContact O-CB 3.24Å; S475-H478 WeakPolarHBondContact O-CB 3.31Å; S475-H478 PolarHBondContact O-N 3.27Å
476	E	93.8	Very high	96.3	Very high	125 Å²	125	56.3 Å²	56.3	58%	0.584	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-19.6	173.2	68.7	-177.7	145.5	0	0	113.9	H518	E476-H518 IonicContact OE2-CE1 3.88Å; E476-H518 IonicContact OE2-NE2 2.7Å
477	F	95.8	Very high	96.3	Very high	22 Å²	22	51.8 Å²	51.8	10%	0.096	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-0.6	177.5	-63.7	-89.6	0	0	0	113.6	R421 L428 S475 T479 D480 D481 H518	R421-F477 HydrophobicContact CG-CD1 4.38Å; R421-F477 HydrophobicContact CG-CD2 4.45Å; R421-F477 HydrophobicContact CG-CE1 3.91Å; R421-F477 HydrophobicContact CG-CE2 4.04Å; R421-F477 HydrophobicContact CG-CZ 3.74Å; L428-F477 HydrophobicContact CD1-CD2 3.79Å; L428-F477 HydrophobicContact CD1-CE2 3.48Å; L428-F477 VanDerWaalsContact CD1-CE2 3.48Å; S475-F477 PolarHBondContact O-N 3.28Å; S475-F477 PolarHBondContact OG-N 3.42Å; F477-T479 PolarHBondContact O-N 3.17Å; F477-D480 WeakPolarHBondContact O-CB 3.48Å; F477-D480 PolarHBondContact O-N 3.43Å; F477-D480 VanDerWaalsContact O-N 3.11Å; F477-D481 PolarHBondContact O-N 3.31Å; F477-H518 HydrophobicContact CD1-CB 3.94Å; F477-H518 AromaticContact CD1-CD2 3.61Å; F477-H518 AromaticContact CD1-CG 3.71Å; F477-H518 HydrophobicContact CE1-CB 3.64Å; F477-H518 AromaticContact CE1-CD2 3.62Å; F477-H518 AromaticContact CE1-CE1 3.94Å; F477-H518 AromaticContact CE1-CG 3.31Å; F477-H518 AromaticContact CE1-ND1 3.54Å; F477-H518 AromaticContact CZ-CE1 3.91Å; F477-H518 AromaticContact CZ-ND1 3.83Å
478	H	96.6	Very high	96.4	Very high	48 Å²	48	45.2 Å²	45.2	22%	0.222	25%	0.245	C	C	.	.	H	α-helix	trans	-55.4	-47.3	-171.3	175.9	84.6	0	0	0	113	L468 P474 S475 D480 D481 V482	L468-H478 PolarHBondContact O-CE1 3.18Å; P474-H478 HydrophobicContact CB-CB 3.83Å; S475-H478 VanDerWaalsContact O-CB 3.24Å; S475-H478 WeakPolarHBondContact O-CB 3.31Å; S475-H478 PolarHBondContact O-N 3.27Å; H478-D480 PolarHBondContact O-N 3.16Å; H478-D481 PolarHBondContact O-N 3.27Å; H478-V482 WeakPolarHBondContact O-CG2 3.18Å; H478-V482 PolarHBondContact O-N 3.39Å
479	T	97.5	Very high	96.5	Very high	45 Å²	45	45.4 Å²	45.4	28%	0.276	25%	0.245	S	C	.	.	H	α-helix	trans	-62.8	-43.3	178.1	-57.2	0	0	0	0	112.1	F477 V482 C483 R512 D515	F477-T479 PolarHBondContact O-N 3.17Å; T479-V482 PolarHBondContact O-N 3.11Å; T479-C483 WeakPolarHBondContact O-CB 3.4Å; T479-C483 PolarHBondContact O-N 3.2Å; T479-C483 PolarHBondContact O-SG 3.48Å; T479-R512 HydrophobicContact CG2-CB 4.43Å; T479-D515 HydrophobicContact CG2-CB 3.74Å
480	D	97.8	Very high	96.6	Very high	1 Å²	1	38 Å²	38	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-45.3	176.7	-63.7	-130.9	0	0	0	110.3	F477 H478 C483 V484 K517 H518 D519	F477-D480 WeakPolarHBondContact O-CB 3.48Å; F477-D480 PolarHBondContact O-N 3.43Å; F477-D480 VanDerWaalsContact O-N 3.11Å; H478-D480 PolarHBondContact O-N 3.16Å; D480-C483 PolarHBondContact O-N 2.95Å; D480-V484 WeakPolarHBondContact O-CG2 3.4Å; D480-V484 PolarHBondContact O-N 3.18Å; D480-K517 PolarHBondContact OD1-N 2.92Å; D480-K517 PolarHBondContact OD2-N 3.35Å; D480-H518 WeakPolarHBondContact OD1-CA 3.4Å; D480-H518 WeakPolarHBondContact OD1-CB 3.37Å; D480-H518 PolarHBondContact OD1-N 3.23Å; D480-D519 HydrophobicContact CB-CB 4.3Å; D480-D519 PolarHBondContact OD1-N 2.89Å
481	D	98.4	Very high	96.7	Very high	7 Å²	7	34.7 Å²	34.7	4%	0.037	19%	0.193	C	C	.	.	H	α-helix	trans	-64.4	-42.9	178.2	-74.3	-28.3	0	0	0	112.1	R421 V431 L468 F477 H478 C483 V484 V485	R421-D481 IonicContact CZ-OD1 2.6Å; R421-D481 IonicContact CZ-OD2 3.61Å; R421-D481 IonicContact NH1-OD1 3.49Å; R421-D481 PolarHBondContact NH1-OD1 3.37Å; R421-D481 IonicContact NH1-OD2 3.08Å; R421-D481 PolarHBondContact NH1-OD2 3.02Å; R421-D481 IonicContact NH2-OD1 3.8Å; R421-D481 IonicContact NH2-OD2 3.28Å; R421-D481 PolarHBondContact NH2-OD2 2.81Å; V431-D481 HydrophobicContact CB-CB 4.34Å; V431-D481 HydrophobicContact CG1-CB 3.95Å; L468-D481 HydrophobicContact CD1-CB 4.03Å; L468-D481 HydrophobicContact CD2-CB 3.98Å; F477-D481 PolarHBondContact O-N 3.31Å; H478-D481 PolarHBondContact O-N 3.27Å; D481-C483 VanDerWaalsContact C-N 3.29Å; D481-C483 PolarHBondContact O-N 3.32Å; D481-V484 PolarHBondContact O-N 3.42Å; D481-V485 WeakPolarHBondContact O-CG2 3.33Å; D481-V485 PolarHBondContact O-N 3.31Å
482	V	98.5	Very high	97	Very high	23 Å²	23	31.8 Å²	31.8	14%	0.139	18%	0.178	C	C	.	.	H	α-helix	trans	-60.5	-42.2	173	174.1	0	0	0	0	110.3	L468 H478 T479 V485 Q486 F508	L468-V482 HydrophobicContact CB-CG2 4.16Å; L468-V482 HydrophobicContact CD1-CG2 3.9Å; H478-V482 WeakPolarHBondContact O-CG2 3.18Å; H478-V482 PolarHBondContact O-N 3.39Å; T479-V482 PolarHBondContact O-N 3.11Å; V482-V485 PolarHBondContact O-N 3.49Å; V482-Q486 HydrophobicContact CG1-CG 4.3Å; V482-Q486 WeakPolarHBondContact O-CG 3.3Å; V482-Q486 PolarHBondContact O-N 2.86Å; V482-F508 HydrophobicContact CG1-CE1 3.71Å; V482-F508 HydrophobicContact CG1-CZ 3.9Å
483	C	98.7	Very high	97.3	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-68	-37.1	179.6	-70.8	0	0	0	0	112.8	T479 D480 D481 Q486 M487 V509 I516 L522	T479-C483 WeakPolarHBondContact O-CB 3.4Å; T479-C483 PolarHBondContact O-N 3.2Å; T479-C483 PolarHBondContact O-SG 3.48Å; D480-C483 PolarHBondContact O-N 2.95Å; D481-C483 VanDerWaalsContact C-N 3.29Å; D481-C483 PolarHBondContact O-N 3.32Å; C483-Q486 PolarHBondContact O-N 3.43Å; C483-M487 WeakPolarHBondContact O-CB 3.21Å; C483-M487 PolarHBondContact O-N 3.32Å; C483-V509 HydrophobicContact CB-CG1 4.03Å; C483-V509 HydrophobicContact CB-CG2 4.17Å; C483-V509 VanDerWaalsContact O-CG2 3.32Å; C483-V509 WeakPolarHBondContact O-CG2 3.36Å; C483-I516 HydrophobicContact CB-CD1 4.27Å; C483-L522 HydrophobicContact CB-CD1 3.85Å
484	V	98.6	Very high	97.5	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-56.9	-52.3	170.2	171.8	0	0	0	0	109.6	V432 E436 D480 D481 Q486 M487 L488 L522	V432-V484 HydrophobicContact CG2-CG1 4.39Å; E436-V484 HydrophobicContact CB-CG1 4.46Å; E436-V484 HydrophobicContact CG-CG1 4.43Å; D480-V484 WeakPolarHBondContact O-CG2 3.4Å; D480-V484 PolarHBondContact O-N 3.18Å; D481-V484 PolarHBondContact O-N 3.42Å; V484-Q486 PolarHBondContact O-N 2.96Å; V484-M487 PolarHBondContact O-N 3.09Å; V484-L488 HydrophobicContact CG1-CD1 3.88Å; V484-L488 HydrophobicContact CG1-CG 4.4Å; V484-L488 VanDerWaalsContact O-CG 3.29Å; V484-L488 WeakPolarHBondContact O-CG 3.47Å; V484-L488 PolarHBondContact O-N 2.92Å; V484-L522 HydrophobicContact CB-CD2 4.46Å; V484-L522 HydrophobicContact CG2-CD1 4.03Å; V484-L522 HydrophobicContact CG2-CD2 3.84Å; V484-L522 HydrophobicContact CG2-CG 4.44Å
485	V	98.8	Very high	97.7	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.006	11%	0.108	C	C	.	.	H	α-helix	trans	-60.1	-46.5	-178.9	173.2	0	0	0	0	111.1	V431 V432 L461 A464 E465 L468 D481 V482 M487 L488 K489	V431-V485 HydrophobicContact CG1-CG2 4.02Å; V431-V485 HydrophobicContact CG2-CG2 3.93Å; V432-V485 HydrophobicContact CG2-CG2 4.41Å; L461-V485 HydrophobicContact CB-CG1 4.37Å; L461-V485 HydrophobicContact CD2-CG1 4.44Å; L461-V485 VanDerWaalsContact O-CG1 3.31Å; L461-V485 WeakPolarHBondContact O-CG1 3.36Å; A464-V485 HydrophobicContact CB-CG2 4.24Å; E465-V485 HydrophobicContact CB-CG1 3.94Å; L468-V485 HydrophobicContact CD1-CG2 4.06Å; D481-V485 WeakPolarHBondContact O-CG2 3.33Å; D481-V485 PolarHBondContact O-N 3.31Å; V482-V485 PolarHBondContact O-N 3.49Å; V485-M487 PolarHBondContact O-N 3.42Å; V485-L488 PolarHBondContact O-N 3.26Å; V485-K489 HydrophobicContact CG1-CD 4.08Å; V485-K489 HydrophobicContact CG1-CG 4.26Å; V485-K489 VanDerWaalsContact O-CG 3.31Å; V485-K489 WeakPolarHBondContact O-CG 3.45Å; V485-K489 PolarHBondContact O-N 3.24Å
486	Q	98.9	Very high	98	Very high	16 Å²	16	20.8 Å²	20.8	8%	0.075	10%	0.104	C	C	.	.	H	α-helix	trans	-62.2	-43.2	178.3	-68.7	-61.1	-38.7	0	0	112.4	E465 V482 C483 V484 L488 K489 G490 C505 F508 V509	E465-Q486 PolarHBondContact OE1-NE2 2.94Å; E465-Q486 PolarHBondContact OE2-NE2 2.7Å; V482-Q486 HydrophobicContact CG1-CG 4.3Å; V482-Q486 WeakPolarHBondContact O-CG 3.3Å; V482-Q486 PolarHBondContact O-N 2.86Å; C483-Q486 PolarHBondContact O-N 3.43Å; V484-Q486 PolarHBondContact O-N 2.96Å; Q486-L488 VanDerWaalsContact C-N 3.35Å; Q486-L488 PolarHBondContact O-N 3.16Å; Q486-K489 PolarHBondContact O-N 2.88Å; Q486-G490 PolarHBondContact O-N 3.31Å; Q486-C505 WeakPolarHBondContact O-CB 3.45Å; Q486-C505 PolarHBondContact OE1-SG 3.43Å; Q486-F508 HydrophobicContact CB-CD1 4.11Å; Q486-F508 HydrophobicContact CG-CD1 3.66Å; Q486-F508 HydrophobicContact CG-CE1 3.95Å; Q486-F508 HydrophobicContact CG-CG 4.31Å; Q486-V509 HydrophobicContact CB-CG2 3.8Å
487	M	98.8	Very high	98.2	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.1	-46.6	175.9	-172.2	-172.1	80.3	0	0	111.3	Y439 C483 V484 V485 G490 L491 V509 L522 F525 T526	Y439-M487 HydrophobicContact CD1-CE 3.42Å; Y439-M487 VanDerWaalsContact CD1-CE 3.42Å; Y439-M487 HydrophobicContact CE1-CE 3.46Å; Y439-M487 VanDerWaalsContact CE1-CE 3.46Å; Y439-M487 HydrophobicContact CE1-SD 4.22Å; Y439-M487 HydrophobicContact CG-CE 3.99Å; C483-M487 WeakPolarHBondContact O-CB 3.21Å; C483-M487 PolarHBondContact O-N 3.32Å; V484-M487 PolarHBondContact O-N 3.09Å; V485-M487 PolarHBondContact O-N 3.42Å; M487-G490 PolarHBondContact O-N 3.32Å; M487-L491 PolarHBondContact O-N 2.9Å; M487-L491 VanDerWaalsContact O-N 3.11Å; M487-V509 HydrophobicContact CB-CG2 4.29Å; M487-L522 HydrophobicContact CE-CD2 4.46Å; M487-L522 HydrophobicContact SD-CD2 4.09Å; M487-F525 HydrophobicContact SD-CB 4.35Å; M487-T526 WeakPolarHBondContact CG-OG1 3.47Å; M487-T526 PolarHBondContact SD-OG1 3.08Å
488	L	98.8	Very high	98.3	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-66.9	-37.2	179.4	-61.7	177.8	0	0	0	112.4	V432 L435 E436 Y439 F444 L461 V484 V485 Q486 L491 C492	V432-L488 HydrophobicContact CG2-CD1 3.72Å; L435-L488 HydrophobicContact CB-CD1 4.06Å; E436-L488 HydrophobicContact CB-CD1 4.49Å; Y439-L488 HydrophobicContact CG-CD2 4.28Å; F444-L488 HydrophobicContact CE2-CD2 3.71Å; F444-L488 HydrophobicContact CZ-CB 4.21Å; F444-L488 HydrophobicContact CZ-CD2 3.76Å; F444-L488 HydrophobicContact CZ-CG 4.45Å; L461-L488 HydrophobicContact CD1-CB 3.76Å; L461-L488 HydrophobicContact CD2-CB 3.74Å; L461-L488 HydrophobicContact CD2-CD1 3.99Å; L461-L488 HydrophobicContact CG-CB 4.44Å; V484-L488 HydrophobicContact CG1-CD1 3.88Å; V484-L488 HydrophobicContact CG1-CG 4.4Å; V484-L488 VanDerWaalsContact O-CG 3.29Å; V484-L488 WeakPolarHBondContact O-CG 3.47Å; V484-L488 PolarHBondContact O-N 2.92Å; V485-L488 PolarHBondContact O-N 3.26Å; Q486-L488 VanDerWaalsContact C-N 3.35Å; Q486-L488 PolarHBondContact O-N 3.16Å; L488-L491 HydrophobicContact CD2-CD1 4.08Å; L488-L491 WeakPolarHBondContact O-CB 3.46Å; L488-L491 PolarHBondContact O-N 3.43Å; L488-C492 PolarHBondContact O-N 3.18Å; L488-C492 VanDerWaalsContact O-N 3.12Å
489	K	98.8	Very high	98.3	Very high	23 Å²	23	20.5 Å²	20.5	10%	0.1	12%	0.115	C	C	.	.	H	α-helix	trans	-61.9	-44.8	171.9	-73.4	-176.5	73.5	-176.5	0	111	L458 L461 E465 V485 Q486 L491 C492 L493	L458-K489 HydrophobicContact CD1-CB 4.19Å; L458-K489 HydrophobicContact CD1-CG 4Å; L461-K489 HydrophobicContact CB-CD 4.4Å; L461-K489 HydrophobicContact CB-CG 3.65Å; L461-K489 HydrophobicContact CD1-CG 4.14Å; L461-K489 HydrophobicContact CG-CG 4.46Å; E465-K489 IonicContact OE2-NZ 3.54Å; E465-K489 PolarHBondContact OE2-NZ 3.13Å; V485-K489 HydrophobicContact CG1-CD 4.08Å; V485-K489 HydrophobicContact CG1-CG 4.26Å; V485-K489 VanDerWaalsContact O-CG 3.31Å; V485-K489 WeakPolarHBondContact O-CG 3.45Å; V485-K489 PolarHBondContact O-N 3.24Å; Q486-K489 PolarHBondContact O-N 2.88Å; K489-L491 PolarHBondContact O-N 3.17Å; K489-C492 PolarHBondContact O-N 2.88Å; K489-L493 WeakPolarHBondContact O-CB 3.5Å; K489-L493 WeakPolarHBondContact O-CG 3.33Å; K489-L493 PolarHBondContact O-N 3.28Å
490	G	98.7	Very high	98.4	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-56.7	-38	176.5	0	0	0	0	0	112.6	Q486 M487 T494 A502	Q486-G490 PolarHBondContact O-N 3.31Å; M487-G490 PolarHBondContact O-N 3.32Å; G490-T494 WeakPolarHBondContact O-CB 3.31Å; G490-T494 PolarHBondContact O-N 2.88Å; G490-T494 PolarHBondContact O-OG1 3.4Å; G490-A502 WeakPolarHBondContact O-CB 3.45Å
491	L	98.3	Very high	98.4	Very high	7 Å²	7	28 Å²	28	4%	0.037	15%	0.153	C	C	.	.	H	α-helix	trans	-64.6	-50.7	173.7	-71.8	159.4	0	0	0	112.3	Y439 F444 M487 L488 K489 L493 T494 Q495 F506 E529	Y439-L491 HydrophobicContact CD2-CD1 3.26Å; Y439-L491 HydrophobicContact CD2-CD2 4.37Å; Y439-L491 HydrophobicContact CD2-CG 4.46Å; Y439-L491 HydrophobicContact CE2-CD1 3.55Å; Y439-L491 HydrophobicContact CE2-CD2 4.09Å; Y439-L491 HydrophobicContact CE2-CG 4.46Å; Y439-L491 HydrophobicContact CG-CD1 4.01Å; F444-L491 HydrophobicContact CB-CB 4.34Å; F444-L491 HydrophobicContact CD1-CB 3.82Å; F444-L491 HydrophobicContact CD2-CD1 4.24Å; F444-L491 HydrophobicContact CE1-CB 4.29Å; F444-L491 HydrophobicContact CE2-CD1 4.49Å; F444-L491 HydrophobicContact CG-CB 4.03Å; F444-L491 HydrophobicContact CG-CD1 4.35Å; M487-L491 PolarHBondContact O-N 2.9Å; M487-L491 VanDerWaalsContact O-N 3.11Å; L488-L491 HydrophobicContact CD2-CD1 4.08Å; L488-L491 WeakPolarHBondContact O-CB 3.46Å; L488-L491 PolarHBondContact O-N 3.43Å; K489-L491 PolarHBondContact O-N 3.17Å; L491-L493 PolarHBondContact O-N 2.96Å; L491-T494 WeakPolarHBondContact O-CB 3.24Å; L491-T494 PolarHBondContact O-N 3.49Å; L491-Q495 WeakPolarHBondContact O-CG 3.27Å; L491-Q495 PolarHBondContact O-N 3.37Å; L491-F506 HydrophobicContact CG-CE1 4.48Å; L491-F506 HydrophobicContact CG-CZ 4.48Å; L491-E529 HydrophobicContact CD2-CG 3.99Å
492	C	98.8	Very high	98.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.5	-49	175.4	-74.4	0	0	0	0	111.8	F444 T454 L458 L488 K489 T494 Q495 L496	F444-C492 VanDerWaalsContact CE1-SG 3.6Å; T454-C492 HydrophobicContact CG2-CB 3.94Å; L458-C492 HydrophobicContact CB-CB 4.06Å; L458-C492 HydrophobicContact CD1-CB 4.2Å; L488-C492 PolarHBondContact O-N 3.18Å; L488-C492 VanDerWaalsContact O-N 3.12Å; K489-C492 PolarHBondContact O-N 2.88Å; C492-T494 VanDerWaalsContact C-N 3.26Å; C492-T494 PolarHBondContact O-N 3.43Å; C492-Q495 PolarHBondContact O-N 3.41Å; C492-Q495 VanDerWaalsContact O-N 3.14Å; C492-L496 WeakPolarHBondContact O-CB 3.36Å; C492-L496 VanDerWaalsContact O-CG 3.28Å; C492-L496 WeakPolarHBondContact O-CG 3.46Å; C492-L496 PolarHBondContact O-N 2.96Å
493	L	98.8	Very high	98.4	Very high	9 Å²	9	29.1 Å²	29.1	5%	0.047	16%	0.157	C	C	.	.	H	α-helix	trans	-61	-36.9	179.9	-68.5	166.9	0	0	0	111.6	L458 K489 L491 L496 G497 R498 Q501 A502	L458-L493 HydrophobicContact CD1-CG 4.4Å; L458-L493 HydrophobicContact CD2-CD2 3.86Å; L458-L493 HydrophobicContact CD2-CG 4.47Å; K489-L493 WeakPolarHBondContact O-CB 3.5Å; K489-L493 WeakPolarHBondContact O-CG 3.33Å; K489-L493 PolarHBondContact O-N 3.28Å; L491-L493 PolarHBondContact O-N 2.96Å; L493-L496 PolarHBondContact O-N 3.41Å; L493-G497 PolarHBondContact O-N 2.97Å; L493-R498 HydrophobicContact CB-CB 4.25Å; L493-R498 HydrophobicContact CD2-CB 3.99Å; L493-R498 HydrophobicContact CD2-CG 4.45Å; L493-R498 WeakPolarHBondContact O-CA 3.43Å; L493-R498 PolarHBondContact O-N 3.41Å; L493-Q501 HydrophobicContact CD1-CB 3.8Å; L493-Q501 HydrophobicContact CD2-CB 4.18Å; L493-Q501 HydrophobicContact CG-CB 4.44Å; L493-A502 HydrophobicContact CB-CB 3.82Å
494	T	98.1	Very high	98.4	Very high	22 Å²	22	34.3 Å²	34.3	14%	0.135	18%	0.184	C	C	.	.	H	α-helix	trans	-62.6	-49.1	173.8	-59.6	0	0	0	0	111	G490 L491 C492 L496 G497 A502 L533 L536	G490-T494 WeakPolarHBondContact O-CB 3.31Å; G490-T494 PolarHBondContact O-N 2.88Å; G490-T494 PolarHBondContact O-OG1 3.4Å; L491-T494 WeakPolarHBondContact O-CB 3.24Å; L491-T494 PolarHBondContact O-N 3.49Å; C492-T494 VanDerWaalsContact C-N 3.26Å; C492-T494 PolarHBondContact O-N 3.43Å; T494-L496 VanDerWaalsContact C-N 3.26Å; T494-L496 PolarHBondContact O-N 3.43Å; T494-G497 PolarHBondContact O-N 3.33Å; T494-A502 VanDerWaalsContact OG1-CB 3.3Å; T494-A502 WeakPolarHBondContact OG1-CB 3.42Å; T494-L533 HydrophobicContact CG2-CD1 3.86Å; T494-L536 HydrophobicContact CG2-CD2 4.12Å
495	Q	97.1	Very high	98.4	Very high	52 Å²	52	34.7 Å²	34.7	24%	0.243	19%	0.186	C	C	.	.	H	α-helix	trans	-63.8	-31.9	179	-63.1	-54.6	-52.9	0	0	112.6	F444 M445 T454 L491 C492 G497	F444-Q495 WeakPolarHBondContact O-CG 3.37Å; M445-Q495 PolarHBondContact SD-NE2 2.9Å; T454-Q495 HydrophobicContact CG2-CB 4.16Å; L491-Q495 WeakPolarHBondContact O-CG 3.27Å; L491-Q495 PolarHBondContact O-N 3.37Å; C492-Q495 PolarHBondContact O-N 3.41Å; C492-Q495 VanDerWaalsContact O-N 3.14Å; Q495-G497 PolarHBondContact O-N 3.37Å
496	L	98.1	Very high	98.4	Very high	35 Å²	35	34.7 Å²	34.7	18%	0.183	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	1.3	175.2	-65.9	166.7	0	0	0	113.5	P451 T454 E455 L458 C492 L493 T494 R498	P451-L496 HydrophobicContact CB-CD2 4.03Å; T454-L496 HydrophobicContact CG2-CD1 4.05Å; T454-L496 HydrophobicContact CG2-CD2 4.07Å; T454-L496 HydrophobicContact CG2-CG 3.75Å; E455-L496 HydrophobicContact CG-CD1 4.22Å; E455-L496 HydrophobicContact CG-CD2 3.95Å; E455-L496 WeakPolarHBondContact OE1-CD1 3.24Å; L458-L496 HydrophobicContact CD2-CD1 3.95Å; C492-L496 WeakPolarHBondContact O-CB 3.36Å; C492-L496 VanDerWaalsContact O-CG 3.28Å; C492-L496 WeakPolarHBondContact O-CG 3.46Å; C492-L496 PolarHBondContact O-N 2.96Å; L493-L496 PolarHBondContact O-N 3.41Å; T494-L496 VanDerWaalsContact C-N 3.26Å; T494-L496 PolarHBondContact O-N 3.43Å; L496-R498 HydrophobicContact CB-CG 4.21Å; L496-R498 PolarHBondContact O-N 2.9Å
497	G	97.6	Very high	98.4	Very high	53 Å²	53	37.4 Å²	37.4	55%	0.546	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	74	8.7	-178.5	0	0	0	0	0	114.8	L493 T494 Q495 L499	L493-G497 PolarHBondContact O-N 2.97Å; T494-G497 PolarHBondContact O-N 3.33Å; Q495-G497 PolarHBondContact O-N 3.37Å; G497-L499 PolarHBondContact O-N 2.68Å
498	R	98.2	Very high	98.4	Very high	95 Å²	95	40.6 Å²	40.6	36%	0.358	22%	0.215	S	C	.	.			trans	-84.7	59.5	179.2	-56.9	-176.6	-168.9	178.5	0.8	111.1	E455 L493 L496 V500 Q501 A502	E455-R498 VanDerWaalsContact CD-NH2 3.28Å; E455-R498 IonicContact OE1-CZ 3.82Å; E455-R498 IonicContact OE1-NE 2.98Å; E455-R498 IonicContact OE1-NH2 2.61Å; E455-R498 PolarHBondContact OE1-NH2 3.05Å; E455-R498 IonicContact OE2-CZ 3Å; E455-R498 IonicContact OE2-NH2 2.83Å; E455-R498 PolarHBondContact OE2-NH2 3.1Å; L493-R498 HydrophobicContact CB-CB 4.25Å; L493-R498 HydrophobicContact CD2-CB 3.99Å; L493-R498 HydrophobicContact CD2-CG 4.45Å; L493-R498 WeakPolarHBondContact O-CA 3.43Å; L493-R498 PolarHBondContact O-N 3.41Å; L496-R498 HydrophobicContact CB-CG 4.21Å; L496-R498 PolarHBondContact O-N 2.9Å; R498-V500 VanDerWaalsContact C-N 3.34Å; R498-V500 PolarHBondContact O-N 3.43Å; R498-Q501 VanDerWaalsContact CD-OE1 3.25Å; R498-Q501 PolarHBondContact O-N 2.92Å; R498-A502 PolarHBondContact O-N 3.32Å
499	L	98.1	Very high	98.4	Very high	41 Å²	41	40.6 Å²	40.6	22%	0.215	22%	0.215	C	C	.	.	H	α-helix	trans	-64.2	-30.7	-163.4	-50.9	-170.5	0	0	0	114.8	G497 E503 L533 L536 K537	G497-L499 PolarHBondContact O-N 2.68Å; L499-E503 WeakPolarHBondContact O-CB 3.4Å; L499-E503 PolarHBondContact O-N 3.46Å; L499-E503 VanDerWaalsContact O-N 3.09Å; L499-L533 HydrophobicContact CB-CD1 4.03Å; L499-L533 HydrophobicContact CD2-CD1 3.75Å; L499-L533 HydrophobicContact CG-CD1 4.35Å; L499-L536 HydrophobicContact CD1-CD2 4.36Å; L499-L536 HydrophobicContact CD2-CD2 3.79Å; L499-K537 HydrophobicContact CD1-CG 3.84Å
500	V	98	Very high	98.4	Very high	103 Å²	103	41.4 Å²	41.4	62%	0.624	22%	0.22	S	C	*	.	H	α-helix	trans	-70.2	-43.7	177.7	176.8	0	0	0	0	110.7	R498 A502 E503 I504	R498-V500 VanDerWaalsContact C-N 3.34Å; R498-V500 PolarHBondContact O-N 3.43Å; V500-A502 VanDerWaalsContact C-N 3.34Å; V500-E503 PolarHBondContact O-N 3.05Å; V500-I504 HydrophobicContact CG1-CD1 4.36Å; V500-I504 WeakPolarHBondContact O-CG1 3.16Å; V500-I504 PolarHBondContact O-N 3.19Å; V500-I504 VanDerWaalsContact O-N 3.1Å
501	Q	98.5	Very high	98.4	Very high	100 Å²	100	45.5 Å²	45.5	47%	0.467	25%	0.249	S	C	.	.	H	α-helix	trans	-66.8	-39.3	177.7	-63.6	177.2	-43.1	0	0	110.8	L493 R498 E503 I504 C505	L493-Q501 HydrophobicContact CD1-CB 3.8Å; L493-Q501 HydrophobicContact CD2-CB 4.18Å; L493-Q501 HydrophobicContact CG-CB 4.44Å; R498-Q501 VanDerWaalsContact CD-OE1 3.25Å; R498-Q501 PolarHBondContact O-N 2.92Å; Q501-E503 VanDerWaalsContact C-N 3.34Å; Q501-E503 PolarHBondContact O-N 2.91Å; Q501-I504 PolarHBondContact O-N 3.26Å; Q501-C505 PolarHBondContact O-N 2.95Å; Q501-C505 VanDerWaalsContact O-N 3.09Å
502	A	98.7	Very high	98.4	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58.1	-45.7	173.8	0	0	0	0	0	112.3	G490 L493 T494 R498 V500 I504 C505 F506 L533	G490-A502 WeakPolarHBondContact O-CB 3.45Å; L493-A502 HydrophobicContact CB-CB 3.82Å; T494-A502 VanDerWaalsContact OG1-CB 3.3Å; T494-A502 WeakPolarHBondContact OG1-CB 3.42Å; R498-A502 PolarHBondContact O-N 3.32Å; V500-A502 VanDerWaalsContact C-N 3.34Å; A502-I504 VanDerWaalsContact C-N 3.33Å; A502-I504 PolarHBondContact O-N 3.38Å; A502-C505 WeakPolarHBondContact O-CB 3.25Å; A502-C505 PolarHBondContact O-N 2.94Å; A502-F506 HydrophobicContact CB-CE2 4.28Å; A502-F506 VanDerWaalsContact O-CD2 3.28Å; A502-F506 WeakPolarHBondContact O-CD2 3.46Å; A502-F506 WeakPolarHBondContact O-CG 3.44Å; A502-F506 PolarHBondContact O-N 2.88Å; A502-L533 HydrophobicContact CB-CD1 4.28Å; A502-L533 HydrophobicContact CB-CD2 4.17Å
503	E	98.6	Very high	98.3	Very high	54 Å²	54	54.2 Å²	54.2	25%	0.252	29%	0.285	S	S	.	.	H	α-helix	trans	-61.9	-38.4	177.3	-178.2	165.8	-148.4	0	0	112.5	L499 V500 Q501 F506 N507 L530 L533 H534 K537	L499-E503 WeakPolarHBondContact O-CB 3.4Å; L499-E503 PolarHBondContact O-N 3.46Å; L499-E503 VanDerWaalsContact O-N 3.09Å; V500-E503 PolarHBondContact O-N 3.05Å; Q501-E503 VanDerWaalsContact C-N 3.34Å; Q501-E503 PolarHBondContact O-N 2.91Å; E503-F506 PolarHBondContact O-N 3.44Å; E503-N507 VanDerWaalsContact CG-ND2 3.28Å; E503-N507 WeakPolarHBondContact CG-ND2 3.45Å; E503-N507 WeakPolarHBondContact O-CB 3.43Å; E503-N507 PolarHBondContact O-N 2.93Å; E503-N507 PolarHBondContact O-ND2 3.07Å; E503-L530 HydrophobicContact CG-CD1 4.12Å; E503-L533 HydrophobicContact CB-CD2 3.69Å; E503-H534 IonicContact OE1-CE1 3.96Å; E503-H534 PolarHBondContact OE1-CE1 3.45Å; E503-H534 IonicContact OE1-NE2 2.79Å; E503-K537 VanDerWaalsContact CD-NZ 3.29Å; E503-K537 IonicContact OE1-NZ 2.74Å; E503-K537 IonicContact OE2-NZ 3.7Å; E503-K537 PolarHBondContact OE2-NZ 3.36Å
504	I	98.7	Very high	98.2	Very high	109 Å²	109	63.4 Å²	63.4	56%	0.559	32%	0.324	S	S	*	.	H	α-helix	trans	-61.5	-47.2	174.8	-68.2	166.1	0	0	0	110.4	V500 Q501 A502 F506 N507 F508	V500-I504 HydrophobicContact CG1-CD1 4.36Å; V500-I504 WeakPolarHBondContact O-CG1 3.16Å; V500-I504 PolarHBondContact O-N 3.19Å; V500-I504 VanDerWaalsContact O-N 3.1Å; Q501-I504 PolarHBondContact O-N 3.26Å; A502-I504 VanDerWaalsContact C-N 3.33Å; A502-I504 PolarHBondContact O-N 3.38Å; I504-F506 PolarHBondContact O-N 2.72Å; I504-N507 PolarHBondContact O-N 3.05Å; I504-F508 WeakPolarHBondContact O-CB 3.38Å; I504-F508 PolarHBondContact O-N 3.12Å
505	C	98.8	Very high	98.1	Very high	8 Å²	8	65.7 Å²	65.7	5%	0.054	34%	0.336	C	S	.	.	H	α-helix	trans	-59.6	-45.3	177	-72.3	0	0	0	0	112.1	Q486 Q501 A502 F508 V509	Q486-C505 WeakPolarHBondContact O-CB 3.45Å; Q486-C505 PolarHBondContact OE1-SG 3.43Å; Q501-C505 PolarHBondContact O-N 2.95Å; Q501-C505 VanDerWaalsContact O-N 3.09Å; A502-C505 WeakPolarHBondContact O-CB 3.25Å; A502-C505 PolarHBondContact O-N 2.94Å; C505-F508 WeakPolarHBondContact O-CB 3.45Å; C505-F508 PolarHBondContact O-N 3.41Å; C505-V509 PolarHBondContact O-N 3.09Å
506	F	98.8	Very high	98.1	Very high	1 Å²	1	63.9 Å²	63.9	0%	0.004	33%	0.327	C	S	.	.	H	α-helix	trans	-67.1	-43.9	179.5	-63.3	-36.2	0	0	0	112.7	L491 A502 E503 I504 F508 V509 I510 T526 E529 L530 L533	L491-F506 HydrophobicContact CG-CE1 4.48Å; L491-F506 HydrophobicContact CG-CZ 4.48Å; A502-F506 HydrophobicContact CB-CE2 4.28Å; A502-F506 VanDerWaalsContact O-CD2 3.28Å; A502-F506 WeakPolarHBondContact O-CD2 3.46Å; A502-F506 WeakPolarHBondContact O-CG 3.44Å; A502-F506 PolarHBondContact O-N 2.88Å; E503-F506 PolarHBondContact O-N 3.44Å; I504-F506 PolarHBondContact O-N 2.72Å; F506-F508 VanDerWaalsContact C-N 3.27Å; F506-F508 PolarHBondContact O-N 2.86Å; F506-V509 PolarHBondContact O-N 3.43Å; F506-I510 WeakPolarHBondContact O-CG1 3.46Å; F506-I510 PolarHBondContact O-N 3.28Å; F506-I510 VanDerWaalsContact O-N 3.1Å; F506-T526 HydrophobicContact CB-CG2 3.6Å; F506-T526 HydrophobicContact CD1-CG2 3.66Å; F506-T526 HydrophobicContact CG-CG2 3.96Å; F506-T526 WeakPolarHBondContact O-CG2 3.47Å; F506-E529 HydrophobicContact CE1-CB 4.04Å; F506-E529 HydrophobicContact CE2-CB 4.32Å; F506-E529 HydrophobicContact CZ-CB 3.86Å; F506-L530 HydrophobicContact CB-CB 4.23Å; F506-L530 HydrophobicContact CB-CD1 4.32Å; F506-L530 HydrophobicContact CD2-CB 4.31Å; F506-L530 HydrophobicContact CD2-CD1 4.3Å; F506-L533 HydrophobicContact CD2-CD2 3.97Å; F506-L533 HydrophobicContact CE2-CB 4.36Å; F506-L533 HydrophobicContact CE2-CD2 4.1Å
507	N	98.6	Very high	97.9	Very high	73 Å²	73	69.5 Å²	69.5	39%	0.39	35%	0.35	S	S	.	.	H	α-helix	trans	-64.9	-32.3	176.6	-78.6	-47.3	0	0	0	112.3	E503 I504 I510 S511	E503-N507 VanDerWaalsContact CG-ND2 3.28Å; E503-N507 WeakPolarHBondContact CG-ND2 3.45Å; E503-N507 WeakPolarHBondContact O-CB 3.43Å; E503-N507 PolarHBondContact O-N 2.93Å; E503-N507 PolarHBondContact O-ND2 3.07Å; I504-N507 PolarHBondContact O-N 3.05Å; N507-I510 PolarHBondContact O-N 2.99Å; N507-S511 VanDerWaalsContact O-CB 3.3Å; N507-S511 WeakPolarHBondContact O-CB 3.43Å; N507-S511 PolarHBondContact O-N 3.25Å; N507-S511 PolarHBondContact O-OG 3.28Å
508	F	98.7	Very high	97.8	Very high	68 Å²	68	69.3 Å²	69.3	30%	0.298	34%	0.335	S	S	.	.	H	α-helix	trans	-57.1	-51.7	171.9	178.5	-83.6	0	0	0	110.8	V482 Q486 I504 C505 F506 I510 S511 R512	V482-F508 HydrophobicContact CG1-CE1 3.71Å; V482-F508 HydrophobicContact CG1-CZ 3.9Å; Q486-F508 HydrophobicContact CB-CD1 4.11Å; Q486-F508 HydrophobicContact CG-CD1 3.66Å; Q486-F508 HydrophobicContact CG-CE1 3.95Å; Q486-F508 HydrophobicContact CG-CG 4.31Å; I504-F508 WeakPolarHBondContact O-CB 3.38Å; I504-F508 PolarHBondContact O-N 3.12Å; C505-F508 WeakPolarHBondContact O-CB 3.45Å; C505-F508 PolarHBondContact O-N 3.41Å; F506-F508 VanDerWaalsContact C-N 3.27Å; F506-F508 PolarHBondContact O-N 2.86Å; F508-I510 PolarHBondContact O-N 2.93Å; F508-S511 PolarHBondContact O-N 3.18Å; F508-S511 PolarHBondContact O-OG 3.22Å; F508-R512 HydrophobicContact CD1-CG 4.36Å; F508-R512 HydrophobicContact CE1-CG 4.01Å; F508-R512 HydrophobicContact CZ-CG 4.26Å; F508-R512 WeakPolarHBondContact O-CG 3.3Å; F508-R512 PolarHBondContact O-N 3.38Å
509	V	98.8	Very high	97.7	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.5	-45.8	179.9	178.2	0	0	0	0	111.4	C483 Q486 M487 C505 F506 S511 R512 I516 L522 T526	C483-V509 HydrophobicContact CB-CG1 4.03Å; C483-V509 HydrophobicContact CB-CG2 4.17Å; C483-V509 VanDerWaalsContact O-CG2 3.32Å; C483-V509 WeakPolarHBondContact O-CG2 3.36Å; Q486-V509 HydrophobicContact CB-CG2 3.8Å; M487-V509 HydrophobicContact CB-CG2 4.29Å; C505-V509 PolarHBondContact O-N 3.09Å; F506-V509 PolarHBondContact O-N 3.43Å; V509-S511 VanDerWaalsContact C-N 3.32Å; V509-S511 PolarHBondContact O-N 3.29Å; V509-R512 PolarHBondContact O-N 2.99Å; V509-R512 VanDerWaalsContact O-N 3.12Å; V509-I516 HydrophobicContact CG1-CD1 4.44Å; V509-L522 HydrophobicContact CG1-CB 4.23Å; V509-T526 HydrophobicContact CB-CG2 3.98Å; V509-T526 HydrophobicContact CG1-CG2 4.29Å; V509-T526 WeakPolarHBondContact CG1-OG1 3.32Å; V509-T526 HydrophobicContact CG2-CG2 4.48Å
510	I	98.4	Very high	97.5	Very high	39 Å²	39	66.1 Å²	66.1	20%	0.2	33%	0.328	C	S	.	.	H	α-helix	trans	-62.8	-39.9	179.6	-64	165	0	0	0	110.9	F506 N507 F508 R512 E513 T526 M527 L530	F506-I510 WeakPolarHBondContact O-CG1 3.46Å; F506-I510 PolarHBondContact O-N 3.28Å; F506-I510 VanDerWaalsContact O-N 3.1Å; N507-I510 PolarHBondContact O-N 2.99Å; F508-I510 PolarHBondContact O-N 2.93Å; I510-R512 PolarHBondContact O-N 3.33Å; I510-E513 WeakPolarHBondContact O-CB 3.35Å; I510-E513 PolarHBondContact O-N 2.92Å; I510-T526 HydrophobicContact CD1-CG2 4.32Å; I510-T526 HydrophobicContact CG1-CG2 4.14Å; I510-M527 HydrophobicContact CD1-CG 3.76Å; I510-M527 HydrophobicContact CG1-CG 3.94Å; I510-L530 HydrophobicContact CD1-CD2 3.63Å
511	S	98.3	Very high	97.5	Very high	87 Å²	87	61.4 Å²	61.4	61%	0.608	30%	0.299	S	S	*	.	H	α-helix	trans	-64.8	-20.3	177.7	76.5	0	0	0	0	113.8	N507 F508 V509	N507-S511 VanDerWaalsContact O-CB 3.3Å; N507-S511 WeakPolarHBondContact O-CB 3.43Å; N507-S511 PolarHBondContact O-N 3.25Å; N507-S511 PolarHBondContact O-OG 3.28Å; F508-S511 PolarHBondContact O-N 3.18Å; F508-S511 PolarHBondContact O-OG 3.22Å; V509-S511 VanDerWaalsContact C-N 3.32Å; V509-S511 PolarHBondContact O-N 3.29Å
512	R	97.9	Very high	97.4	Very high	101 Å²	101	56.7 Å²	56.7	38%	0.381	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	9.1	179.4	-65.3	-64.6	-179.7	-176.1	0	114	T479 F508 V509 I510 K514 D515 I516	T479-R512 HydrophobicContact CG2-CB 4.43Å; F508-R512 HydrophobicContact CD1-CG 4.36Å; F508-R512 HydrophobicContact CE1-CG 4.01Å; F508-R512 HydrophobicContact CZ-CG 4.26Å; F508-R512 WeakPolarHBondContact O-CG 3.3Å; F508-R512 PolarHBondContact O-N 3.38Å; V509-R512 PolarHBondContact O-N 2.99Å; V509-R512 VanDerWaalsContact O-N 3.12Å; I510-R512 PolarHBondContact O-N 3.33Å; R512-K514 PolarHBondContact O-N 3.3Å; R512-D515 WeakPolarHBondContact CD-OD2 3.44Å; R512-D515 IonicContact CZ-OD2 3.28Å; R512-D515 IonicContact NH1-OD2 3.27Å; R512-D515 PolarHBondContact NH1-OD2 3.23Å; R512-D515 WeakPolarHBondContact O-CA 3.43Å; R512-D515 WeakPolarHBondContact O-CB 3.19Å; R512-D515 PolarHBondContact O-N 2.97Å; R512-I516 WeakPolarHBondContact O-CG1 3.28Å; R512-I516 PolarHBondContact O-N 3.39Å; R512-I516 VanDerWaalsContact O-N 3.14Å
513	E	97.2	Very high	97.4	Very high	89 Å²	89	56.9 Å²	56.9	42%	0.416	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	-42.5	-177.9	175.5	173.5	168.1	0	0	113.7	I510 D515 V523 Y554	I510-E513 WeakPolarHBondContact O-CB 3.35Å; I510-E513 PolarHBondContact O-N 2.92Å; E513-D515 VanDerWaalsContact C-N 3.28Å; E513-D515 PolarHBondContact O-N 2.87Å; E513-V523 HydrophobicContact CB-CG1 4.4Å; E513-V523 HydrophobicContact CB-CG2 3.93Å; E513-V523 HydrophobicContact CG-CG1 4.39Å; E513-V523 HydrophobicContact CG-CG2 4.08Å; E513-Y554 WeakPolarHBondContact OE1-CE1 3.44Å; E513-Y554 PolarHBondContact OE2-OH 3.43Å
514	K	96.8	Very high	97.4	Very high	202 Å²	202	54.3 Å²	54.3	88%	0.878	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-20.4	-179.1	-63.1	-177.6	-178.1	177	0	113.9	R512	R512-K514 PolarHBondContact O-N 3.3Å
515	D	97	Very high	97.3	Very high	69 Å²	69	49.4 Å²	49.4	37%	0.369	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-19	-177.2	-57.8	-31.9	0	0	0	111.7	T479 R512 E513	T479-D515 HydrophobicContact CG2-CB 3.74Å; R512-D515 WeakPolarHBondContact CD-OD2 3.44Å; R512-D515 IonicContact CZ-OD2 3.28Å; R512-D515 IonicContact NH1-OD2 3.27Å; R512-D515 PolarHBondContact NH1-OD2 3.23Å; R512-D515 WeakPolarHBondContact O-CA 3.43Å; R512-D515 WeakPolarHBondContact O-CB 3.19Å; R512-D515 PolarHBondContact O-N 2.97Å; E513-D515 VanDerWaalsContact C-N 3.28Å; E513-D515 PolarHBondContact O-N 2.87Å
516	I	96.8	Very high	97.3	Very high	14 Å²	14	49 Å²	49	7%	0.072	24%	0.238	C	C	.	.			trans	-76.3	122.8	176.9	-66.4	166	0	0	0	109.7	C483 V509 R512 L522 V523	C483-I516 HydrophobicContact CB-CD1 4.27Å; V509-I516 HydrophobicContact CG1-CD1 4.44Å; R512-I516 WeakPolarHBondContact O-CG1 3.28Å; R512-I516 PolarHBondContact O-N 3.39Å; R512-I516 VanDerWaalsContact O-N 3.14Å; I516-L522 HydrophobicContact CD1-CB 4.3Å; I516-L522 HydrophobicContact CD1-CD1 4.47Å; I516-V523 HydrophobicContact CD1-CG2 3.71Å
517	K	94.6	Very high	97.3	Very high	153 Å²	153	49.8 Å²	49.8	67%	0.665	24%	0.242	S	C	*	.			trans	-111.1	-31.6	-174.6	-67.8	179.4	-175.3	172.7	0	114.2	D480	D480-K517 PolarHBondContact OD1-N 2.92Å; D480-K517 PolarHBondContact OD2-N 3.35Å
518	H	94.8	Very high	97.2	Very high	49 Å²	49	46.3 Å²	46.3	23%	0.227	22%	0.223	C	C	.	.	S	Bend	trans	-113.5	-48.1	-167.8	-54.9	-87.8	0	0	0	111.6	K417 E476 F477 D480 T520	K417-H518 WeakPolarHBondContact CE-O 3.34Å; K417-H518 PolarHBondContact NZ-O 3.49Å; E476-H518 IonicContact OE2-CE1 3.88Å; E476-H518 IonicContact OE2-NE2 2.7Å; F477-H518 HydrophobicContact CD1-CB 3.94Å; F477-H518 AromaticContact CD1-CD2 3.61Å; F477-H518 AromaticContact CD1-CG 3.71Å; F477-H518 HydrophobicContact CE1-CB 3.64Å; F477-H518 AromaticContact CE1-CD2 3.62Å; F477-H518 AromaticContact CE1-CE1 3.94Å; F477-H518 AromaticContact CE1-CG 3.31Å; F477-H518 AromaticContact CE1-ND1 3.54Å; F477-H518 AromaticContact CZ-CE1 3.91Å; F477-H518 AromaticContact CZ-ND1 3.83Å; D480-H518 WeakPolarHBondContact OD1-CA 3.4Å; D480-H518 WeakPolarHBondContact OD1-CB 3.37Å; D480-H518 PolarHBondContact OD1-N 3.23Å; H518-T520 VanDerWaalsContact C-N 3.32Å; H518-T520 PolarHBondContact O-N 3.04Å
519	D	94.9	Very high	97.2	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.037	21%	0.212	C	C	.	.			trans	-94.6	55.1	-174.9	-75.9	-34.5	0	0	0	111.9	K418 D480 Y521 L522	K418-D519 VanDerWaalsContact NZ-CG 3.34Å; K418-D519 IonicContact NZ-OD1 2.96Å; K418-D519 PolarHBondContact NZ-OD1 2.92Å; K418-D519 IonicContact NZ-OD2 2.71Å; K418-D519 PolarHBondContact NZ-OD2 2.91Å; D480-D519 HydrophobicContact CB-CB 4.3Å; D480-D519 PolarHBondContact OD1-N 2.89Å; D519-Y521 HydrophobicContact CB-CD1 4.09Å; D519-Y521 HydrophobicContact CB-CE1 3.65Å; D519-Y521 PolarHBondContact O-N 3.47Å; D519-L522 HydrophobicContact CB-CD1 3.62Å; D519-L522 HydrophobicContact CB-CG 4.05Å; D519-L522 WeakPolarHBondContact O-CB 3.43Å; D519-L522 WeakPolarHBondContact O-CG 3.28Å; D519-L522 PolarHBondContact O-N 3.23Å
520	T	95.7	Very high	97.1	Very high	62 Å²	62	44.2 Å²	44.2	38%	0.38	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-9.8	-178.1	60.1	0	0	0	0	115.1	H518 L522 P524	H518-T520 VanDerWaalsContact C-N 3.32Å; H518-T520 PolarHBondContact O-N 3.04Å; T520-L522 VanDerWaalsContact C-N 3.29Å; T520-P524 WeakPolarHBondContact O-CD 3.37Å
521	Y	96.8	Very high	97.1	Very high	5 Å²	5	42.3 Å²	42.3	2%	0.02	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-22.7	171.9	80.5	-84	0	0	0	112.2	F414 E436 D519 V523 P524 F525 S558	F414-Y521 AromaticContact CE2-CD1 3.89Å; F414-Y521 HydrophobicContact CE2-CD1 3.89Å; F414-Y521 AromaticContact CE2-CE1 3.62Å; F414-Y521 HydrophobicContact CE2-CE1 3.62Å; F414-Y521 HydrophobicContact CE2-CE2 4.43Å; F414-Y521 HydrophobicContact CE2-CG 4.42Å; F414-Y521 AromaticContact CE2-CZ 3.95Å; F414-Y521 HydrophobicContact CZ-CE1 4.17Å; E436-Y521 PolarHBondContact OE1-OH 3.21Å; D519-Y521 HydrophobicContact CB-CD1 4.09Å; D519-Y521 HydrophobicContact CB-CE1 3.65Å; D519-Y521 PolarHBondContact O-N 3.47Å; Y521-V523 VanDerWaalsContact C-N 3.34Å; Y521-V523 PolarHBondContact O-N 2.96Å; Y521-P524 VanDerWaalsContact O-CD 3.26Å; Y521-P524 WeakPolarHBondContact O-CD 3.48Å; Y521-P524 WeakPolarHBondContact O-CG 3.5Å; Y521-F525 HydrophobicContact CD2-CB 4.39Å; Y521-F525 AromaticContact CD2-CD2 3.78Å; Y521-F525 HydrophobicContact CD2-CD2 3.78Å; Y521-F525 HydrophobicContact CD2-CE2 4.17Å; Y521-F525 HydrophobicContact CD2-CG 4.05Å; Y521-F525 HydrophobicContact CG-CD2 4.41Å; Y521-F525 WeakPolarHBondContact O-CB 3.4Å; Y521-F525 WeakPolarHBondContact O-CD2 3.36Å; Y521-F525 PolarHBondContact O-N 3.19Å; Y521-F525 VanDerWaalsContact O-N 3.1Å; Y521-S558 WeakPolarHBondContact CB-O 3.49Å
522	L	97.8	Very high	97	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-56.6	-45	-174.1	-78	166.5	0	0	0	112.7	C483 V484 M487 V509 I516 D519 T520 T526	C483-L522 HydrophobicContact CB-CD1 3.85Å; V484-L522 HydrophobicContact CB-CD2 4.46Å; V484-L522 HydrophobicContact CG2-CD1 4.03Å; V484-L522 HydrophobicContact CG2-CD2 3.84Å; V484-L522 HydrophobicContact CG2-CG 4.44Å; M487-L522 HydrophobicContact CE-CD2 4.46Å; M487-L522 HydrophobicContact SD-CD2 4.09Å; V509-L522 HydrophobicContact CG1-CB 4.23Å; I516-L522 HydrophobicContact CD1-CB 4.3Å; I516-L522 HydrophobicContact CD1-CD1 4.47Å; D519-L522 HydrophobicContact CB-CD1 3.62Å; D519-L522 HydrophobicContact CB-CG 4.05Å; D519-L522 WeakPolarHBondContact O-CB 3.43Å; D519-L522 WeakPolarHBondContact O-CG 3.28Å; D519-L522 PolarHBondContact O-N 3.23Å; T520-L522 VanDerWaalsContact C-N 3.29Å; L522-T526 WeakPolarHBondContact O-CB 3.41Å; L522-T526 PolarHBondContact O-N 3.48Å; L522-T526 PolarHBondContact O-OG1 3.4Å
523	V	97.9	Very high	96.9	Very high	4 Å²	4	35 Å²	35	2%	0.024	17%	0.167	C	C	.	.	H	α-helix	trans	-64.7	-57.5	-177.2	-176.4	0	0	0	0	112	E513 I516 Y521 F525 T526 M527 Y554	E513-V523 HydrophobicContact CB-CG1 4.4Å; E513-V523 HydrophobicContact CB-CG2 3.93Å; E513-V523 HydrophobicContact CG-CG1 4.39Å; E513-V523 HydrophobicContact CG-CG2 4.08Å; I516-V523 HydrophobicContact CD1-CG2 3.71Å; Y521-V523 VanDerWaalsContact C-N 3.34Å; Y521-V523 PolarHBondContact O-N 2.96Å; V523-F525 VanDerWaalsContact C-N 3.31Å; V523-F525 PolarHBondContact O-N 2.92Å; V523-T526 PolarHBondContact O-N 3.11Å; V523-M527 HydrophobicContact CG1-CG 4.48Å; V523-M527 HydrophobicContact CG1-SD 4.29Å; V523-M527 WeakPolarHBondContact O-CG 3.36Å; V523-M527 PolarHBondContact O-N 3.19Å; V523-Y554 HydrophobicContact CB-CE1 4.14Å; V523-Y554 HydrophobicContact CG1-CE1 3.75Å; V523-Y554 VanDerWaalsContact CG1-OH 3.31Å; V523-Y554 WeakPolarHBondContact CG1-OH 3.38Å
524	P	97.9	Very high	96.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.3	-34.8	-179.9	23.2	-33.6	0	0	0	113	T520 Y521 Y528 A550 Y554 Y557 L563	T520-P524 WeakPolarHBondContact O-CD 3.37Å; Y521-P524 VanDerWaalsContact O-CD 3.26Å; Y521-P524 WeakPolarHBondContact O-CD 3.48Å; Y521-P524 WeakPolarHBondContact O-CG 3.5Å; P524-Y528 PolarHBondContact O-N 2.94Å; P524-A550 HydrophobicContact CB-CB 4.44Å; P524-Y554 HydrophobicContact CB-CD1 4.5Å; P524-Y554 HydrophobicContact CB-CD2 3.93Å; P524-Y554 HydrophobicContact CB-CG 3.87Å; P524-Y554 HydrophobicContact CG-CD1 4.33Å; P524-Y554 HydrophobicContact CG-CG 4.08Å; P524-Y557 HydrophobicContact CB-CE1 4.35Å; P524-Y557 HydrophobicContact CB-CE2 4.29Å; P524-Y557 HydrophobicContact CG-CD1 4.1Å; P524-Y557 HydrophobicContact CG-CD2 3.91Å; P524-Y557 HydrophobicContact CG-CE1 4.02Å; P524-Y557 HydrophobicContact CG-CE2 3.79Å; P524-Y557 HydrophobicContact CG-CG 4.08Å; P524-L563 HydrophobicContact CB-CD2 3.82Å
525	F	97.6	Very high	96.8	Very high	7 Å²	7	25.3 Å²	25.3	3%	0.031	12%	0.123	C	C	.	.	H	α-helix	trans	-67.6	-42.1	174.2	-84.1	-105.2	0	0	0	111.7	Y439 M487 Y521 V523 M527 Y528 E529 Y557 M559 L563	Y439-F525 HydrophobicContact CE1-CB 4.33Å; Y439-F525 AromaticContact CE1-CD1 3.55Å; Y439-F525 HydrophobicContact CE1-CD1 3.55Å; Y439-F525 HydrophobicContact CE1-CE1 4.25Å; Y439-F525 HydrophobicContact CE1-CG 4.32Å; Y439-F525 AromaticContact CZ-CD1 3.88Å; Y439-F525 WeakPolarHBondContact OH-CD1 3.27Å; M487-F525 HydrophobicContact SD-CB 4.35Å; Y521-F525 HydrophobicContact CD2-CB 4.39Å; Y521-F525 AromaticContact CD2-CD2 3.78Å; Y521-F525 HydrophobicContact CD2-CD2 3.78Å; Y521-F525 HydrophobicContact CD2-CE2 4.17Å; Y521-F525 HydrophobicContact CD2-CG 4.05Å; Y521-F525 HydrophobicContact CG-CD2 4.41Å; Y521-F525 WeakPolarHBondContact O-CB 3.4Å; Y521-F525 WeakPolarHBondContact O-CD2 3.36Å; Y521-F525 PolarHBondContact O-N 3.19Å; Y521-F525 VanDerWaalsContact O-N 3.1Å; V523-F525 VanDerWaalsContact C-N 3.31Å; V523-F525 PolarHBondContact O-N 2.92Å; F525-M527 PolarHBondContact O-N 2.91Å; F525-Y528 WeakPolarHBondContact O-CB 3.43Å; F525-Y528 PolarHBondContact O-N 3.35Å; F525-E529 WeakPolarHBondContact O-CG 3.42Å; F525-E529 PolarHBondContact O-N 2.87Å; F525-Y557 HydrophobicContact CD2-CD2 4.48Å; F525-Y557 HydrophobicContact CD2-CE2 4.17Å; F525-Y557 HydrophobicContact CE2-CD2 4.15Å; F525-Y557 AromaticContact CE2-CE2 3.81Å; F525-Y557 HydrophobicContact CE2-CE2 3.81Å; F525-M559 HydrophobicContact CE2-CB 4.08Å; F525-M559 HydrophobicContact CZ-CB 3.6Å; F525-L563 HydrophobicContact CD1-CD1 4.1Å; F525-L563 HydrophobicContact CD2-CB 4.39Å; F525-L563 HydrophobicContact CD2-CD1 4.47Å; F525-L563 HydrophobicContact CD2-CD2 3.77Å; F525-L563 HydrophobicContact CD2-CG 4.43Å; F525-L563 HydrophobicContact CE1-CB 4.34Å; F525-L563 HydrophobicContact CE1-CD1 4.23Å; F525-L563 HydrophobicContact CE2-CB 3.83Å; F525-L563 HydrophobicContact CE2-CD2 4.03Å; F525-L563 HydrophobicContact CE2-CG 4.36Å; F525-L563 HydrophobicContact CG-CD1 4.26Å; F525-L563 HydrophobicContact CG-CD2 4.21Å; F525-L563 HydrophobicContact CZ-CB 3.79Å; F525-L563 HydrophobicContact CZ-CD1 4.46Å
526	T	98.4	Very high	96.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-66.1	-38.5	177	-58.2	0	0	0	0	112.1	M487 F506 V509 I510 L522 V523 Y528 E529 L530	M487-T526 WeakPolarHBondContact CG-OG1 3.47Å; M487-T526 PolarHBondContact SD-OG1 3.08Å; F506-T526 HydrophobicContact CB-CG2 3.6Å; F506-T526 HydrophobicContact CD1-CG2 3.66Å; F506-T526 HydrophobicContact CG-CG2 3.96Å; F506-T526 WeakPolarHBondContact O-CG2 3.47Å; V509-T526 HydrophobicContact CB-CG2 3.98Å; V509-T526 HydrophobicContact CG1-CG2 4.29Å; V509-T526 WeakPolarHBondContact CG1-OG1 3.32Å; V509-T526 HydrophobicContact CG2-CG2 4.48Å; I510-T526 HydrophobicContact CD1-CG2 4.32Å; I510-T526 HydrophobicContact CG1-CG2 4.14Å; L522-T526 WeakPolarHBondContact O-CB 3.41Å; L522-T526 PolarHBondContact O-N 3.48Å; L522-T526 PolarHBondContact O-OG1 3.4Å; V523-T526 PolarHBondContact O-N 3.11Å; T526-Y528 VanDerWaalsContact C-N 3.3Å; T526-Y528 PolarHBondContact O-N 3.29Å; T526-E529 PolarHBondContact O-N 3.2Å; T526-L530 WeakPolarHBondContact O-CB 3.24Å; T526-L530 PolarHBondContact O-N 3.4Å
527	M	98.4	Very high	96.5	Very high	16 Å²	16	30.3 Å²	30.3	8%	0.079	15%	0.146	C	C	.	.	H	α-helix	trans	-60.9	-41.4	172.6	-72.1	-176.9	72.9	0	0	111.6	I510 V523 F525 L530 G531 V546 K549 A550 Y554	I510-M527 HydrophobicContact CD1-CG 3.76Å; I510-M527 HydrophobicContact CG1-CG 3.94Å; V523-M527 HydrophobicContact CG1-CG 4.48Å; V523-M527 HydrophobicContact CG1-SD 4.29Å; V523-M527 WeakPolarHBondContact O-CG 3.36Å; V523-M527 PolarHBondContact O-N 3.19Å; F525-M527 PolarHBondContact O-N 2.91Å; M527-L530 PolarHBondContact O-N 3.03Å; M527-G531 PolarHBondContact O-N 2.98Å; M527-V546 HydrophobicContact CB-CG1 4.04Å; M527-V546 HydrophobicContact CE-CG1 4.21Å; M527-V546 WeakPolarHBondContact O-CG1 3.45Å; M527-K549 HydrophobicContact CE-CB 3.56Å; M527-K549 HydrophobicContact CE-CD 4.44Å; M527-A550 HydrophobicContact CB-CB 3.84Å; M527-Y554 HydrophobicContact SD-CE2 3.48Å; M527-Y554 WeakPolarHBondContact SD-CE2 3.03Å
528	Y	97.1	Very high	96.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.5	-45.7	174.4	166.7	-91.4	0	0	0	112	P524 F525 T526 G531 L532 I547 L563 R566 I567 V570	P524-Y528 PolarHBondContact O-N 2.94Å; F525-Y528 WeakPolarHBondContact O-CB 3.43Å; F525-Y528 PolarHBondContact O-N 3.35Å; T526-Y528 VanDerWaalsContact C-N 3.3Å; T526-Y528 PolarHBondContact O-N 3.29Å; Y528-G531 PolarHBondContact O-N 3.06Å; Y528-L532 HydrophobicContact CD1-CD1 4.26Å; Y528-L532 HydrophobicContact CE1-CD1 3.46Å; Y528-L532 VanDerWaalsContact CE1-CD1 3.46Å; Y528-L532 HydrophobicContact CE1-CG 4.13Å; Y528-L532 PolarHBondContact O-N 3.01Å; Y528-I547 HydrophobicContact CD2-CG1 4.41Å; Y528-L563 HydrophobicContact CD1-CD1 4.06Å; Y528-L563 HydrophobicContact CD2-CD1 4.12Å; Y528-L563 HydrophobicContact CG-CD1 3.68Å; Y528-R566 VanDerWaalsContact CE1-NH2 3.29Å; Y528-R566 HydrophobicContact CE2-CB 4.02Å; Y528-R566 PolarHBondContact OH-NE 3.17Å; Y528-I567 HydrophobicContact CD2-CG1 3.66Å; Y528-I567 HydrophobicContact CE2-CG1 4.17Å; Y528-V570 HydrophobicContact CE2-CB 4.34Å; Y528-V570 HydrophobicContact CE2-CG2 3.81Å; Y528-V570 VanDerWaalsContact OH-CG2 3.27Å; Y528-V570 WeakPolarHBondContact OH-CG2 3.34Å
529	E	97.6	Very high	96.5	Very high	15 Å²	15	26.3 Å²	26.3	7%	0.07	15%	0.147	C	C	.	.	H	α-helix	trans	-66.5	-36.8	177.1	-60.7	-57.4	157.3	0	0	112.3	Y439 L491 F506 F525 T526 G531 L532 L533 R566	Y439-E529 HydrophobicContact CE2-CG 4.12Å; Y439-E529 WeakPolarHBondContact CE2-OE1 3.36Å; Y439-E529 WeakPolarHBondContact OH-CG 3.3Å; Y439-E529 PolarHBondContact OH-OE1 2.98Å; L491-E529 HydrophobicContact CD2-CG 3.99Å; F506-E529 HydrophobicContact CE1-CB 4.04Å; F506-E529 HydrophobicContact CE2-CB 4.32Å; F506-E529 HydrophobicContact CZ-CB 3.86Å; F525-E529 WeakPolarHBondContact O-CG 3.42Å; F525-E529 PolarHBondContact O-N 2.87Å; T526-E529 PolarHBondContact O-N 3.2Å; E529-G531 VanDerWaalsContact C-N 3.33Å; E529-G531 PolarHBondContact O-N 3.41Å; E529-L532 WeakPolarHBondContact O-CB 3.31Å; E529-L532 PolarHBondContact O-N 3.38Å; E529-L533 PolarHBondContact O-N 3.19Å; E529-R566 IonicContact OE1-CZ 2.8Å; E529-R566 IonicContact OE1-NH1 3.2Å; E529-R566 PolarHBondContact OE1-NH1 3.45Å; E529-R566 IonicContact OE1-NH2 3.69Å; E529-R566 PolarHBondContact OE1-NH2 3.34Å; E529-R566 VanDerWaalsContact OE1-NH2 3.08Å
530	L	98.3	Very high	96.6	Very high	9 Å²	9	29 Å²	29	5%	0.047	16%	0.161	C	C	.	.	H	α-helix	trans	-62.7	-40.2	171.9	179.4	60.8	0	0	0	111.5	E503 F506 I510 T526 M527 L533 H534 V546	E503-L530 HydrophobicContact CG-CD1 4.12Å; F506-L530 HydrophobicContact CB-CB 4.23Å; F506-L530 HydrophobicContact CB-CD1 4.32Å; F506-L530 HydrophobicContact CD2-CB 4.31Å; F506-L530 HydrophobicContact CD2-CD1 4.3Å; I510-L530 HydrophobicContact CD1-CD2 3.63Å; T526-L530 WeakPolarHBondContact O-CB 3.24Å; T526-L530 PolarHBondContact O-N 3.4Å; M527-L530 PolarHBondContact O-N 3.03Å; L530-L533 HydrophobicContact CD1-CD2 4.17Å; L530-L533 WeakPolarHBondContact O-CB 3.19Å; L530-L533 PolarHBondContact O-N 2.97Å; L530-H534 PolarHBondContact O-CD2 3.41Å; L530-H534 PolarHBondContact O-N 3.16Å; L530-V546 HydrophobicContact CD2-CG1 4.46Å
531	G	97.4	Very high	96.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.7	-42.1	173.3	0	0	0	0	0	112.6	M527 Y528 E529 L533 H534 K535 A543	M527-G531 PolarHBondContact O-N 2.98Å; Y528-G531 PolarHBondContact O-N 3.06Å; E529-G531 VanDerWaalsContact C-N 3.33Å; E529-G531 PolarHBondContact O-N 3.41Å; G531-L533 VanDerWaalsContact C-N 3.31Å; G531-L533 PolarHBondContact O-N 3.25Å; G531-H534 PolarHBondContact O-N 3.18Å; G531-K535 PolarHBondContact O-N 3.32Å; G531-A543 WeakPolarHBondContact O-CB 3.25Å
532	L	95.7	Very high	96.5	Very high	35 Å²	35	34.1 Å²	34.1	18%	0.183	19%	0.187	C	C	.	.	H	α-helix	trans	-62	-38.8	172.1	-71.2	-176.9	0	0	0	112.3	Y528 E529 K535 L536 V570	Y528-L532 HydrophobicContact CD1-CD1 4.26Å; Y528-L532 HydrophobicContact CE1-CD1 3.46Å; Y528-L532 VanDerWaalsContact CE1-CD1 3.46Å; Y528-L532 HydrophobicContact CE1-CG 4.13Å; Y528-L532 PolarHBondContact O-N 3.01Å; E529-L532 WeakPolarHBondContact O-CB 3.31Å; E529-L532 PolarHBondContact O-N 3.38Å; L532-K535 WeakPolarHBondContact O-CB 3.31Å; L532-K535 PolarHBondContact O-N 3.12Å; L532-L536 WeakPolarHBondContact O-CB 3.44Å; L532-L536 PolarHBondContact O-N 3.02Å; L532-V570 HydrophobicContact CD2-CB 4.42Å; L532-V570 HydrophobicContact CD2-CG1 3.7Å; L532-V570 HydrophobicContact CD2-CG2 3.77Å
533	L	97	Very high	96.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.5	-42.4	174.7	-174.4	70.8	0	0	0	111.9	T494 L499 A502 E503 F506 E529 L530 G531 L536 K537	T494-L533 HydrophobicContact CG2-CD1 3.86Å; L499-L533 HydrophobicContact CB-CD1 4.03Å; L499-L533 HydrophobicContact CD2-CD1 3.75Å; L499-L533 HydrophobicContact CG-CD1 4.35Å; A502-L533 HydrophobicContact CB-CD1 4.28Å; A502-L533 HydrophobicContact CB-CD2 4.17Å; E503-L533 HydrophobicContact CB-CD2 3.69Å; F506-L533 HydrophobicContact CD2-CD2 3.97Å; F506-L533 HydrophobicContact CE2-CB 4.36Å; F506-L533 HydrophobicContact CE2-CD2 4.1Å; E529-L533 PolarHBondContact O-N 3.19Å; L530-L533 HydrophobicContact CD1-CD2 4.17Å; L530-L533 WeakPolarHBondContact O-CB 3.19Å; L530-L533 PolarHBondContact O-N 2.97Å; G531-L533 VanDerWaalsContact C-N 3.31Å; G531-L533 PolarHBondContact O-N 3.25Å; L533-L536 WeakPolarHBondContact O-CB 3.15Å; L533-L536 PolarHBondContact O-N 2.96Å; L533-K537 WeakPolarHBondContact O-CG 3.48Å; L533-K537 PolarHBondContact O-N 3.27Å
534	H	97.2	Very high	96.3	Very high	21 Å²	21	35.3 Å²	35.3	10%	0.097	19%	0.193	C	C	.	.	H	α-helix	trans	-64.2	-41.4	173.8	-74.5	-66.3	0	0	0	112	E503 L530 G531 L536 K537 G538 D539 T542 A543	E503-H534 IonicContact OE1-CE1 3.96Å; E503-H534 PolarHBondContact OE1-CE1 3.45Å; E503-H534 IonicContact OE1-NE2 2.79Å; L530-H534 PolarHBondContact O-CD2 3.41Å; L530-H534 PolarHBondContact O-N 3.16Å; G531-H534 PolarHBondContact O-N 3.18Å; H534-L536 VanDerWaalsContact C-N 3.29Å; H534-L536 PolarHBondContact O-N 3.27Å; H534-K537 CarbonylContact O-C 3.6Å; H534-K537 PolarHBondContact O-N 3.25Å; H534-K537 VanDerWaalsContact O-N 3.12Å; H534-G538 PolarHBondContact O-N 3.19Å; H534-G538 VanDerWaalsContact O-N 3.17Å; H534-D539 HydrophobicContact CB-CB 4.4Å; H534-D539 PolarHBondContact O-N 2.74Å; H534-T542 HydrophobicContact CB-CG2 4.43Å; H534-A543 HydrophobicContact CB-CB 3.99Å
535	K	94.9	Very high	96.3	Very high	65 Å²	65	38.4 Å²	38.4	28%	0.283	21%	0.212	S	C	.	.	H	α-helix	trans	-57.8	-44.2	173.9	-175.2	-171.9	173.7	-169.8	0	110.7	G531 L532 K537 G538 I540 A543 T573 M574	G531-K535 PolarHBondContact O-N 3.32Å; L532-K535 WeakPolarHBondContact O-CB 3.31Å; L532-K535 PolarHBondContact O-N 3.12Å; K535-K537 VanDerWaalsContact C-N 3.3Å; K535-K537 PolarHBondContact O-N 2.91Å; K535-G538 PolarHBondContact O-N 3.44Å; K535-I540 HydrophobicContact CG-CD1 3.87Å; K535-A543 HydrophobicContact CB-CB 3.92Å; K535-T573 PolarHBondContact NZ-OG1 3.42Å; K535-M574 HydrophobicContact CB-SD 4.28Å; K535-M574 HydrophobicContact CD-CG 4.11Å; K535-M574 HydrophobicContact CD-SD 3.8Å; K535-M574 HydrophobicContact CG-SD 3.91Å
536	L	93.3	Very high	96.2	Very high	109 Å²	109	39 Å²	39	57%	0.571	22%	0.216	S	C	*	.	H	α-helix	trans	-63.2	-34.7	177.4	-175.8	64.1	0	0	0	112.5	T494 L499 L532 L533 H534 G538	T494-L536 HydrophobicContact CG2-CD2 4.12Å; L499-L536 HydrophobicContact CD1-CD2 4.36Å; L499-L536 HydrophobicContact CD2-CD2 3.79Å; L532-L536 WeakPolarHBondContact O-CB 3.44Å; L532-L536 PolarHBondContact O-N 3.02Å; L533-L536 WeakPolarHBondContact O-CB 3.15Å; L533-L536 PolarHBondContact O-N 2.96Å; H534-L536 VanDerWaalsContact C-N 3.29Å; H534-L536 PolarHBondContact O-N 3.27Å; L536-G538 PolarHBondContact O-N 3.24Å
537	K	94.4	Very high	96.1	Very high	79 Å²	79	39 Å²	39	34%	0.343	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-7	173.1	-68.4	171.2	-178.5	169	0	113.7	L499 E503 L533 H534 K535	L499-K537 HydrophobicContact CD1-CG 3.84Å; E503-K537 VanDerWaalsContact CD-NZ 3.29Å; E503-K537 IonicContact OE1-NZ 2.74Å; E503-K537 IonicContact OE2-NZ 3.7Å; E503-K537 PolarHBondContact OE2-NZ 3.36Å; L533-K537 WeakPolarHBondContact O-CG 3.48Å; L533-K537 PolarHBondContact O-N 3.27Å; H534-K537 CarbonylContact O-C 3.6Å; H534-K537 PolarHBondContact O-N 3.25Å; H534-K537 VanDerWaalsContact O-N 3.12Å; K535-K537 VanDerWaalsContact C-N 3.3Å; K535-K537 PolarHBondContact O-N 2.91Å
538	G	94.3	Very high	95.8	Very high	56 Å²	56	42.1 Å²	42.1	58%	0.577	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.5	3.4	-176	0	0	0	0	0	114.9	H534 K535 L536 I540	H534-G538 PolarHBondContact O-N 3.19Å; H534-G538 VanDerWaalsContact O-N 3.17Å; K535-G538 PolarHBondContact O-N 3.44Å; L536-G538 PolarHBondContact O-N 3.24Å; G538-I540 PolarHBondContact O-N 3.24Å; G538-I540 VanDerWaalsContact O-N 3.15Å
539	D	95	Very high	95.7	Very high	63 Å²	63	47 Å²	47	34%	0.337	25%	0.252	S	S	.	.			trans	-88.7	76.3	177.6	-172.6	-4.4	0	0	0	111	H534 N541 T542 A543	H534-D539 HydrophobicContact CB-CB 4.4Å; H534-D539 PolarHBondContact O-N 2.74Å; D539-N541 VanDerWaalsContact C-N 3.33Å; D539-N541 PolarHBondContact O-N 3.02Å; D539-T542 WeakPolarHBondContact OD1-CB 3.27Å; D539-T542 PolarHBondContact OD1-N 3.42Å; D539-T542 VanDerWaalsContact OD1-N 3.1Å; D539-T542 PolarHBondContact OD1-OG1 3.48Å; D539-T542 VanDerWaalsContact OD1-OG1 3.1Å; D539-T542 WeakPolarHBondContact OD2-CB 3.37Å; D539-T542 PolarHBondContact OD2-OG1 2.92Å; D539-A543 WeakPolarHBondContact O-CB 3.33Å; D539-A543 PolarHBondContact O-N 3.12Å
540	I	95.5	Very high	95.6	Very high	64 Å²	64	46.3 Å²	46.3	33%	0.328	25%	0.249	S	C	.	.	H	α-helix	trans	-64	-36.9	-175.9	-56	-56.7	0	0	0	112.1	K535 G538 A543 I544 M574	K535-I540 HydrophobicContact CG-CD1 3.87Å; G538-I540 PolarHBondContact O-N 3.24Å; G538-I540 VanDerWaalsContact O-N 3.15Å; I540-A543 WeakPolarHBondContact O-CB 3.42Å; I540-A543 PolarHBondContact O-N 3.26Å; I540-I544 HydrophobicContact CG2-CD1 3.86Å; I540-I544 HydrophobicContact CG2-CG1 4.37Å; I540-I544 WeakPolarHBondContact O-CG1 3.41Å; I540-I544 PolarHBondContact O-N 3.15Å; I540-M574 HydrophobicContact CD1-SD 4.41Å; I540-M574 HydrophobicContact CG2-CB 4.1Å; I540-M574 HydrophobicContact CG2-CG 4.33Å; I540-M574 HydrophobicContact CG2-SD 4.07Å
541	N	95.1	Very high	95.2	Very high	126 Å²	126	47.9 Å²	47.9	67%	0.674	26%	0.255	S	S	*	.	H	α-helix	trans	-67.4	-45.6	-178	-71.5	-27.8	0	0	0	111.5	D539 A543 T545	D539-N541 VanDerWaalsContact C-N 3.33Å; D539-N541 PolarHBondContact O-N 3.02Å; N541-A543 VanDerWaalsContact C-N 3.34Å; N541-T545 WeakPolarHBondContact O-CB 3.48Å; N541-T545 PolarHBondContact O-N 3.19Å; N541-T545 PolarHBondContact O-OG1 2.88Å
542	T	95.9	Very high	94.9	Very high	47 Å²	47	53.2 Å²	53.2	29%	0.288	28%	0.281	S	S	.	.	H	α-helix	trans	-65.5	-41.1	174.6	-58.3	0	0	0	0	110.6	H534 D539 I544 T545 V546	H534-T542 HydrophobicContact CB-CG2 4.43Å; D539-T542 WeakPolarHBondContact OD1-CB 3.27Å; D539-T542 PolarHBondContact OD1-N 3.42Å; D539-T542 VanDerWaalsContact OD1-N 3.1Å; D539-T542 PolarHBondContact OD1-OG1 3.48Å; D539-T542 VanDerWaalsContact OD1-OG1 3.1Å; D539-T542 WeakPolarHBondContact OD2-CB 3.37Å; D539-T542 PolarHBondContact OD2-OG1 2.92Å; T542-I544 PolarHBondContact O-N 3.09Å; T542-T545 PolarHBondContact O-N 3.31Å; T542-V546 HydrophobicContact CG2-CG2 4.05Å; T542-V546 VanDerWaalsContact O-CG2 3.31Å; T542-V546 WeakPolarHBondContact O-CG2 3.37Å; T542-V546 PolarHBondContact O-N 3.14Å
543	A	96.5	Very high	94.8	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-55.2	-51.9	176.4	0	0	0	0	0	112.4	G531 H534 K535 D539 I540 N541 T545 V546 I547 M574	G531-A543 WeakPolarHBondContact O-CB 3.25Å; H534-A543 HydrophobicContact CB-CB 3.99Å; K535-A543 HydrophobicContact CB-CB 3.92Å; D539-A543 WeakPolarHBondContact O-CB 3.33Å; D539-A543 PolarHBondContact O-N 3.12Å; I540-A543 WeakPolarHBondContact O-CB 3.42Å; I540-A543 PolarHBondContact O-N 3.26Å; N541-A543 VanDerWaalsContact C-N 3.34Å; A543-T545 PolarHBondContact O-N 2.95Å; A543-V546 PolarHBondContact O-N 3.4Å; A543-I547 WeakPolarHBondContact O-CB 3.44Å; A543-I547 WeakPolarHBondContact O-CD1 3.39Å; A543-I547 VanDerWaalsContact O-CG1 3.25Å; A543-I547 WeakPolarHBondContact O-CG1 3.33Å; A543-I547 PolarHBondContact O-N 3.11Å; A543-M574 HydrophobicContact CB-CE 4.36Å; A543-M574 HydrophobicContact CB-SD 3.99Å
544	I	95.8	Very high	94.7	Very high	29 Å²	29	58.5 Å²	58.5	15%	0.149	31%	0.308	C	S	.	.	H	α-helix	trans	-58.6	-49.9	176.8	-68.4	167.4	0	0	0	110	I540 T542 V546 I547 E548 L571 M574	I540-I544 HydrophobicContact CG2-CD1 3.86Å; I540-I544 HydrophobicContact CG2-CG1 4.37Å; I540-I544 WeakPolarHBondContact O-CG1 3.41Å; I540-I544 PolarHBondContact O-N 3.15Å; T542-I544 PolarHBondContact O-N 3.09Å; I544-V546 PolarHBondContact O-N 3.49Å; I544-I547 PolarHBondContact O-N 3.33Å; I544-E548 HydrophobicContact CG2-CG 4.21Å; I544-E548 WeakPolarHBondContact O-CB 3.42Å; I544-E548 WeakPolarHBondContact O-CG 3.05Å; I544-E548 PolarHBondContact O-N 2.92Å; I544-L571 HydrophobicContact CG1-CD2 4.32Å; I544-L571 HydrophobicContact CG2-CD2 4.3Å; I544-M574 HydrophobicContact CD1-CB 4.19Å; I544-M574 HydrophobicContact CG1-CB 4.23Å; I544-M574 HydrophobicContact CG1-CE 3.63Å; I544-M574 HydrophobicContact CG1-SD 4.08Å
545	T	96.1	Very high	94.5	Very high	66 Å²	66	66 Å²	66	41%	0.405	34%	0.335	S	S	.	.	H	α-helix	trans	-58.3	-45.8	-176.9	-59.7	0	0	0	0	112.3	N541 T542 A543 K549	N541-T545 WeakPolarHBondContact O-CB 3.48Å; N541-T545 PolarHBondContact O-N 3.19Å; N541-T545 PolarHBondContact O-OG1 2.88Å; T542-T545 PolarHBondContact O-N 3.31Å; A543-T545 PolarHBondContact O-N 2.95Å; T545-K549 HydrophobicContact CG2-CD 4.45Å; T545-K549 VanDerWaalsContact O-CG 3.31Å; T545-K549 WeakPolarHBondContact O-CG 3.48Å; T545-K549 PolarHBondContact O-N 3.2Å; T545-K549 VanDerWaalsContact O-N 3.14Å
546	V	96.5	Very high	94.2	Very high	18 Å²	18	70.3 Å²	70.3	11%	0.109	36%	0.361	C	S	.	.	H	α-helix	trans	-68.4	-43.7	-179.5	176.8	0	0	0	0	110.8	M527 L530 T542 A543 I544 E548 K549 A550	M527-V546 HydrophobicContact CB-CG1 4.04Å; M527-V546 HydrophobicContact CE-CG1 4.21Å; M527-V546 WeakPolarHBondContact O-CG1 3.45Å; L530-V546 HydrophobicContact CD2-CG1 4.46Å; T542-V546 HydrophobicContact CG2-CG2 4.05Å; T542-V546 VanDerWaalsContact O-CG2 3.31Å; T542-V546 WeakPolarHBondContact O-CG2 3.37Å; T542-V546 PolarHBondContact O-N 3.14Å; A543-V546 PolarHBondContact O-N 3.4Å; I544-V546 PolarHBondContact O-N 3.49Å; V546-E548 PolarHBondContact O-N 2.92Å; V546-K549 PolarHBondContact O-N 2.98Å; V546-A550 PolarHBondContact O-N 2.78Å; V546-A550 VanDerWaalsContact O-N 3.09Å
547	I	95.6	Very high	94.2	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-64.3	-41	179.5	-73.6	169.7	0	0	0	111.6	Y528 A543 I544 A550 K551 I567 V570 L571 M574	Y528-I547 HydrophobicContact CD2-CG1 4.41Å; A543-I547 WeakPolarHBondContact O-CB 3.44Å; A543-I547 WeakPolarHBondContact O-CD1 3.39Å; A543-I547 VanDerWaalsContact O-CG1 3.25Å; A543-I547 WeakPolarHBondContact O-CG1 3.33Å; A543-I547 PolarHBondContact O-N 3.11Å; I544-I547 PolarHBondContact O-N 3.33Å; I547-A550 WeakPolarHBondContact O-CB 3.43Å; I547-A550 PolarHBondContact O-N 3.01Å; I547-K551 PolarHBondContact O-N 3.24Å; I547-I567 HydrophobicContact CG2-CB 4.17Å; I547-I567 HydrophobicContact CG2-CD1 4.39Å; I547-I567 HydrophobicContact CG2-CG1 3.93Å; I547-I567 HydrophobicContact CG2-CG2 3.56Å; I547-V570 HydrophobicContact CD1-CG1 3.78Å; I547-L571 HydrophobicContact CB-CD2 4.36Å; I547-L571 HydrophobicContact CG2-CD1 4.27Å; I547-L571 HydrophobicContact CG2-CD2 3.81Å; I547-L571 HydrophobicContact CG2-CG 3.95Å; I547-M574 HydrophobicContact CD1-CE 3.92Å
548	E	93.3	Very high	94	Very high	82 Å²	82	62.7 Å²	62.7	38%	0.383	33%	0.325	S	S	.	.	H	α-helix	trans	-66.6	-38.9	176.8	-74	-167.2	153.9	0	0	112.2	I544 V546 A550 K551 M552 L571	I544-E548 HydrophobicContact CG2-CG 4.21Å; I544-E548 WeakPolarHBondContact O-CB 3.42Å; I544-E548 WeakPolarHBondContact O-CG 3.05Å; I544-E548 PolarHBondContact O-N 2.92Å; V546-E548 PolarHBondContact O-N 2.92Å; E548-A550 VanDerWaalsContact C-N 3.33Å; E548-A550 PolarHBondContact O-N 2.98Å; E548-K551 WeakPolarHBondContact O-CB 3.4Å; E548-K551 PolarHBondContact O-N 3.04Å; E548-K551 VanDerWaalsContact O-N 3.14Å; E548-M552 WeakPolarHBondContact O-CG 2.88Å; E548-M552 PolarHBondContact O-N 2.7Å; E548-L571 HydrophobicContact CG-CD1 4.31Å
549	K	94.9	Very high	93.9	Very high	103 Å²	103	60.6 Å²	60.6	45%	0.448	30%	0.301	S	S	.	.	H	α-helix	trans	-59.5	-43.3	173.2	-74.9	173.8	180	178.8	0	111.7	M527 T545 V546 K551 M552 N553	M527-K549 HydrophobicContact CE-CB 3.56Å; M527-K549 HydrophobicContact CE-CD 4.44Å; T545-K549 HydrophobicContact CG2-CD 4.45Å; T545-K549 VanDerWaalsContact O-CG 3.31Å; T545-K549 WeakPolarHBondContact O-CG 3.48Å; T545-K549 PolarHBondContact O-N 3.2Å; T545-K549 VanDerWaalsContact O-N 3.14Å; V546-K549 PolarHBondContact O-N 2.98Å; K549-K551 PolarHBondContact O-N 2.66Å; K549-M552 PolarHBondContact O-N 3.4Å; K549-N553 WeakPolarHBondContact O-CB 3.5Å; K549-N553 PolarHBondContact O-N 2.85Å
550	A	94.5	Very high	93.7	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-57.5	-36.6	176.2	0	0	0	0	0	112.3	P524 M527 V546 I547 E548 Y554 I567	P524-A550 HydrophobicContact CB-CB 4.44Å; M527-A550 HydrophobicContact CB-CB 3.84Å; V546-A550 PolarHBondContact O-N 2.78Å; V546-A550 VanDerWaalsContact O-N 3.09Å; I547-A550 WeakPolarHBondContact O-CB 3.43Å; I547-A550 PolarHBondContact O-N 3.01Å; E548-A550 VanDerWaalsContact C-N 3.33Å; E548-A550 PolarHBondContact O-N 2.98Å; A550-Y554 WeakPolarHBondContact O-CD2 3.43Å; A550-I567 HydrophobicContact CB-CD1 4.3Å
551	K	91.4	Very high	93.2	Very high	43 Å²	43	59.8 Å²	59.8	19%	0.187	30%	0.301	C	S	.	.	H	α-helix	trans	-76.9	-38.3	178	-178.6	-179.5	174.3	-175.8	0	113.9	I547 E548 K549 I567	I547-K551 PolarHBondContact O-N 3.24Å; E548-K551 WeakPolarHBondContact O-CB 3.4Å; E548-K551 PolarHBondContact O-N 3.04Å; E548-K551 VanDerWaalsContact O-N 3.14Å; K549-K551 PolarHBondContact O-N 2.66Å; K551-I567 HydrophobicContact CB-CD1 3.9Å; K551-I567 HydrophobicContact CB-CG2 4.39Å; K551-I567 HydrophobicContact CD-CG2 3.99Å
552	M	90.9	Very high	92.9	Very high	111 Å²	111	54.7 Å²	54.7	55%	0.547	27%	0.273	S	S	.	.	H	α-helix	trans	-90.5	-31.3	-169.9	-64.1	-57.4	179	0	0	113.4	E548 K549	E548-M552 WeakPolarHBondContact O-CG 2.88Å; E548-M552 PolarHBondContact O-N 2.7Å; K549-M552 PolarHBondContact O-N 3.4Å
553	N	93.7	Very high	92.7	Very high	113 Å²	113	52.5 Å²	52.5	60%	0.604	26%	0.259	S	S	*	.	H	α-helix	trans	-95	-14	-169.6	-63.9	-3.5	0	0	0	114	K549	K549-N553 WeakPolarHBondContact O-CB 3.5Å; K549-N553 PolarHBondContact O-N 2.85Å
554	Y	93.6	Very high	92.4	Very high	33 Å²	33	53.8 Å²	53.8	13%	0.129	27%	0.265	C	S	.	.			trans	-119.9	142.4	-175.3	-57.6	-89.4	0	0	0	111.2	E513 V523 P524 M527 A550	E513-Y554 WeakPolarHBondContact OE1-CE1 3.44Å; E513-Y554 PolarHBondContact OE2-OH 3.43Å; V523-Y554 HydrophobicContact CB-CE1 4.14Å; V523-Y554 HydrophobicContact CG1-CE1 3.75Å; V523-Y554 VanDerWaalsContact CG1-OH 3.31Å; V523-Y554 WeakPolarHBondContact CG1-OH 3.38Å; P524-Y554 HydrophobicContact CB-CD1 4.5Å; P524-Y554 HydrophobicContact CB-CD2 3.93Å; P524-Y554 HydrophobicContact CB-CG 3.87Å; P524-Y554 HydrophobicContact CG-CD1 4.33Å; P524-Y554 HydrophobicContact CG-CG 4.08Å; M527-Y554 HydrophobicContact SD-CE2 3.48Å; M527-Y554 WeakPolarHBondContact SD-CE2 3.03Å; A550-Y554 WeakPolarHBondContact O-CD2 3.43Å
555	R	92.8	Very high	92	Very high	178 Å²	178	54.7 Å²	54.7	67%	0.672	27%	0.268	S	S	*	.			trans	-148.1	161.3	179.3	-61.2	-173.6	-174.8	-179.3	3.9	111.1	Y557	R555-Y557 PolarHBondContact O-N 3.39Å; R555-Y557 VanDerWaalsContact O-N 3.11Å
556	D	89.4	Confident	91.7	Very high	156 Å²	156	51.9 Å²	51.9	83%	0.834	25%	0.25	S	C	*	.	S	Bend	trans	61.6	20.9	170.2	-57.6	-54.2	0	0	0	114.6	E560	D556-E560 PolarHBondContact N-OE2 3.3Å
557	Y	92.6	Very high	91.4	Very high	14 Å²	14	51 Å²	51	6%	0.055	25%	0.245	C	C	.	.			trans	-90.9	162.8	174	59.9	-86.8	0	0	0	111.8	P524 F525 R555 E560 L563	P524-Y557 HydrophobicContact CB-CE1 4.35Å; P524-Y557 HydrophobicContact CB-CE2 4.29Å; P524-Y557 HydrophobicContact CG-CD1 4.1Å; P524-Y557 HydrophobicContact CG-CD2 3.91Å; P524-Y557 HydrophobicContact CG-CE1 4.02Å; P524-Y557 HydrophobicContact CG-CE2 3.79Å; P524-Y557 HydrophobicContact CG-CG 4.08Å; F525-Y557 HydrophobicContact CD2-CD2 4.48Å; F525-Y557 HydrophobicContact CD2-CE2 4.17Å; F525-Y557 HydrophobicContact CE2-CD2 4.15Å; F525-Y557 AromaticContact CE2-CE2 3.81Å; F525-Y557 HydrophobicContact CE2-CE2 3.81Å; R555-Y557 PolarHBondContact O-N 3.39Å; R555-Y557 VanDerWaalsContact O-N 3.11Å; Y557-E560 HydrophobicContact CD1-CB 4.32Å; Y557-E560 HydrophobicContact CD1-CG 4.47Å; Y557-E560 HydrophobicContact CD2-CB 4.07Å; Y557-E560 HydrophobicContact CE1-CB 3.99Å; Y557-E560 HydrophobicContact CE1-CG 3.79Å; Y557-E560 HydrophobicContact CE2-CB 3.76Å; Y557-E560 HydrophobicContact CE2-CG 4.26Å; Y557-E560 HydrophobicContact CG-CB 4.33Å; Y557-E560 PolarHBondContact O-N 3.38Å; Y557-L563 HydrophobicContact CE2-CB 4.4Å; Y557-L563 HydrophobicContact CE2-CD2 4.02Å; Y557-L563 WeakPolarHBondContact OH-CD2 3.48Å
558	S	91.6	Very high	91	Very high	14 Å²	14	52 Å²	52	10%	0.098	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	140.9	179.7	-60.5	0	0	0	0	110.7	Y521 E560	Y521-S558 WeakPolarHBondContact CB-O 3.49Å; S558-E560 PolarHBondContact O-N 3.2Å
559	M	90.8	Very high	90.7	Very high	13 Å²	13	49.1 Å²	49.1	6%	0.064	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.4	18	-178.8	-55.6	-60.9	-69.7	0	0	115.7	P410 T411 F414 V440 F525 S561 R562 L563	P410-M559 HydrophobicContact CB-CE 4.23Å; P410-M559 HydrophobicContact CB-SD 3.59Å; P410-M559 VanDerWaalsContact CB-SD 3.59Å; T411-M559 HydrophobicContact CG2-CE 3.57Å; T411-M559 HydrophobicContact CG2-SD 4.17Å; F414-M559 HydrophobicContact CB-CG 4.06Å; F414-M559 HydrophobicContact CB-SD 4.11Å; F414-M559 HydrophobicContact CD2-CG 4.21Å; F414-M559 HydrophobicContact CG-CG 4.21Å; V440-M559 HydrophobicContact CG1-CE 4.23Å; F525-M559 HydrophobicContact CE2-CB 4.08Å; F525-M559 HydrophobicContact CZ-CB 3.6Å; M559-S561 VanDerWaalsContact C-N 3.35Å; M559-S561 PolarHBondContact O-N 2.97Å; M559-R562 HydrophobicContact CB-CB 4.44Å; M559-R562 HydrophobicContact CE-CB 3.85Å; M559-R562 HydrophobicContact CE-CG 4.17Å; M559-R562 WeakPolarHBondContact O-CB 3.35Å; M559-R562 PolarHBondContact O-N 3.35Å; M559-L563 PolarHBondContact O-N 3.14Å
560	E	91	Very high	90.4	Very high	37 Å²	37	44.2 Å²	44.2	17%	0.173	22%	0.218	C	C	.	.	H	α-helix	trans	-50.1	-49.4	177.4	176.5	-177.6	165.7	0	0	113.1	D556 Y557 S558 R562 L563 H564	D556-E560 PolarHBondContact N-OE2 3.3Å; Y557-E560 HydrophobicContact CD1-CB 4.32Å; Y557-E560 HydrophobicContact CD1-CG 4.47Å; Y557-E560 HydrophobicContact CD2-CB 4.07Å; Y557-E560 HydrophobicContact CE1-CB 3.99Å; Y557-E560 HydrophobicContact CE1-CG 3.79Å; Y557-E560 HydrophobicContact CE2-CB 3.76Å; Y557-E560 HydrophobicContact CE2-CG 4.26Å; Y557-E560 HydrophobicContact CG-CB 4.33Å; Y557-E560 PolarHBondContact O-N 3.38Å; S558-E560 PolarHBondContact O-N 3.2Å; E560-R562 VanDerWaalsContact C-N 3.26Å; E560-R562 PolarHBondContact O-N 2.82Å; E560-L563 PolarHBondContact O-N 2.93Å; E560-H564 PolarHBondContact O-N 3.47Å; E560-H564 IonicContact OE1-CE1 2.7Å; E560-H564 PolarHBondContact OE1-CE1 3.31Å; E560-H564 VanDerWaalsContact OE1-CE1 3.23Å
561	S	86.3	Confident	90.1	Very high	72 Å²	72	44.2 Å²	44.2	50%	0.503	22%	0.218	S	C	.	.	H	α-helix	trans	-58.8	-41.2	-179.8	-55.3	0	0	0	0	111.6	M559 H564 F565	M559-S561 VanDerWaalsContact C-N 3.35Å; M559-S561 PolarHBondContact O-N 2.97Å; S561-H564 WeakPolarHBondContact O-CB 3.3Å; S561-H564 PolarHBondContact O-N 3.3Å; S561-F565 WeakPolarHBondContact O-CD2 3.49Å; S561-F565 PolarHBondContact O-N 3.33Å; S561-F565 VanDerWaalsContact O-N 3.07Å
562	R	88.3	Confident	89.6	Confident	20 Å²	20	44.7 Å²	44.7	8%	0.075	22%	0.223	C	C	.	.	H	α-helix	trans	-64.9	-44.1	177.9	-176.6	179	-178.3	120.5	2.5	111.5	I266 V440 M559 E560 H564 F565 R566	I266-R562 PolarHBondContact O-NH2 3.24Å; V440-R562 PolarHBondContact O-NE 2.73Å; V440-R562 PolarHBondContact O-NH1 3.1Å; V440-R562 PolarHBondContact O-NH2 3.1Å; M559-R562 HydrophobicContact CB-CB 4.44Å; M559-R562 HydrophobicContact CE-CB 3.85Å; M559-R562 HydrophobicContact CE-CG 4.17Å; M559-R562 WeakPolarHBondContact O-CB 3.35Å; M559-R562 PolarHBondContact O-N 3.35Å; E560-R562 VanDerWaalsContact C-N 3.26Å; E560-R562 PolarHBondContact O-N 2.82Å; R562-H564 VanDerWaalsContact C-N 3.26Å; R562-H564 PolarHBondContact O-N 2.91Å; R562-F565 WeakPolarHBondContact O-CB 3.46Å; R562-F565 PolarHBondContact O-N 3.26Å; R562-R566 PolarHBondContact O-N 3.08Å; R562-R566 VanDerWaalsContact O-N 3.09Å
563	L	91.3	Very high	89.3	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.2	-41	176	-173.2	59.6	0	0	0	110.7	P524 F525 Y528 Y557 M559 E560 F565 R566 I567	P524-L563 HydrophobicContact CB-CD2 3.82Å; F525-L563 HydrophobicContact CD1-CD1 4.1Å; F525-L563 HydrophobicContact CD2-CB 4.39Å; F525-L563 HydrophobicContact CD2-CD1 4.47Å; F525-L563 HydrophobicContact CD2-CD2 3.77Å; F525-L563 HydrophobicContact CD2-CG 4.43Å; F525-L563 HydrophobicContact CE1-CB 4.34Å; F525-L563 HydrophobicContact CE1-CD1 4.23Å; F525-L563 HydrophobicContact CE2-CB 3.83Å; F525-L563 HydrophobicContact CE2-CD2 4.03Å; F525-L563 HydrophobicContact CE2-CG 4.36Å; F525-L563 HydrophobicContact CG-CD1 4.26Å; F525-L563 HydrophobicContact CG-CD2 4.21Å; F525-L563 HydrophobicContact CZ-CB 3.79Å; F525-L563 HydrophobicContact CZ-CD1 4.46Å; Y528-L563 HydrophobicContact CD1-CD1 4.06Å; Y528-L563 HydrophobicContact CD2-CD1 4.12Å; Y528-L563 HydrophobicContact CG-CD1 3.68Å; Y557-L563 HydrophobicContact CE2-CB 4.4Å; Y557-L563 HydrophobicContact CE2-CD2 4.02Å; Y557-L563 WeakPolarHBondContact OH-CD2 3.48Å; M559-L563 PolarHBondContact O-N 3.14Å; E560-L563 PolarHBondContact O-N 2.93Å; L563-F565 VanDerWaalsContact C-N 3.35Å; L563-F565 PolarHBondContact O-N 3Å; L563-R566 PolarHBondContact O-N 2.91Å; L563-R566 VanDerWaalsContact O-N 3.17Å; L563-I567 HydrophobicContact CD1-CD1 4.43Å; L563-I567 HydrophobicContact CD1-CG1 4.34Å; L563-I567 HydrophobicContact CD2-CD1 4.34Å; L563-I567 HydrophobicContact CG-CD1 3.89Å; L563-I567 HydrophobicContact CG-CG1 4.22Å; L563-I567 WeakPolarHBondContact O-CB 3.22Å; L563-I567 VanDerWaalsContact O-CG1 3.3Å; L563-I567 WeakPolarHBondContact O-CG1 3.48Å; L563-I567 PolarHBondContact O-N 2.89Å
564	H	89.8	Confident	88.8	Confident	27 Å²	27	38.8 Å²	38.8	13%	0.125	20%	0.196	C	C	.	.	H	α-helix	trans	-62.6	-37.1	176.5	-70.5	175.6	0	0	0	113.7	E560 S561 R562 H568	E560-H564 PolarHBondContact O-N 3.47Å; E560-H564 IonicContact OE1-CE1 2.7Å; E560-H564 PolarHBondContact OE1-CE1 3.31Å; E560-H564 VanDerWaalsContact OE1-CE1 3.23Å; S561-H564 WeakPolarHBondContact O-CB 3.3Å; S561-H564 PolarHBondContact O-N 3.3Å; R562-H564 VanDerWaalsContact C-N 3.26Å; R562-H564 PolarHBondContact O-N 2.91Å; H564-H568 WeakPolarHBondContact O-CB 3.4Å; H564-H568 PolarHBondContact O-N 3.48Å
565	F	86.9	Confident	87.8	Confident	48 Å²	48	40.1 Å²	40.1	21%	0.211	22%	0.22	C	C	.	.	H	α-helix	trans	-60.6	-48.6	171.2	-82.3	-81.1	0	0	0	111.2	M213 P215 L267 S561 R562 L563 I567 H568 A569	M213-F565 WeakPolarHBondContact O-CD1 3.5Å; M213-F565 WeakPolarHBondContact O-CE1 3.46Å; P215-F565 HydrophobicContact CG-CD1 3.91Å; P215-F565 HydrophobicContact CG-CD2 4Å; P215-F565 HydrophobicContact CG-CE1 3.62Å; P215-F565 HydrophobicContact CG-CE2 3.65Å; P215-F565 HydrophobicContact CG-CG 4.1Å; P215-F565 HydrophobicContact CG-CZ 3.46Å; P215-F565 VanDerWaalsContact CG-CZ 3.46Å; L267-F565 HydrophobicContact CB-CB 4.48Å; L267-F565 CarbonylContact O-C 3.51Å; S561-F565 WeakPolarHBondContact O-CD2 3.49Å; S561-F565 PolarHBondContact O-N 3.33Å; S561-F565 VanDerWaalsContact O-N 3.07Å; R562-F565 WeakPolarHBondContact O-CB 3.46Å; R562-F565 PolarHBondContact O-N 3.26Å; L563-F565 VanDerWaalsContact C-N 3.35Å; L563-F565 PolarHBondContact O-N 3Å; F565-I567 PolarHBondContact O-N 3.36Å; F565-H568 PolarHBondContact O-N 2.92Å; F565-A569 PolarHBondContact O-N 3.31Å
566	R	90.4	Very high	86.2	Confident	7 Å²	7	33.3 Å²	33.3	3%	0.026	20%	0.199	C	C	.	.	H	α-helix	trans	-62.9	-43	179.2	-69.1	-177.3	73.9	-162.8	2.8	112.3	L267 Y439 N442 Y528 E529 R562 L563 A569 V570	L267-R566 WeakPolarHBondContact O-CA 3.39Å; L267-R566 PolarHBondContact O-N 2.93Å; Y439-R566 PolarHBondContact OH-NH1 2.95Å; N442-R566 PolarHBondContact OD1-NH1 2.83Å; N442-R566 PolarHBondContact OD1-NH2 3.5Å; Y528-R566 VanDerWaalsContact CE1-NH2 3.29Å; Y528-R566 HydrophobicContact CE2-CB 4.02Å; Y528-R566 PolarHBondContact OH-NE 3.17Å; E529-R566 IonicContact OE1-CZ 2.8Å; E529-R566 IonicContact OE1-NH1 3.2Å; E529-R566 PolarHBondContact OE1-NH1 3.45Å; E529-R566 IonicContact OE1-NH2 3.69Å; E529-R566 PolarHBondContact OE1-NH2 3.34Å; E529-R566 VanDerWaalsContact OE1-NH2 3.08Å; R562-R566 PolarHBondContact O-N 3.08Å; R562-R566 VanDerWaalsContact O-N 3.09Å; L563-R566 PolarHBondContact O-N 2.91Å; L563-R566 VanDerWaalsContact O-N 3.17Å; R566-A569 PolarHBondContact O-N 3.28Å; R566-V570 WeakPolarHBondContact O-CG2 3.2Å; R566-V570 PolarHBondContact O-N 3.04Å
567	I	91.4	Very high	84.6	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.6	-48.8	174.8	-72.6	179.5	0	0	0	110.4	Y528 I547 A550 K551 L563 F565 A569 V570 L571	Y528-I567 HydrophobicContact CD2-CG1 3.66Å; Y528-I567 HydrophobicContact CE2-CG1 4.17Å; I547-I567 HydrophobicContact CG2-CB 4.17Å; I547-I567 HydrophobicContact CG2-CD1 4.39Å; I547-I567 HydrophobicContact CG2-CG1 3.93Å; I547-I567 HydrophobicContact CG2-CG2 3.56Å; A550-I567 HydrophobicContact CB-CD1 4.3Å; K551-I567 HydrophobicContact CB-CD1 3.9Å; K551-I567 HydrophobicContact CB-CG2 4.39Å; K551-I567 HydrophobicContact CD-CG2 3.99Å; L563-I567 HydrophobicContact CD1-CD1 4.43Å; L563-I567 HydrophobicContact CD1-CG1 4.34Å; L563-I567 HydrophobicContact CD2-CD1 4.34Å; L563-I567 HydrophobicContact CG-CD1 3.89Å; L563-I567 HydrophobicContact CG-CG1 4.22Å; L563-I567 WeakPolarHBondContact O-CB 3.22Å; L563-I567 VanDerWaalsContact O-CG1 3.3Å; L563-I567 WeakPolarHBondContact O-CG1 3.48Å; L563-I567 PolarHBondContact O-N 2.89Å; F565-I567 PolarHBondContact O-N 3.36Å; I567-A569 VanDerWaalsContact C-N 3.33Å; I567-A569 PolarHBondContact O-N 3.49Å; I567-V570 PolarHBondContact O-N 2.97Å; I567-L571 HydrophobicContact CG2-CD1 3.63Å; I567-L571 HydrophobicContact CG2-CG 4.11Å; I567-L571 WeakPolarHBondContact O-CB 3.33Å; I567-L571 VanDerWaalsContact O-CG 3.29Å; I567-L571 WeakPolarHBondContact O-CG 3.5Å; I567-L571 PolarHBondContact O-N 3.32Å
568	H	87.2	Confident	82.1	Confident	20 Å²	20	37.4 Å²	37.4	9%	0.093	21%	0.213	C	C	.	.	H	α-helix	trans	-58.3	-45.8	178.3	175.9	-114.7	0	0	0	111.8	H564 F565 N572 F577	H564-H568 WeakPolarHBondContact O-CB 3.4Å; H564-H568 PolarHBondContact O-N 3.48Å; F565-H568 PolarHBondContact O-N 2.92Å; H568-N572 PolarHBondContact CE1-ND2 3Å; H568-N572 VanDerWaalsContact CE1-ND2 3.31Å; H568-N572 PolarHBondContact NE2-ND2 3.21Å; H568-N572 VanDerWaalsContact O-CG 3.26Å; H568-N572 PolarHBondContact O-N 3.12Å; H568-N572 PolarHBondContact O-ND2 3.05Å; H568-N572 VanDerWaalsContact O-ND2 3.16Å; H568-F577 AromaticContact CD2-CE2 3.76Å; H568-F577 AromaticContact CD2-CZ 3.81Å
569	A	85.4	Confident	79.4	Confident	22 Å²	22	41.3 Å²	41.3	18%	0.182	25%	0.246	C	C	.	.	H	α-helix	trans	-60.4	-47.5	177.9	0	0	0	0	0	112.2	F565 R566 I567 N572 T573	F565-A569 PolarHBondContact O-N 3.31Å; R566-A569 PolarHBondContact O-N 3.28Å; I567-A569 VanDerWaalsContact C-N 3.33Å; I567-A569 PolarHBondContact O-N 3.49Å; A569-N572 PolarHBondContact O-N 3.18Å; A569-T573 PolarHBondContact O-N 3.3Å
570	V	89.3	Confident	77	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-66.8	-44.9	-178.6	171.9	0	0	0	0	112	T269 Y528 L532 I547 R566 I567 N572 T573 M574	T269-V570 HydrophobicContact CG2-CG2 3.87Å; Y528-V570 HydrophobicContact CE2-CB 4.34Å; Y528-V570 HydrophobicContact CE2-CG2 3.81Å; Y528-V570 VanDerWaalsContact OH-CG2 3.27Å; Y528-V570 WeakPolarHBondContact OH-CG2 3.34Å; L532-V570 HydrophobicContact CD2-CB 4.42Å; L532-V570 HydrophobicContact CD2-CG1 3.7Å; L532-V570 HydrophobicContact CD2-CG2 3.77Å; I547-V570 HydrophobicContact CD1-CG1 3.78Å; R566-V570 WeakPolarHBondContact O-CG2 3.2Å; R566-V570 PolarHBondContact O-N 3.04Å; I567-V570 PolarHBondContact O-N 2.97Å; V570-N572 VanDerWaalsContact C-N 3.28Å; V570-N572 PolarHBondContact O-N 3.13Å; V570-T573 WeakPolarHBondContact O-CB 3.47Å; V570-T573 PolarHBondContact O-N 3.25Å; V570-T573 PolarHBondContact O-OG1 3.12Å; V570-M574 HydrophobicContact CG1-CE 3.84Å; V570-M574 PolarHBondContact O-N 2.81Å
571	L	87.4	Confident	74.2	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-60.5	-37.8	179.5	-74.3	-178.6	0	0	0	112.3	I544 I547 E548 I567 T573 M574 G575 S576 F577	I544-L571 HydrophobicContact CG1-CD2 4.32Å; I544-L571 HydrophobicContact CG2-CD2 4.3Å; I547-L571 HydrophobicContact CB-CD2 4.36Å; I547-L571 HydrophobicContact CG2-CD1 4.27Å; I547-L571 HydrophobicContact CG2-CD2 3.81Å; I547-L571 HydrophobicContact CG2-CG 3.95Å; E548-L571 HydrophobicContact CG-CD1 4.31Å; I567-L571 HydrophobicContact CG2-CD1 3.63Å; I567-L571 HydrophobicContact CG2-CG 4.11Å; I567-L571 WeakPolarHBondContact O-CB 3.33Å; I567-L571 VanDerWaalsContact O-CG 3.29Å; I567-L571 WeakPolarHBondContact O-CG 3.5Å; I567-L571 PolarHBondContact O-N 3.32Å; L571-T573 VanDerWaalsContact C-N 3.26Å; L571-T573 PolarHBondContact O-N 3.06Å; L571-M574 HydrophobicContact CD2-CE 3.84Å; L571-M574 PolarHBondContact O-N 2.79Å; L571-G575 PolarHBondContact O-N 2.95Å; L571-S576 WeakPolarHBondContact CB-OG 3.09Å; L571-S576 WeakPolarHBondContact CD2-OG 3.45Å; L571-S576 PolarHBondContact O-N 3.29Å; L571-F577 HydrophobicContact CB-CD2 4.1Å; L571-F577 HydrophobicContact CB-CE2 3.92Å; L571-F577 HydrophobicContact CD1-CE2 4.16Å
572	N	81.7	Confident	71.6	Confident	52 Å²	52	57.3 Å²	57.3	28%	0.278	32%	0.323	S	S	.	.	H	α-helix	trans	-59.8	-35.4	173.6	-73.3	-24.8	0	0	0	112.4	H568 A569 V570 M574 G575 F577	H568-N572 PolarHBondContact CE1-ND2 3Å; H568-N572 VanDerWaalsContact CE1-ND2 3.31Å; H568-N572 PolarHBondContact NE2-ND2 3.21Å; H568-N572 VanDerWaalsContact O-CG 3.26Å; H568-N572 PolarHBondContact O-N 3.12Å; H568-N572 PolarHBondContact O-ND2 3.05Å; H568-N572 VanDerWaalsContact O-ND2 3.16Å; A569-N572 PolarHBondContact O-N 3.18Å; V570-N572 VanDerWaalsContact C-N 3.28Å; V570-N572 PolarHBondContact O-N 3.13Å; N572-M574 PolarHBondContact O-N 3.49Å; N572-G575 PolarHBondContact O-N 3.07Å; N572-F577 WeakPolarHBondContact OD1-CD2 3.41Å
573	T	83.5	Confident	69.1	Low	76 Å²	76	62.1 Å²	62.1	47%	0.466	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-12.3	176.3	70.2	0	0	0	0	114.2	T269 K535 A569 V570 L571	T269-T573 HydrophobicContact CG2-CG2 3.89Å; K535-T573 PolarHBondContact NZ-OG1 3.42Å; A569-T573 PolarHBondContact O-N 3.3Å; V570-T573 WeakPolarHBondContact O-CB 3.47Å; V570-T573 PolarHBondContact O-N 3.25Å; V570-T573 PolarHBondContact O-OG1 3.12Å; L571-T573 VanDerWaalsContact C-N 3.26Å; L571-T573 PolarHBondContact O-N 3.06Å
574	M	84.9	Confident	66.3	Low	25 Å²	25	66.7 Å²	66.7	12%	0.123	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	7.7	179.7	-60.8	-169.1	-70.8	0	0	112.6	K535 I540 A543 I544 I547 V570 L571 N572 S576	K535-M574 HydrophobicContact CB-SD 4.28Å; K535-M574 HydrophobicContact CD-CG 4.11Å; K535-M574 HydrophobicContact CD-SD 3.8Å; K535-M574 HydrophobicContact CG-SD 3.91Å; I540-M574 HydrophobicContact CD1-SD 4.41Å; I540-M574 HydrophobicContact CG2-CB 4.1Å; I540-M574 HydrophobicContact CG2-CG 4.33Å; I540-M574 HydrophobicContact CG2-SD 4.07Å; A543-M574 HydrophobicContact CB-CE 4.36Å; A543-M574 HydrophobicContact CB-SD 3.99Å; I544-M574 HydrophobicContact CD1-CB 4.19Å; I544-M574 HydrophobicContact CG1-CB 4.23Å; I544-M574 HydrophobicContact CG1-CE 3.63Å; I544-M574 HydrophobicContact CG1-SD 4.08Å; I547-M574 HydrophobicContact CD1-CE 3.92Å; V570-M574 HydrophobicContact CG1-CE 3.84Å; V570-M574 PolarHBondContact O-N 2.81Å; L571-M574 HydrophobicContact CD2-CE 3.84Å; L571-M574 PolarHBondContact O-N 2.79Å; N572-M574 PolarHBondContact O-N 3.49Å; M574-S576 PolarHBondContact O-N 2.95Å
575	G	70.8	Confident	64.1	Low	61 Å²	61	77.5 Å²	77.5	63%	0.629	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	15.5	178.9	0	0	0	0	0	114.7	L571 N572 F577	L571-G575 PolarHBondContact O-N 2.95Å; N572-G575 PolarHBondContact O-N 3.07Å; G575-F577 VanDerWaalsContact C-N 3.3Å; G575-F577 PolarHBondContact O-N 2.98Å
576	S	61.1	Low	61.6	Low	35 Å²	35	84.5 Å²	84.5	25%	0.245	48%	0.475	C	S	.	.			trans	-82.5	-4.4	-173.7	87.9	0	0	0	0	114.3	L571 M574	L571-S576 WeakPolarHBondContact CB-OG 3.09Å; L571-S576 WeakPolarHBondContact CD2-OG 3.45Å; L571-S576 PolarHBondContact O-N 3.29Å; M574-S576 PolarHBondContact O-N 2.95Å
577	F	54.8	Low	60.2	Low	84 Å²	84	88.4 Å²	88.4	37%	0.368	50%	0.498	S	S	.	.			trans	-95.5	89.9	167.4	-86.2	-87.5	0	0	0	108.4	H568 L571 N572 G575 A579	H568-F577 AromaticContact CD2-CE2 3.76Å; H568-F577 AromaticContact CD2-CZ 3.81Å; L571-F577 HydrophobicContact CB-CD2 4.1Å; L571-F577 HydrophobicContact CB-CE2 3.92Å; L571-F577 HydrophobicContact CD1-CE2 4.16Å; N572-F577 WeakPolarHBondContact OD1-CD2 3.41Å; G575-F577 VanDerWaalsContact C-N 3.3Å; G575-F577 PolarHBondContact O-N 2.98Å; F577-A579 PolarHBondContact O-N 3.3Å
578	E	39.5	Very low	58.5	Low	171 Å²	171	93.1 Å²	93.1	80%	0.799	52%	0.524	S	S	*	.			trans	-55.8	122.9	157.6	-76.2	-176	161.4	0	0	107.7	K580	E578-K580 VanDerWaalsContact C-N 3.28Å; E578-K580 PolarHBondContact O-N 3.3Å
579	A	36.4	Very low	56.9	Low	96 Å²	96	97.1 Å²	97.1	79%	0.793	55%	0.548	S	S	*	.			trans	-57.7	98.5	163.1	0	0	0	0	0	106.9	F577 L581	F577-A579 PolarHBondContact O-N 3.3Å; A579-L581 PolarHBondContact O-N 3.41Å
580	K	40.3	Very low	55.2	Low	195 Å²	195	101.5 Å²	101.5	85%	0.848	57%	0.57	S	S	*	*			trans	-60.3	109.1	167	-81.1	-172.7	175.7	-175.7	0	105.8	E578	E578-K580 VanDerWaalsContact C-N 3.28Å; E578-K580 PolarHBondContact O-N 3.3Å
581	L	31.2	Very low	53.1	Low	157 Å²	157	107.9 Å²	107.9	82%	0.822	61%	0.605	S	S	*	*			trans	-40.8	134.6	170.5	-81.8	151	0	0	0	108.4	A579	A579-L581 PolarHBondContact O-N 3.41Å
582	P	32	Very low	50.8	Low	107 Å²	107	115 Å²	115	70%	0.695	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-52.9	142	177	21.5	-30.6	0	0	0	108.7	S584	P582-S584 PolarHBondContact O-N 2.97Å; P582-S584 VanDerWaalsContact O-N 3.07Å
583	P	36.6	Very low	48.6	Very low	120 Å²	120	119.5 Å²	119.5	78%	0.779	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-53.2	125	177.6	21.4	-30.5	0	0	0	107.9	R585	P583-R585 PolarHBondContact O-N 3.45Å
584	S	32.2	Very low	45.9	Very low	96 Å²	96	122.8 Å²	122.8	67%	0.671	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-52.7	119.9	175.3	58.5	0	0	0	0	107.3	P582 T586	P582-S584 PolarHBondContact O-N 2.97Å; P582-S584 VanDerWaalsContact O-N 3.07Å; S584-T586 PolarHBondContact O-N 2.86Å
585	R	42.5	Very low	42.7	Very low	254 Å²	254	131 Å²	131	96%	0.958	73%	0.734	S	S	*	*			trans	-68.2	90.4	167.6	-74.5	-177	175	179.5	-1.2	107.1	P583	P583-R585 PolarHBondContact O-N 3.45Å
586	T	34.9	Very low	40.1	Very low	196 Å²	196	137.4 Å²	137.4	100%	1.202	74%	0.744	S	S	*	*			trans	-103.1	0	155.2	42	0	0	0	0	108.3	S584	S584-T586 PolarHBondContact O-N 2.86Å

Retrieved 586 of 586 residues in 228.7 ms (Link to these results)

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