A0A087Y723_POEFO Loading...

Eukaryotic translation initiation factor 3 subunit L

Component of the eukaryotic translation initiation factor 3 (eIF-3) complex, which is involved in protein synthesis of a specialized repertoire of mRNAs and, together with other initiation factors, stimulates binding of mRNA and methionyl-tRNAi to the 40S ribosome. The eIF-3 complex specifically targets and initiates translation of a subset of mRNAs involved in cell proliferation.

AlphaFold DB , UniProt , Accession A0A087Y723, Species POEFO (Poecilia formosa, Amazon molly), Gene EIF3L, Length 566 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.4	Very low	31	Very low	233 Å²	233	174.4 Å²	174.4	100%	1.148	84%	0.835	S	S	*	*				0	94.1	0	-72.9	173.3	166.4	0	0	105.3
2	S	26.9	Very low	31.3	Very low	88 Å²	88	177.5 Å²	177.5	62%	0.615	84%	0.835	S	S	*	*				57	130.9	68.2	82.4	0	0	0	0	110.3
3	Y	28.9	Very low	31.6	Very low	201 Å²	201	175.5 Å²	175.5	79%	0.788	83%	0.833	S	S	*	*			cis	-154.7	137.4	30.8	-88.8	-84.8	0	0	0	107.9
4	H	30	Very low	32.5	Very low	173 Å²	173	177.7 Å²	177.7	80%	0.801	83%	0.831	S	S	*	*				57.5	114.2	103.2	-82.5	-72.1	0	0	0	116
5	E	31.9	Very low	33.4	Very low	195 Å²	195	175.9 Å²	175.9	91%	0.911	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-77	133.1	160.1	-78.3	172	149.9	0	0	109.3
6	E	31.1	Very low	34.2	Very low	197 Å²	197	172.1 Å²	172.1	92%	0.921	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-83.4	130.3	179	-71.8	172.8	153.6	0	0	110.8
7	E	31	Very low	35	Very low	192 Å²	192	170.2 Å²	170.2	90%	0.897	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-81.4	147	168.7	-76.6	177.3	155.2	0	0	111.2
8	E	30	Very low	36.3	Very low	202 Å²	202	166.7 Å²	166.7	94%	0.944	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-54.9	138.3	177.5	-85.8	171.2	137.4	0	0	113.9
9	Y	29.9	Very low	37.5	Very low	207 Å²	207	161.5 Å²	161.5	81%	0.812	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-92.2	119.8	-178.5	-155.9	-88.2	0	0	0	110.4
10	D	32.5	Very low	38.3	Very low	128 Å²	128	158.2 Å²	158.2	68%	0.684	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-92.4	126.5	173.6	-158.4	-21.6	0	0	0	110.3	Y12	D10-Y12 PolarHBondContact O-N 2.84Å; D10-Y12 VanDerWaalsContact O-N 3.16Å
11	P	35.2	Very low	39.3	Very low	102 Å²	102	155.2 Å²	155.2	66%	0.662	77%	0.771	S	S	*	*	S	Bend	trans	-88.4	28.5	-159.7	-6.3	27.1	0	0	0	116.4
12	Y	35.3	Very low	40.6	Very low	212 Å²	212	152.5 Å²	152.5	83%	0.831	75%	0.752	S	S	*	*			trans	-116.8	18	-172.4	-71	-71.8	0	0	0	116.2	D10	D10-Y12 PolarHBondContact O-N 2.84Å; D10-Y12 VanDerWaalsContact O-N 3.16Å
13	D	34.7	Very low	42	Very low	151 Å²	151	150.2 Å²	150.2	81%	0.807	74%	0.739	S	S	*	*			trans	-108.3	53	-178.2	-156.1	23.3	0	0	0	113.8
14	Y	44.1	Very low	43.2	Very low	207 Å²	207	141.8 Å²	141.8	81%	0.812	71%	0.707	S	S	*	*			trans	-146	96.5	167.4	-104.6	-87	0	0	0	109.8
15	D	45.9	Very low	44.5	Very low	151 Å²	151	138.1 Å²	138.1	81%	0.807	69%	0.693	S	S	*	*				172.9	93.2	129.5	-91.1	-27	0	0	0	110.8
16	L	46.1	Very low	45.7	Very low	115 Å²	115	131.1 Å²	131.1	60%	0.602	67%	0.669	S	S	*	*			trans	-140.3	30.2	169.1	-110.5	140.8	0	0	0	112.7	Y27	L16-Y27 HydrophobicContact CD2-CD1 4.28Å; L16-Y27 HydrophobicContact CD2-CE1 3.42Å; L16-Y27 VanDerWaalsContact CD2-CE1 3.42Å; L16-Y27 HydrophobicContact CD2-CE2 4.23Å; L16-Y27 VanDerWaalsContact CD2-OH 3.28Å; L16-Y27 WeakPolarHBondContact CD2-OH 3.19Å
17	H	48.4	Very low	46.7	Very low	140 Å²	140	126.6 Å²	126.6	65%	0.648	64%	0.644	S	S	*	*			trans	-120.5	115	167.2	-77.3	-61.5	0	0	0	109.3	G19 D24	H17-G19 PolarHBondContact O-N 2.77Å; H17-D24 WeakPolarHBondContact CA-OD2 3.27Å; H17-D24 WeakPolarHBondContact CB-OD2 3.35Å; H17-D24 IonicContact CG-OD2 2.68Å; H17-D24 IonicContact ND1-OD2 2.86Å; H17-D24 PolarHBondContact ND1-OD2 2.88Å; H17-D24 VanDerWaalsContact ND1-OD2 3.13Å
18	T	57.9	Low	47.7	Very low	107 Å²	107	122.4 Å²	122.4	66%	0.656	62%	0.624	S	S	*	*			trans	-79.2	-0.3	-178.3	53.6	0	0	0	0	112.8	D20 D24	T18-D20 PolarHBondContact O-N 2.9Å; T18-D20 VanDerWaalsContact O-N 3.15Å; T18-D24 PolarHBondContact N-OD1 2.89Å; T18-D24 PolarHBondContact N-OD2 2.89Å; T18-D24 PolarHBondContact OG1-OD1 3.21Å
19	G	58.5	Low	48.6	Very low	68 Å²	68	120.6 Å²	120.6	70%	0.701	61%	0.609	S	S	*	*	S	Bend	trans	73	0.7	175.8	0	0	0	0	0	114.1	H17	H17-G19 PolarHBondContact O-N 2.77Å
20	D	54.4	Low	49.3	Very low	95 Å²	95	116.1 Å²	116.1	51%	0.508	60%	0.595	S	S	.	*			trans	-103.7	109	171	-165.1	-14.6	0	0	0	108.9	T18 K22 A23 D24	T18-D20 PolarHBondContact O-N 2.9Å; T18-D20 VanDerWaalsContact O-N 3.15Å; D20-K22 PolarHBondContact O-N 3.25Å; D20-A23 HydrophobicContact CB-CB 4.13Å; D20-A23 PolarHBondContact O-N 3.06Å; D20-D24 PolarHBondContact O-N 3.01Å; D20-D24 VanDerWaalsContact O-N 3.09Å
21	P	59.1	Low	49.6	Very low	96 Å²	96	116 Å²	116	62%	0.623	59%	0.586	S	S	*	*	H	α-helix	trans	-56.1	-26.3	-173.3	-26.2	33.6	0	0	0	113.8	L25	P21-L25 VanDerWaalsContact O-CB 3.26Å; P21-L25 WeakPolarHBondContact O-CB 3.48Å; P21-L25 WeakPolarHBondContact O-CD1 3.36Å; P21-L25 WeakPolarHBondContact O-CG 3.3Å; P21-L25 PolarHBondContact O-N 3.31Å
22	K	60.8	Low	49.7	Very low	175 Å²	175	117.3 Å²	117.3	76%	0.761	58%	0.584	S	S	*	*	H	α-helix	trans	-77.6	-34.3	177.4	-98.9	-175.8	174.2	178.9	0	113.5	D20 A26	D20-K22 PolarHBondContact O-N 3.25Å; K22-A26 WeakPolarHBondContact O-CB 3.18Å; K22-A26 PolarHBondContact O-N 3.24Å; K22-A26 VanDerWaalsContact O-N 3.15Å
23	A	55.4	Low	49.9	Very low	41 Å²	41	114.2 Å²	114.2	34%	0.339	58%	0.576	S	S	.	*	H	α-helix	trans	-77	-39.6	179.8	0	0	0	0	0	110.4	D20 A26 Y27	D20-A23 HydrophobicContact CB-CB 4.13Å; D20-A23 PolarHBondContact O-N 3.06Å; A23-A26 PolarHBondContact O-N 3.41Å; A23-Y27 WeakPolarHBondContact O-CB 3.49Å; A23-Y27 PolarHBondContact O-N 3.33Å
24	D	55.8	Low	50	Low	23 Å²	23	114.2 Å²	114.2	12%	0.123	57%	0.572	C	S	.	*	H	α-helix	trans	-69.2	-38.5	176.5	-69	-6.7	0	0	0	111.5	H17 T18 D20 A26 Y27 E28	H17-D24 WeakPolarHBondContact CA-OD2 3.27Å; H17-D24 WeakPolarHBondContact CB-OD2 3.35Å; H17-D24 IonicContact CG-OD2 2.68Å; H17-D24 IonicContact ND1-OD2 2.86Å; H17-D24 PolarHBondContact ND1-OD2 2.88Å; H17-D24 VanDerWaalsContact ND1-OD2 3.13Å; T18-D24 PolarHBondContact N-OD1 2.89Å; T18-D24 PolarHBondContact N-OD2 2.89Å; T18-D24 PolarHBondContact OG1-OD1 3.21Å; D20-D24 PolarHBondContact O-N 3.01Å; D20-D24 VanDerWaalsContact O-N 3.09Å; D24-A26 VanDerWaalsContact C-N 3.31Å; D24-A26 PolarHBondContact O-N 3.44Å; D24-Y27 PolarHBondContact O-N 3.38Å; D24-E28 WeakPolarHBondContact O-CB 3.4Å; D24-E28 PolarHBondContact O-N 3.26Å
25	L	56.9	Low	49.6	Very low	96 Å²	96	108.8 Å²	108.8	50%	0.503	56%	0.56	S	S	.	*	H	α-helix	trans	-65.8	-30.2	170.3	-91.1	161	0	0	0	113.4	P21 R29	P21-L25 VanDerWaalsContact O-CB 3.26Å; P21-L25 WeakPolarHBondContact O-CB 3.48Å; P21-L25 WeakPolarHBondContact O-CD1 3.36Å; P21-L25 WeakPolarHBondContact O-CG 3.3Å; P21-L25 PolarHBondContact O-N 3.31Å; L25-R29 VanDerWaalsContact O-CB 3.27Å; L25-R29 WeakPolarHBondContact O-CB 3.4Å; L25-R29 VanDerWaalsContact O-CG 3.26Å; L25-R29 WeakPolarHBondContact O-CG 3.45Å; L25-R29 PolarHBondContact O-N 2.7Å
26	A	56.6	Low	49.1	Very low	48 Å²	48	109.7 Å²	109.7	40%	0.397	55%	0.554	S	S	.	*	H	α-helix	trans	-76.6	-35.7	175.5	0	0	0	0	0	111.2	K22 A23 D24 R29 Q30	K22-A26 WeakPolarHBondContact O-CB 3.18Å; K22-A26 PolarHBondContact O-N 3.24Å; K22-A26 VanDerWaalsContact O-N 3.15Å; A23-A26 PolarHBondContact O-N 3.41Å; D24-A26 VanDerWaalsContact C-N 3.31Å; D24-A26 PolarHBondContact O-N 3.44Å; A26-R29 PolarHBondContact O-N 2.97Å; A26-Q30 WeakPolarHBondContact O-CB 3.31Å; A26-Q30 WeakPolarHBondContact O-CG 3.17Å; A26-Q30 PolarHBondContact O-N 3.2Å
27	Y	52.8	Low	48.8	Very low	102 Å²	102	110.1 Å²	110.1	40%	0.4	55%	0.552	S	S	.	*	H	α-helix	trans	-68.1	-47.6	173.7	-168.7	-93.6	0	0	0	110.7	L16 A23 D24 R29 Q30 Y31	L16-Y27 HydrophobicContact CD2-CD1 4.28Å; L16-Y27 HydrophobicContact CD2-CE1 3.42Å; L16-Y27 VanDerWaalsContact CD2-CE1 3.42Å; L16-Y27 HydrophobicContact CD2-CE2 4.23Å; L16-Y27 VanDerWaalsContact CD2-OH 3.28Å; L16-Y27 WeakPolarHBondContact CD2-OH 3.19Å; A23-Y27 WeakPolarHBondContact O-CB 3.49Å; A23-Y27 PolarHBondContact O-N 3.33Å; D24-Y27 PolarHBondContact O-N 3.38Å; Y27-R29 PolarHBondContact O-N 2.95Å; Y27-Q30 CarbonylContact O-C 3.32Å; Y27-Q30 PolarHBondContact O-N 3.26Å; Y27-Q30 VanDerWaalsContact O-N 3.12Å; Y27-Y31 HydrophobicContact CD1-CD2 4.35Å; Y27-Y31 AromaticContact CE1-CD2 3.62Å; Y27-Y31 HydrophobicContact CE1-CD2 3.62Å; Y27-Y31 HydrophobicContact CE1-CE2 4.02Å; Y27-Y31 HydrophobicContact CE1-CG 4.48Å; Y27-Y31 AromaticContact CZ-CD2 3.88Å; Y27-Y31 VanDerWaalsContact O-CB 3.32Å; Y27-Y31 WeakPolarHBondContact O-CB 3.29Å; Y27-Y31 PolarHBondContact O-N 2.87Å
28	E	51	Low	48.6	Very low	105 Å²	105	108.6 Å²	108.6	49%	0.491	55%	0.552	S	S	.	*	H	α-helix	trans	-59.3	-42.1	171.2	-81.9	-177.1	156.4	0	0	111.9	D24 Q30 Y31 E32	D24-E28 WeakPolarHBondContact O-CB 3.4Å; D24-E28 PolarHBondContact O-N 3.26Å; E28-Q30 VanDerWaalsContact C-N 3.34Å; E28-Q30 PolarHBondContact O-N 3.2Å; E28-Y31 PolarHBondContact O-N 3Å; E28-E32 VanDerWaalsContact O-CB 3.27Å; E28-E32 WeakPolarHBondContact O-CB 3.41Å; E28-E32 WeakPolarHBondContact O-CG 3.5Å; E28-E32 PolarHBondContact O-N 3.32Å
29	R	49.2	Very low	48.2	Very low	164 Å²	164	104.1 Å²	104.1	62%	0.619	52%	0.524	S	S	*	.	H	α-helix	trans	-64.7	-35.8	173.4	-84	-178.5	-174.2	-178	3.6	113.2	L25 A26 Y27 Q33	L25-R29 VanDerWaalsContact O-CB 3.27Å; L25-R29 WeakPolarHBondContact O-CB 3.4Å; L25-R29 VanDerWaalsContact O-CG 3.26Å; L25-R29 WeakPolarHBondContact O-CG 3.45Å; L25-R29 PolarHBondContact O-N 2.7Å; A26-R29 PolarHBondContact O-N 2.97Å; Y27-R29 PolarHBondContact O-N 2.95Å; R29-Q33 VanDerWaalsContact O-CB 3.26Å; R29-Q33 WeakPolarHBondContact O-CB 3.39Å; R29-Q33 WeakPolarHBondContact O-CG 3.41Å; R29-Q33 PolarHBondContact O-N 3.17Å
30	Q	44.6	Very low	48	Very low	113 Å²	113	102.9 Å²	102.9	53%	0.528	50%	0.504	S	S	.	.	H	α-helix	trans	-72.9	-35.4	174.8	-84.8	-176.7	-41.1	0	0	111.5	A26 Y27 E28 Q33 Q34	A26-Q30 WeakPolarHBondContact O-CB 3.31Å; A26-Q30 WeakPolarHBondContact O-CG 3.17Å; A26-Q30 PolarHBondContact O-N 3.2Å; Y27-Q30 CarbonylContact O-C 3.32Å; Y27-Q30 PolarHBondContact O-N 3.26Å; Y27-Q30 VanDerWaalsContact O-N 3.12Å; E28-Q30 VanDerWaalsContact C-N 3.34Å; E28-Q30 PolarHBondContact O-N 3.2Å; Q30-Q33 PolarHBondContact O-N 3.42Å; Q30-Q34 WeakPolarHBondContact O-CB 3.03Å; Q30-Q34 WeakPolarHBondContact O-CG 3.37Å; Q30-Q34 PolarHBondContact O-N 3.04Å
31	Y	38.7	Very low	48	Very low	125 Å²	125	105.6 Å²	105.6	49%	0.49	51%	0.513	S	S	.	.	H	α-helix	trans	-70.9	-45.6	176.8	-135.3	-93.5	0	0	0	110.6	Y27 E28 Q33 Q34 T35	Y27-Y31 HydrophobicContact CD1-CD2 4.35Å; Y27-Y31 AromaticContact CE1-CD2 3.62Å; Y27-Y31 HydrophobicContact CE1-CD2 3.62Å; Y27-Y31 HydrophobicContact CE1-CE2 4.02Å; Y27-Y31 HydrophobicContact CE1-CG 4.48Å; Y27-Y31 AromaticContact CZ-CD2 3.88Å; Y27-Y31 VanDerWaalsContact O-CB 3.32Å; Y27-Y31 WeakPolarHBondContact O-CB 3.29Å; Y27-Y31 PolarHBondContact O-N 2.87Å; E28-Y31 PolarHBondContact O-N 3Å; Y31-Q33 VanDerWaalsContact C-N 3.29Å; Y31-Q33 PolarHBondContact O-N 3.09Å; Y31-Q34 CarbonylContact O-C 3.53Å; Y31-Q34 WeakPolarHBondContact O-CA 3.31Å; Y31-Q34 PolarHBondContact O-N 2.9Å; Y31-T35 PolarHBondContact O-N 3.19Å; Y31-T35 PolarHBondContact O-OG1 2.95Å
32	E	37.4	Very low	47.9	Very low	130 Å²	130	104.9 Å²	104.9	61%	0.607	51%	0.507	S	S	*	.	H	α-helix	trans	-59.6	-37.2	171.3	-78.3	-176.5	152.8	0	0	111.8	E28 Q34 Y36	E28-E32 VanDerWaalsContact O-CB 3.27Å; E28-E32 WeakPolarHBondContact O-CB 3.41Å; E28-E32 WeakPolarHBondContact O-CG 3.5Å; E28-E32 PolarHBondContact O-N 3.32Å; E32-Q34 VanDerWaalsContact C-N 3.3Å; E32-Q34 PolarHBondContact O-N 2.89Å; E32-Y36 PolarHBondContact O-N 3.37Å
33	Q	39.6	Very low	47.8	Very low	146 Å²	146	96.6 Å²	96.6	68%	0.682	47%	0.471	S	S	*	.	H	α-helix	trans	-70	-24	172.6	-79.1	172.5	11.4	0	0	113.6	R29 Q30 Y31	R29-Q33 VanDerWaalsContact O-CB 3.26Å; R29-Q33 WeakPolarHBondContact O-CB 3.39Å; R29-Q33 WeakPolarHBondContact O-CG 3.41Å; R29-Q33 PolarHBondContact O-N 3.17Å; Q30-Q33 PolarHBondContact O-N 3.42Å; Y31-Q33 VanDerWaalsContact C-N 3.29Å; Y31-Q33 PolarHBondContact O-N 3.09Å
34	Q	37.5	Very low	48	Very low	152 Å²	152	98 Å²	98	71%	0.71	47%	0.47	S	S	*	.	H	α-helix	trans	-91.8	-30.9	-179.7	-77.1	174.7	9.7	0	0	113.2	Q30 Y31 E32	Q30-Q34 WeakPolarHBondContact O-CB 3.03Å; Q30-Q34 WeakPolarHBondContact O-CG 3.37Å; Q30-Q34 PolarHBondContact O-N 3.04Å; Y31-Q34 CarbonylContact O-C 3.53Å; Y31-Q34 WeakPolarHBondContact O-CA 3.31Å; Y31-Q34 PolarHBondContact O-N 2.9Å; E32-Q34 VanDerWaalsContact C-N 3.3Å; E32-Q34 PolarHBondContact O-N 2.89Å
35	T	35.1	Very low	48.3	Very low	92 Å²	92	101.6 Å²	101.6	56%	0.564	49%	0.489	S	S	*	.	H	α-helix	trans	-99.3	-21.5	179.8	20.9	0	0	0	0	114.3	Y31	Y31-T35 PolarHBondContact O-N 3.19Å; Y31-T35 PolarHBondContact O-OG1 2.95Å
36	Y	36.1	Very low	48.6	Very low	171 Å²	171	98 Å²	98	67%	0.671	47%	0.469	S	S	*	.			trans	-124.7	95	172.9	-76.6	-90.2	0	0	0	110.1	E32 V38	E32-Y36 PolarHBondContact O-N 3.37Å; Y36-V38 PolarHBondContact O-N 2.82Å
37	H	40.1	Very low	49	Very low	123 Å²	123	95.9 Å²	95.9	57%	0.569	45%	0.451	S	S	*	.			trans	-64.2	82.3	156.1	-145.3	-59.6	0	0	0	106.6	I39	H37-I39 VanDerWaalsContact C-N 3.26Å; H37-I39 PolarHBondContact O-N 3.47Å
38	V	42.3	Very low	49.5	Very low	108 Å²	108	95.4 Å²	95.4	66%	0.655	45%	0.453	S	S	*	.			trans	-61.1	94.5	179.5	179.1	0	0	0	0	106.5	Y36 P40	Y36-V38 PolarHBondContact O-N 2.82Å; V38-P40 WeakPolarHBondContact O-CD 3.45Å
39	I	49.8	Very low	50.1	Low	13 Å²	13	95.9 Å²	95.9	7%	0.067	45%	0.451	C	S	.	.			trans	-55.2	115.6	172.3	-54.6	-176.5	0	0	0	105	H37 E41 I43 K44 P104 I109 L112	H37-I39 VanDerWaalsContact C-N 3.26Å; H37-I39 PolarHBondContact O-N 3.47Å; I39-E41 PolarHBondContact O-N 2.87Å; I39-I43 HydrophobicContact CG2-CB 3.69Å; I39-I43 HydrophobicContact CG2-CG2 3.43Å; I39-I43 VanDerWaalsContact CG2-CG2 3.43Å; I39-K44 HydrophobicContact CB-CD 4.47Å; I39-K44 HydrophobicContact CB-CG 3.92Å; I39-K44 HydrophobicContact CG2-CG 3.7Å; I39-K44 WeakPolarHBondContact O-CE 3.18Å; I39-P104 HydrophobicContact CD1-CB 3.7Å; I39-P104 HydrophobicContact CD1-CG 3.78Å; I39-P104 HydrophobicContact CG1-CB 3.96Å; I39-P104 HydrophobicContact CG1-CG 3.65Å; I39-P104 HydrophobicContact CG2-CG 4.36Å; I39-I109 HydrophobicContact CD1-CG1 4.03Å; I39-L112 HydrophobicContact CD1-CD1 4.07Å
40	P	54.8	Low	50.8	Low	42 Å²	42	88.3 Å²	88.3	27%	0.273	42%	0.422	S	S	.	.			trans	-50.6	139.2	179.5	-29.2	35.6	0	0	0	110	V38 V42 I43 K44 F97	V38-P40 WeakPolarHBondContact O-CD 3.45Å; P40-V42 PolarHBondContact O-N 3.28Å; P40-I43 HydrophobicContact CB-CD1 4.03Å; P40-I43 HydrophobicContact CG-CD1 3.74Å; P40-I43 WeakPolarHBondContact O-CA 3.42Å; P40-I43 WeakPolarHBondContact O-CB 3.32Å; P40-I43 PolarHBondContact O-N 2.86Å; P40-K44 PolarHBondContact O-N 3.39Å; P40-F97 HydrophobicContact CG-CD1 4.31Å; P40-F97 HydrophobicContact CG-CE1 4.46Å
41	E	54.2	Low	51.7	Low	152 Å²	152	84.7 Å²	84.7	71%	0.71	41%	0.405	S	S	*	.	H	α-helix	trans	-54.1	-30.1	-178.3	-70.9	-176.4	162.4	0	0	112.3	I39 I43 K44 N45	I39-E41 PolarHBondContact O-N 2.87Å; E41-I43 VanDerWaalsContact C-N 3.3Å; E41-I43 PolarHBondContact O-N 3.33Å; E41-K44 PolarHBondContact O-N 3.19Å; E41-N45 VanDerWaalsContact O-CB 3.25Å; E41-N45 WeakPolarHBondContact O-CB 3.24Å; E41-N45 PolarHBondContact O-N 3.26Å; E41-N45 PolarHBondContact O-ND2 2.96Å
42	V	56.4	Low	53	Low	82 Å²	82	84.8 Å²	84.8	50%	0.497	41%	0.408	S	S	.	.	H	α-helix	trans	-59.9	-39	173.4	-174.6	0	0	0	0	112.1	P40 F46 L93	P40-V42 PolarHBondContact O-N 3.28Å; V42-F46 WeakPolarHBondContact O-CB 3.41Å; V42-F46 PolarHBondContact O-N 3.34Å; V42-L93 HydrophobicContact CG1-CD2 3.92Å
43	I	60	Low	54.1	Low	0 Å²	0	79 Å²	79	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-78.1	-37.9	177.4	-68.7	152.7	0	0	0	110.5	I39 P40 E41 F46 L47 F97 F98 W103	I39-I43 HydrophobicContact CG2-CB 3.69Å; I39-I43 HydrophobicContact CG2-CG2 3.43Å; I39-I43 VanDerWaalsContact CG2-CG2 3.43Å; P40-I43 HydrophobicContact CB-CD1 4.03Å; P40-I43 HydrophobicContact CG-CD1 3.74Å; P40-I43 WeakPolarHBondContact O-CA 3.42Å; P40-I43 WeakPolarHBondContact O-CB 3.32Å; P40-I43 PolarHBondContact O-N 2.86Å; E41-I43 VanDerWaalsContact C-N 3.3Å; E41-I43 PolarHBondContact O-N 3.33Å; I43-F46 PolarHBondContact O-N 3.1Å; I43-L47 HydrophobicContact CG2-CD1 3.84Å; I43-L47 HydrophobicContact CG2-CG 4.25Å; I43-L47 WeakPolarHBondContact O-CB 3.36Å; I43-L47 WeakPolarHBondContact O-CG 3.3Å; I43-L47 PolarHBondContact O-N 3.02Å; I43-F97 HydrophobicContact CD1-CB 4.22Å; I43-F97 HydrophobicContact CD1-CD2 4.31Å; I43-F97 HydrophobicContact CD1-CG 4.21Å; I43-F98 HydrophobicContact CD1-CD2 4.41Å; I43-F98 HydrophobicContact CD1-CE2 3.37Å; I43-F98 HydrophobicContact CD1-CZ 3.83Å; I43-F98 HydrophobicContact CG1-CE2 4.36Å; I43-W103 HydrophobicContact CG2-CE3 4.27Å; I43-W103 HydrophobicContact CG2-CH2 4.43Å; I43-W103 HydrophobicContact CG2-CZ3 3.71Å
44	K	60.1	Low	55.3	Low	72 Å²	72	72.2 Å²	72.2	31%	0.313	35%	0.35	S	S	.	.	H	α-helix	trans	-61.4	-47	172.5	-67.2	-175.3	-179.8	179.8	0	111.7	I39 P40 E41 F46 L47 Q48 L112	I39-K44 HydrophobicContact CB-CD 4.47Å; I39-K44 HydrophobicContact CB-CG 3.92Å; I39-K44 HydrophobicContact CG2-CG 3.7Å; I39-K44 WeakPolarHBondContact O-CE 3.18Å; P40-K44 PolarHBondContact O-N 3.39Å; E41-K44 PolarHBondContact O-N 3.19Å; K44-F46 VanDerWaalsContact C-N 3.33Å; K44-F46 PolarHBondContact O-N 3.21Å; K44-L47 PolarHBondContact O-N 3.43Å; K44-Q48 WeakPolarHBondContact O-CB 3.47Å; K44-Q48 WeakPolarHBondContact O-CG 3.08Å; K44-Q48 PolarHBondContact O-N 2.76Å; K44-L112 HydrophobicContact CD-CD1 4.47Å; K44-L112 HydrophobicContact CD-CD2 4.1Å; K44-L112 HydrophobicContact CG-CD1 4.3Å; K44-L112 HydrophobicContact CG-CD2 4.35Å
45	N	61.3	Low	56.6	Low	98 Å²	98	66.2 Å²	66.2	52%	0.524	33%	0.325	S	S	.	.	H	α-helix	trans	-65.1	-37.8	177.2	-69.1	-17.2	0	0	0	111.6	E41 Y49	E41-N45 VanDerWaalsContact O-CB 3.25Å; E41-N45 WeakPolarHBondContact O-CB 3.24Å; E41-N45 PolarHBondContact O-N 3.26Å; E41-N45 PolarHBondContact O-ND2 2.96Å; N45-Y49 WeakPolarHBondContact O-CB 3.38Å; N45-Y49 PolarHBondContact O-N 2.96Å
46	F	64.3	Low	57.9	Low	21 Å²	21	64.8 Å²	64.8	9%	0.092	31%	0.314	C	S	.	.	H	α-helix	trans	-65	-45.1	173.8	175.6	-94	0	0	0	112.2	V42 I43 K44 Y49 F50 V85 W90 L93	V42-F46 WeakPolarHBondContact O-CB 3.41Å; V42-F46 PolarHBondContact O-N 3.34Å; I43-F46 PolarHBondContact O-N 3.1Å; K44-F46 VanDerWaalsContact C-N 3.33Å; K44-F46 PolarHBondContact O-N 3.21Å; F46-Y49 PolarHBondContact O-N 3.34Å; F46-F50 VanDerWaalsContact O-CB 3.25Å; F46-F50 WeakPolarHBondContact O-CB 3.41Å; F46-F50 PolarHBondContact O-N 3.42Å; F46-V85 HydrophobicContact CE2-CG1 3.6Å; F46-V85 HydrophobicContact CZ-CG1 3.51Å; F46-W90 AromaticContact CE1-CE3 3.71Å; F46-W90 HydrophobicContact CE1-CE3 3.71Å; F46-W90 HydrophobicContact CE1-CZ3 4.13Å; F46-W90 HydrophobicContact CZ-CE3 4.17Å; F46-L93 HydrophobicContact CB-CD1 3.95Å; F46-L93 HydrophobicContact CD1-CD1 3.85Å; F46-L93 HydrophobicContact CD2-CD1 3.54Å; F46-L93 HydrophobicContact CE1-CD1 4.24Å; F46-L93 HydrophobicContact CE2-CD1 3.92Å; F46-L93 HydrophobicContact CG-CD1 3.47Å; F46-L93 VanDerWaalsContact CG-CD1 3.47Å; F46-L93 HydrophobicContact CZ-CD1 4.26Å
47	L	64	Low	59.1	Low	2 Å²	2	56.9 Å²	56.9	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-67.8	-38.2	178.7	-70.6	170.9	0	0	0	111.9	I43 K44 F50 H51 W103 I109 F119 Y123	I43-L47 HydrophobicContact CG2-CD1 3.84Å; I43-L47 HydrophobicContact CG2-CG 4.25Å; I43-L47 WeakPolarHBondContact O-CB 3.36Å; I43-L47 WeakPolarHBondContact O-CG 3.3Å; I43-L47 PolarHBondContact O-N 3.02Å; K44-L47 PolarHBondContact O-N 3.43Å; L47-F50 PolarHBondContact O-N 3.28Å; L47-H51 VanDerWaalsContact O-CB 3.27Å; L47-H51 WeakPolarHBondContact O-CB 3.19Å; L47-H51 PolarHBondContact O-N 2.86Å; L47-W103 HydrophobicContact CD2-CZ3 4.45Å; L47-I109 HydrophobicContact CD1-CD1 3.67Å; L47-I109 HydrophobicContact CD1-CG1 3.94Å; L47-I109 HydrophobicContact CD1-CG2 4.19Å; L47-F119 HydrophobicContact CD2-CZ 4.43Å; L47-Y123 HydrophobicContact CD2-CD2 3.74Å; L47-Y123 HydrophobicContact CD2-CE2 3.61Å
48	Q	63.6	Low	60.1	Low	93 Å²	93	52.2 Å²	52.2	44%	0.435	26%	0.262	S	S	.	.	H	α-helix	trans	-67.4	-39.9	173.3	-74.4	178.8	-9.3	0	0	112.1	K44 K52	K44-Q48 WeakPolarHBondContact O-CB 3.47Å; K44-Q48 WeakPolarHBondContact O-CG 3.08Å; K44-Q48 PolarHBondContact O-N 2.76Å; Q48-K52 VanDerWaalsContact O-CB 3.28Å; Q48-K52 WeakPolarHBondContact O-CB 3.33Å; Q48-K52 PolarHBondContact O-N 3.33Å
49	Y	63.5	Low	61	Low	114 Å²	114	52 Å²	52	45%	0.447	26%	0.258	S	S	.	.	H	α-helix	trans	-63.9	-46.3	173.3	179.6	-103.4	0	0	0	110.9	N45 F46 H51 K52 T53 V85	N45-Y49 WeakPolarHBondContact O-CB 3.38Å; N45-Y49 PolarHBondContact O-N 2.96Å; F46-Y49 PolarHBondContact O-N 3.34Å; Y49-H51 PolarHBondContact O-N 2.86Å; Y49-K52 PolarHBondContact O-N 2.85Å; Y49-T53 PolarHBondContact O-N 3.24Å; Y49-T53 PolarHBondContact O-OG1 2.82Å; Y49-V85 HydrophobicContact CD1-CG2 4.49Å; Y49-V85 HydrophobicContact CE1-CG2 3.98Å
50	F	63.9	Low	61.5	Low	5 Å²	5	54.4 Å²	54.4	2%	0.022	27%	0.269	C	S	.	.	H	α-helix	trans	-62.8	-41.8	177.8	-170.4	-127.4	0	0	0	112.1	F46 L47 T53 I54 I82 V85 F119 L126 W173	F46-F50 VanDerWaalsContact O-CB 3.25Å; F46-F50 WeakPolarHBondContact O-CB 3.41Å; F46-F50 PolarHBondContact O-N 3.42Å; L47-F50 PolarHBondContact O-N 3.28Å; F50-T53 PolarHBondContact O-N 3.38Å; F50-I54 HydrophobicContact CD1-CD1 3.9Å; F50-I54 HydrophobicContact CD2-CD1 4.15Å; F50-I54 HydrophobicContact CE1-CD1 3.5Å; F50-I54 HydrophobicContact CE2-CD1 3.83Å; F50-I54 HydrophobicContact CE2-CG1 4.42Å; F50-I54 HydrophobicContact CG-CD1 4.2Å; F50-I54 HydrophobicContact CZ-CD1 3.49Å; F50-I54 VanDerWaalsContact CZ-CD1 3.49Å; F50-I54 WeakPolarHBondContact O-CB 3.23Å; F50-I54 WeakPolarHBondContact O-CG1 3.24Å; F50-I54 PolarHBondContact O-N 3.33Å; F50-I82 HydrophobicContact CE2-CG2 4.38Å; F50-V85 HydrophobicContact CD2-CG1 3.57Å; F50-V85 HydrophobicContact CE2-CG1 3.93Å; F50-V85 HydrophobicContact CG-CG1 4.41Å; F50-F119 HydrophobicContact CB-CE2 4.11Å; F50-F119 HydrophobicContact CB-CZ 4.41Å; F50-F119 HydrophobicContact CD1-CD2 4.27Å; F50-F119 AromaticContact CD1-CE2 3.22Å; F50-F119 HydrophobicContact CD1-CE2 3.22Å; F50-F119 AromaticContact CD1-CZ 3.64Å; F50-F119 HydrophobicContact CD1-CZ 3.64Å; F50-F119 AromaticContact CE1-CE2 3.89Å; F50-F119 HydrophobicContact CE1-CE2 3.89Å; F50-F119 HydrophobicContact CE1-CZ 4.44Å; F50-F119 AromaticContact CG-CE2 3.91Å; F50-F119 HydrophobicContact CG-CE2 3.91Å; F50-F119 HydrophobicContact CG-CZ 4.44Å; F50-L126 HydrophobicContact CE1-CD1 4Å; F50-L126 HydrophobicContact CZ-CD1 4.23Å; F50-W173 HydrophobicContact CE1-CH2 4.38Å; F50-W173 HydrophobicContact CE2-CZ3 4.47Å; F50-W173 AromaticContact CZ-CH2 3.65Å; F50-W173 HydrophobicContact CZ-CH2 3.65Å; F50-W173 AromaticContact CZ-CZ3 3.92Å; F50-W173 HydrophobicContact CZ-CZ3 3.92Å
51	H	64.3	Low	61.7	Low	38 Å²	38	52.8 Å²	52.8	18%	0.176	26%	0.257	C	S	.	.	H	α-helix	trans	-63.2	-44.7	174.7	173.5	-113.8	0	0	0	111.9	L47 Y49 T53 I54 S55 V113 D116 F119	L47-H51 VanDerWaalsContact O-CB 3.27Å; L47-H51 WeakPolarHBondContact O-CB 3.19Å; L47-H51 PolarHBondContact O-N 2.86Å; Y49-H51 PolarHBondContact O-N 2.86Å; H51-T53 VanDerWaalsContact C-N 3.34Å; H51-T53 PolarHBondContact O-N 2.77Å; H51-I54 PolarHBondContact O-N 2.9Å; H51-S55 PolarHBondContact NE2-OG 3.2Å; H51-S55 WeakPolarHBondContact O-CB 3.37Å; H51-S55 PolarHBondContact O-N 2.93Å; H51-S55 PolarHBondContact O-OG 3.12Å; H51-V113 HydrophobicContact CB-CG1 3.84Å; H51-V113 WeakPolarHBondContact CD2-CG1 3.45Å; H51-V113 PolarHBondContact CE1-O 3.26Å; H51-V113 VanDerWaalsContact CE1-O 3.27Å; H51-V113 WeakPolarHBondContact NE2-CG1 3.39Å; H51-V113 PolarHBondContact NE2-O 3.38Å; H51-D116 IonicContact NE2-OD2 3.7Å; H51-F119 HydrophobicContact CB-CD2 3.96Å; H51-F119 HydrophobicContact CB-CE1 4.38Å; H51-F119 HydrophobicContact CB-CE2 3.7Å; H51-F119 HydrophobicContact CB-CG 4.38Å; H51-F119 HydrophobicContact CB-CZ 3.92Å; H51-F119 AromaticContact CD2-CD2 3.98Å; H51-F119 AromaticContact CD2-CG 3.82Å; H51-F119 VanDerWaalsContact N-CE2 3.29Å
52	K	65	Low	61.9	Low	127 Å²	127	47.9 Å²	47.9	55%	0.552	24%	0.237	S	C	*	.	H	α-helix	trans	-62.2	-42.9	176.8	-173.6	175.9	-179.9	177.5	0	111.3	Q48 Y49 I54 S55 D56	Q48-K52 VanDerWaalsContact O-CB 3.28Å; Q48-K52 WeakPolarHBondContact O-CB 3.33Å; Q48-K52 PolarHBondContact O-N 3.33Å; Y49-K52 PolarHBondContact O-N 2.85Å; K52-I54 PolarHBondContact O-N 2.91Å; K52-S55 PolarHBondContact O-N 2.71Å; K52-D56 WeakPolarHBondContact O-CB 3.49Å; K52-D56 PolarHBondContact O-N 2.99Å
53	T	60.7	Low	61.9	Low	9 Å²	9	50.8 Å²	50.8	6%	0.055	24%	0.241	C	C	.	.	H	α-helix	trans	-65.8	-37.3	177.7	-53.3	0	0	0	0	112.2	Y49 F50 H51 L57 I82	Y49-T53 PolarHBondContact O-N 3.24Å; Y49-T53 PolarHBondContact O-OG1 2.82Å; F50-T53 PolarHBondContact O-N 3.38Å; H51-T53 VanDerWaalsContact C-N 3.34Å; H51-T53 PolarHBondContact O-N 2.77Å; T53-L57 VanDerWaalsContact O-CB 3.32Å; T53-L57 WeakPolarHBondContact O-CB 3.16Å; T53-L57 PolarHBondContact O-N 3.2Å; T53-L57 VanDerWaalsContact O-N 3.1Å; T53-I82 HydrophobicContact CG2-CD1 4.23Å; T53-I82 HydrophobicContact CG2-CG1 3.75Å
54	I	64.8	Low	61.8	Low	3 Å²	3	52.9 Å²	52.9	2%	0.015	25%	0.25	C	S	.	.	H	α-helix	trans	-70.7	-46.7	175.9	-73.2	171	0	0	0	111.1	F50 H51 K52 L57 I58 F119 L122	F50-I54 HydrophobicContact CD1-CD1 3.9Å; F50-I54 HydrophobicContact CD2-CD1 4.15Å; F50-I54 HydrophobicContact CE1-CD1 3.5Å; F50-I54 HydrophobicContact CE2-CD1 3.83Å; F50-I54 HydrophobicContact CE2-CG1 4.42Å; F50-I54 HydrophobicContact CG-CD1 4.2Å; F50-I54 HydrophobicContact CZ-CD1 3.49Å; F50-I54 VanDerWaalsContact CZ-CD1 3.49Å; F50-I54 WeakPolarHBondContact O-CB 3.23Å; F50-I54 WeakPolarHBondContact O-CG1 3.24Å; F50-I54 PolarHBondContact O-N 3.33Å; H51-I54 PolarHBondContact O-N 2.9Å; K52-I54 PolarHBondContact O-N 2.91Å; I54-L57 WeakPolarHBondContact O-CB 3.45Å; I54-L57 PolarHBondContact O-N 3.12Å; I54-L57 VanDerWaalsContact O-N 3.13Å; I54-I58 HydrophobicContact CG2-CD1 3.75Å; I54-I58 HydrophobicContact CG2-CG1 4.45Å; I54-I58 VanDerWaalsContact O-CG1 3.3Å; I54-I58 WeakPolarHBondContact O-CG1 3.34Å; I54-I58 PolarHBondContact O-N 3.17Å; I54-F119 HydrophobicContact CB-CD2 4.32Å; I54-F119 HydrophobicContact CD1-CD2 3.63Å; I54-F119 HydrophobicContact CD1-CE2 3.89Å; I54-L122 HydrophobicContact CD1-CD1 4.22Å
55	S	64	Low	61.6	Low	26 Å²	26	52.7 Å²	52.7	18%	0.182	25%	0.252	C	S	.	.	H	α-helix	trans	-60.5	-46.7	176.3	-64.8	0	0	0	0	111.1	H51 K52 L57 I58 D59	H51-S55 PolarHBondContact NE2-OG 3.2Å; H51-S55 WeakPolarHBondContact O-CB 3.37Å; H51-S55 PolarHBondContact O-N 2.93Å; H51-S55 PolarHBondContact O-OG 3.12Å; K52-S55 PolarHBondContact O-N 2.71Å; S55-L57 PolarHBondContact O-N 3.26Å; S55-I58 PolarHBondContact O-N 3.32Å; S55-D59 WeakPolarHBondContact O-CB 3.49Å; S55-D59 PolarHBondContact O-N 3.27Å
56	D	63.5	Low	61.3	Low	62 Å²	62	55.3 Å²	55.3	33%	0.332	26%	0.261	S	S	.	.	H	α-helix	trans	-67.1	-19.5	177.8	-70.6	-13.1	0	0	0	112.7	K52 Q60 K78	K52-D56 WeakPolarHBondContact O-CB 3.49Å; K52-D56 PolarHBondContact O-N 2.99Å; D56-Q60 WeakPolarHBondContact O-CB 3.41Å; D56-Q60 WeakPolarHBondContact O-CG 3.46Å; D56-Q60 PolarHBondContact O-N 3.03Å; D56-K78 PolarHBondContact O-NZ 3.39Å
57	L	60.5	Low	60.6	Low	5 Å²	5	56.3 Å²	56.3	3%	0.026	27%	0.271	C	S	.	.	H	α-helix	trans	-82.5	-43.4	172.6	-175	150	0	0	0	110.7	T53 I54 S55 Q60 K61 K78 I79 I82 E168	T53-L57 VanDerWaalsContact O-CB 3.32Å; T53-L57 WeakPolarHBondContact O-CB 3.16Å; T53-L57 PolarHBondContact O-N 3.2Å; T53-L57 VanDerWaalsContact O-N 3.1Å; I54-L57 WeakPolarHBondContact O-CB 3.45Å; I54-L57 PolarHBondContact O-N 3.12Å; I54-L57 VanDerWaalsContact O-N 3.13Å; S55-L57 PolarHBondContact O-N 3.26Å; L57-Q60 PolarHBondContact O-N 2.94Å; L57-K61 HydrophobicContact CD2-CG 4.26Å; L57-K61 WeakPolarHBondContact O-CB 3.04Å; L57-K61 PolarHBondContact O-N 3.22Å; L57-K78 HydrophobicContact CD1-CB 4.25Å; L57-I79 HydrophobicContact CD1-CG1 4.16Å; L57-I82 HydrophobicContact CD1-CD1 3.48Å; L57-I82 VanDerWaalsContact CD1-CD1 3.48Å; L57-E168 HydrophobicContact CD2-CB 4.44Å; L57-E168 WeakPolarHBondContact CD2-O 3.2Å
58	I	61.8	Low	60	Low	24 Å²	24	63.5 Å²	63.5	12%	0.123	31%	0.31	C	S	.	.	H	α-helix	trans	-60.6	-48	175.5	-67.9	166.8	0	0	0	109.6	I54 S55 Q60 K61 V62 V118 P166 L167	I54-I58 HydrophobicContact CG2-CD1 3.75Å; I54-I58 HydrophobicContact CG2-CG1 4.45Å; I54-I58 VanDerWaalsContact O-CG1 3.3Å; I54-I58 WeakPolarHBondContact O-CG1 3.34Å; I54-I58 PolarHBondContact O-N 3.17Å; S55-I58 PolarHBondContact O-N 3.32Å; I58-Q60 VanDerWaalsContact C-N 3.33Å; I58-Q60 PolarHBondContact O-N 3.44Å; I58-K61 PolarHBondContact O-N 3.04Å; I58-K61 VanDerWaalsContact O-N 3.15Å; I58-V62 HydrophobicContact CG2-CG2 4.34Å; I58-V62 VanDerWaalsContact O-CG2 3.29Å; I58-V62 WeakPolarHBondContact O-CG2 3.14Å; I58-V62 PolarHBondContact O-N 3.14Å; I58-V118 HydrophobicContact CD1-CB 4.49Å; I58-V118 HydrophobicContact CD1-CG1 4.29Å; I58-P166 HydrophobicContact CG2-CG 4.2Å; I58-L167 HydrophobicContact CG1-CD1 4.35Å
59	D	60.8	Low	59.2	Low	105 Å²	105	69.8 Å²	69.8	56%	0.561	33%	0.329	S	S	*	.	H	α-helix	trans	-61.7	-40.1	179.2	-73.7	-18.4	0	0	0	112.3	S55 Y63	S55-D59 WeakPolarHBondContact O-CB 3.49Å; S55-D59 PolarHBondContact O-N 3.27Å; D59-Y63 WeakPolarHBondContact O-CB 3.28Å; D59-Y63 PolarHBondContact O-N 2.99Å
60	Q	59.3	Low	58.3	Low	63 Å²	63	66 Å²	66	29%	0.294	32%	0.318	S	S	.	.	H	α-helix	trans	-69.1	-35	176	-77.8	-177.6	-7.8	0	0	112.7	D56 L57 I58 Y63 E64	D56-Q60 WeakPolarHBondContact O-CB 3.41Å; D56-Q60 WeakPolarHBondContact O-CG 3.46Å; D56-Q60 PolarHBondContact O-N 3.03Å; L57-Q60 PolarHBondContact O-N 2.94Å; I58-Q60 VanDerWaalsContact C-N 3.33Å; I58-Q60 PolarHBondContact O-N 3.44Å; Q60-Y63 PolarHBondContact O-N 3.49Å; Q60-E64 PolarHBondContact O-N 2.81Å
61	K	59.3	Low	57.4	Low	8 Å²	8	69 Å²	69	4%	0.035	34%	0.34	C	S	.	.	H	α-helix	trans	-72.3	-39	175.1	-83.1	-75.2	163.5	-172.3	0	112.6	L57 I58 Y63 E64 L65 I75 P166 E168	L57-K61 HydrophobicContact CD2-CG 4.26Å; L57-K61 WeakPolarHBondContact O-CB 3.04Å; L57-K61 PolarHBondContact O-N 3.22Å; I58-K61 PolarHBondContact O-N 3.04Å; I58-K61 VanDerWaalsContact O-N 3.15Å; K61-Y63 VanDerWaalsContact C-N 3.26Å; K61-Y63 PolarHBondContact O-N 3.01Å; K61-E64 WeakPolarHBondContact CD-OE2 3.41Å; K61-E64 WeakPolarHBondContact CE-OE2 3.49Å; K61-E64 IonicContact NZ-OE1 2.65Å; K61-E64 IonicContact NZ-OE2 3.85Å; K61-E64 PolarHBondContact NZ-OE2 2.89Å; K61-E64 PolarHBondContact O-N 2.81Å; K61-L65 WeakPolarHBondContact O-CB 3.43Å; K61-L65 VanDerWaalsContact O-CG 3.31Å; K61-L65 WeakPolarHBondContact O-CG 3.47Å; K61-L65 PolarHBondContact O-N 2.96Å; K61-I75 HydrophobicContact CD-CD1 4.26Å; K61-P166 HydrophobicContact CB-CB 3.99Å; K61-E168 HydrophobicContact CD-CG 4.06Å; K61-E168 WeakPolarHBondContact CE-OE1 3.37Å; K61-E168 WeakPolarHBondContact CE-OE2 3.18Å; K61-E168 IonicContact NZ-OE1 2.75Å; K61-E168 PolarHBondContact NZ-OE1 3.45Å; K61-E168 IonicContact NZ-OE2 3.13Å; K61-E168 PolarHBondContact NZ-OE2 2.88Å
62	V	59.3	Low	57	Low	48 Å²	48	70.7 Å²	70.7	29%	0.291	36%	0.355	S	S	.	.	H	α-helix	trans	-59.2	-42.3	170.5	172.5	0	0	0	0	110	I58 L65 Q66 P166	I58-V62 HydrophobicContact CG2-CG2 4.34Å; I58-V62 VanDerWaalsContact O-CG2 3.29Å; I58-V62 WeakPolarHBondContact O-CG2 3.14Å; I58-V62 PolarHBondContact O-N 3.14Å; V62-L65 PolarHBondContact O-N 3.44Å; V62-Q66 WeakPolarHBondContact O-CB 3.41Å; V62-Q66 VanDerWaalsContact O-CG 3.26Å; V62-Q66 WeakPolarHBondContact O-CG 3.42Å; V62-Q66 PolarHBondContact O-N 3.16Å; V62-P166 HydrophobicContact CG2-CB 3.54Å; V62-P166 HydrophobicContact CG2-CG 3.77Å
63	Y	56.7	Low	56.4	Low	144 Å²	144	71.2 Å²	71.2	57%	0.565	36%	0.36	S	S	*	.	H	α-helix	trans	-69.5	-32.8	177.1	-166.4	-94.1	0	0	0	113.5	D59 Q60 K61 S67 V70	D59-Y63 WeakPolarHBondContact O-CB 3.28Å; D59-Y63 PolarHBondContact O-N 2.99Å; Q60-Y63 PolarHBondContact O-N 3.49Å; K61-Y63 VanDerWaalsContact C-N 3.26Å; K61-Y63 PolarHBondContact O-N 3.01Å; Y63-S67 VanDerWaalsContact O-CB 3.32Å; Y63-S67 WeakPolarHBondContact O-CB 3.49Å; Y63-S67 PolarHBondContact O-N 2.83Å; Y63-S67 PolarHBondContact O-OG 3.06Å; Y63-V70 HydrophobicContact CD1-CG2 3.56Å; Y63-V70 HydrophobicContact CE1-CG2 4.22Å
64	E	56.8	Low	56	Low	44 Å²	44	72.9 Å²	72.9	21%	0.206	37%	0.372	C	S	.	.	H	α-helix	trans	-67.4	-46.8	172.3	-170.7	-174	-178.8	0	0	111.6	Q60 K61 Q66 S67 N68 V70 I75	Q60-E64 PolarHBondContact O-N 2.81Å; K61-E64 WeakPolarHBondContact CD-OE2 3.41Å; K61-E64 WeakPolarHBondContact CE-OE2 3.49Å; K61-E64 IonicContact NZ-OE1 2.65Å; K61-E64 IonicContact NZ-OE2 3.85Å; K61-E64 PolarHBondContact NZ-OE2 2.89Å; K61-E64 PolarHBondContact O-N 2.81Å; E64-Q66 PolarHBondContact O-N 3.06Å; E64-S67 PolarHBondContact O-N 3.09Å; E64-N68 PolarHBondContact O-N 3.41Å; E64-V70 HydrophobicContact CB-CB 4.05Å; E64-V70 HydrophobicContact CB-CG2 3.99Å; E64-V70 HydrophobicContact CG-CB 4.13Å; E64-V70 HydrophobicContact CG-CG2 4.49Å; E64-I75 WeakPolarHBondContact OE2-CD1 3.07Å
65	L	56.5	Low	55.8	Low	67 Å²	67	72.9 Å²	72.9	35%	0.351	37%	0.372	S	S	.	.	H	α-helix	trans	-59.9	-31	175.8	-74.2	167.1	0	0	0	112.3	K61 V62 P164 P166 H254	K61-L65 WeakPolarHBondContact O-CB 3.43Å; K61-L65 VanDerWaalsContact O-CG 3.31Å; K61-L65 WeakPolarHBondContact O-CG 3.47Å; K61-L65 PolarHBondContact O-N 2.96Å; V62-L65 PolarHBondContact O-N 3.44Å; L65-P164 HydrophobicContact CD2-CB 4.05Å; L65-P164 HydrophobicContact CD2-CG 4.09Å; L65-P166 HydrophobicContact CD1-CB 3.95Å; L65-H254 VanDerWaalsContact CD2-CE1 3.44Å; L65-H254 WeakPolarHBondContact CD2-CE1 3.46Å
66	Q	55.2	Low	55.5	Low	153 Å²	153	77.3 Å²	77.3	72%	0.715	39%	0.39	S	S	*	.	H	α-helix	trans	-88.2	-26.8	179	-71.4	176.4	-0.5	0	0	114.4	V62 E64	V62-Q66 WeakPolarHBondContact O-CB 3.41Å; V62-Q66 VanDerWaalsContact O-CG 3.26Å; V62-Q66 WeakPolarHBondContact O-CG 3.42Å; V62-Q66 PolarHBondContact O-N 3.16Å; E64-Q66 PolarHBondContact O-N 3.06Å
67	S	48.7	Very low	55.2	Low	42 Å²	42	80.7 Å²	80.7	29%	0.294	40%	0.404	S	S	.	.	H	α-helix	trans	-119.2	-8.4	-171.1	77	0	0	0	0	116.3	Y63 E64 R69	Y63-S67 VanDerWaalsContact O-CB 3.32Å; Y63-S67 WeakPolarHBondContact O-CB 3.49Å; Y63-S67 PolarHBondContact O-N 2.83Å; Y63-S67 PolarHBondContact O-OG 3.06Å; E64-S67 PolarHBondContact O-N 3.09Å; S67-R69 PolarHBondContact O-N 3.38Å
68	N	52.4	Low	55.2	Low	154 Å²	154	82.1 Å²	82.1	82%	0.824	41%	0.41	S	S	*	.	S	Bend	trans	50.6	18.1	-175.7	-91.5	-13.1	0	0	0	114.3	E64	E64-N68 PolarHBondContact O-N 3.41Å
69	R	46.7	Very low	55.2	Low	224 Å²	224	82.4 Å²	82.4	85%	0.845	41%	0.411	S	S	*	.			trans	-143.5	53.5	-172.6	-74.5	-170.3	174.6	-179.1	-0	112.7	S67	S67-R69 PolarHBondContact O-N 3.38Å
70	V	43.8	Very low	55.2	Low	34 Å²	34	85 Å²	85	21%	0.206	41%	0.414	C	S	.	.			trans	-113.6	128.9	160.1	-173.8	0	0	0	0	107.9	Y63 E64 S72 I75	Y63-V70 HydrophobicContact CD1-CG2 3.56Å; Y63-V70 HydrophobicContact CE1-CG2 4.22Å; E64-V70 HydrophobicContact CB-CB 4.05Å; E64-V70 HydrophobicContact CB-CG2 3.99Å; E64-V70 HydrophobicContact CG-CB 4.13Å; E64-V70 HydrophobicContact CG-CG2 4.49Å; V70-S72 PolarHBondContact O-N 3.26Å; V70-I75 HydrophobicContact CG1-CD1 4.3Å
71	S	45.8	Very low	55.3	Low	70 Å²	70	86.1 Å²	86.1	49%	0.49	42%	0.42	S	S	.	.			trans	-59.7	118.2	175.6	42	0	0	0	0	109.9	E73 S74	S71-E73 PolarHBondContact O-N 3.08Å; S71-S74 PolarHBondContact O-N 2.84Å; S71-S74 PolarHBondContact OG-OG 2.86Å
72	S	54.2	Low	55.5	Low	72 Å²	72	85.8 Å²	85.8	50%	0.503	42%	0.418	S	S	.	.	H	α-helix	trans	-46.7	-28.5	174.9	46.4	0	0	0	0	113.6	V70 S74 I75 E76	V70-S72 PolarHBondContact O-N 3.26Å; S72-S74 PolarHBondContact O-N 3.4Å; S72-I75 PolarHBondContact O-N 3.38Å; S72-E76 WeakPolarHBondContact O-CG 3.33Å; S72-E76 PolarHBondContact O-N 2.91Å
73	E	52.5	Low	55.5	Low	138 Å²	138	85.6 Å²	85.6	65%	0.645	41%	0.414	S	S	*	.	H	α-helix	trans	-61.9	-36.4	178.3	-64.2	-179.2	168.2	0	0	114.5	S71 I75 E76 Q77	S71-E73 PolarHBondContact O-N 3.08Å; E73-I75 VanDerWaalsContact C-N 3.33Å; E73-E76 PolarHBondContact O-N 2.91Å; E73-Q77 PolarHBondContact O-N 3.38Å
74	S	54.2	Low	55.8	Low	44 Å²	44	82 Å²	82	31%	0.308	41%	0.405	S	S	.	.	H	α-helix	trans	-72.1	-31.9	-179.3	-55	0	0	0	0	112	S71 S72 K78	S71-S74 PolarHBondContact O-N 2.84Å; S71-S74 PolarHBondContact OG-OG 2.86Å; S72-S74 PolarHBondContact O-N 3.4Å; S74-K78 PolarHBondContact O-N 3.21Å
75	I	58.9	Low	56	Low	3 Å²	3	80.4 Å²	80.4	2%	0.015	40%	0.398	C	S	.	.	H	α-helix	trans	-75.1	-42.6	176.4	-64.7	164.5	0	0	0	109.2	K61 E64 V70 S72 E73 Q77 K78 I79 E168	K61-I75 HydrophobicContact CD-CD1 4.26Å; E64-I75 WeakPolarHBondContact OE2-CD1 3.07Å; V70-I75 HydrophobicContact CG1-CD1 4.3Å; S72-I75 PolarHBondContact O-N 3.38Å; E73-I75 VanDerWaalsContact C-N 3.33Å; I75-Q77 VanDerWaalsContact C-N 3.33Å; I75-Q77 PolarHBondContact O-N 3.18Å; I75-K78 PolarHBondContact O-N 3.34Å; I75-I79 HydrophobicContact CG2-CD1 3.82Å; I75-I79 HydrophobicContact CG2-CG1 4.41Å; I75-I79 WeakPolarHBondContact O-CB 3.5Å; I75-I79 VanDerWaalsContact O-CG1 3.23Å; I75-I79 WeakPolarHBondContact O-CG1 3.31Å; I75-I79 PolarHBondContact O-N 3.46Å; I75-E168 VanDerWaalsContact CG2-OE2 3.25Å; I75-E168 WeakPolarHBondContact CG2-OE2 3.24Å
76	E	57.9	Low	56.2	Low	120 Å²	120	77.9 Å²	77.9	56%	0.561	38%	0.383	S	S	*	.	H	α-helix	trans	-60.5	-39.4	174.2	-74.6	-179.1	176.1	0	0	112.7	S72 E73 I79 Y80	S72-E76 WeakPolarHBondContact O-CG 3.33Å; S72-E76 PolarHBondContact O-N 2.91Å; E73-E76 PolarHBondContact O-N 2.91Å; E76-I79 PolarHBondContact O-N 3.3Å; E76-Y80 WeakPolarHBondContact O-CB 3.49Å; E76-Y80 PolarHBondContact O-N 3.19Å
77	Q	57.3	Low	56.5	Low	133 Å²	133	73.1 Å²	73.1	62%	0.621	36%	0.361	S	S	*	.	H	α-helix	trans	-61.9	-44.4	173.6	-85.1	-178	-20.1	0	0	112.3	E73 I75 Y80 E81	E73-Q77 PolarHBondContact O-N 3.38Å; I75-Q77 VanDerWaalsContact C-N 3.33Å; I75-Q77 PolarHBondContact O-N 3.18Å; Q77-Y80 WeakPolarHBondContact O-CB 3.18Å; Q77-Y80 PolarHBondContact O-N 3.45Å; Q77-E81 WeakPolarHBondContact O-CG 3.12Å; Q77-E81 PolarHBondContact O-N 3.35Å
78	K	61.1	Low	57.1	Low	34 Å²	34	74.4 Å²	74.4	15%	0.148	37%	0.365	C	S	.	.	H	α-helix	trans	-69.4	-34.8	177.2	-72.7	-173.7	177	-172.6	0	113	D56 L57 S74 I75 Y80 E81 I82	D56-K78 PolarHBondContact O-NZ 3.39Å; L57-K78 HydrophobicContact CD1-CB 4.25Å; S74-K78 PolarHBondContact O-N 3.21Å; I75-K78 PolarHBondContact O-N 3.34Å; K78-Y80 VanDerWaalsContact C-N 3.27Å; K78-Y80 PolarHBondContact O-N 2.75Å; K78-E81 PolarHBondContact O-N 2.99Å; K78-I82 VanDerWaalsContact O-CG1 3.29Å; K78-I82 WeakPolarHBondContact O-CG1 3.24Å; K78-I82 PolarHBondContact O-N 2.84Å
79	I	60.8	Low	57.3	Low	31 Å²	31	68.9 Å²	68.9	16%	0.159	34%	0.338	C	S	.	.	H	α-helix	trans	-61.4	-39.9	171	-70.6	168.3	0	0	0	110	L57 I75 E76 I82 Q83 E168 P170	L57-I79 HydrophobicContact CD1-CG1 4.16Å; I75-I79 HydrophobicContact CG2-CD1 3.82Å; I75-I79 HydrophobicContact CG2-CG1 4.41Å; I75-I79 WeakPolarHBondContact O-CB 3.5Å; I75-I79 VanDerWaalsContact O-CG1 3.23Å; I75-I79 WeakPolarHBondContact O-CG1 3.31Å; I75-I79 PolarHBondContact O-N 3.46Å; E76-I79 PolarHBondContact O-N 3.3Å; I79-I82 PolarHBondContact O-N 3.48Å; I79-Q83 WeakPolarHBondContact O-CB 3.38Å; I79-Q83 PolarHBondContact O-N 3.12Å; I79-E168 HydrophobicContact CD1-CB 4.08Å; I79-P170 HydrophobicContact CG2-CB 3.99Å; I79-P170 HydrophobicContact CG2-CG 3.88Å
80	Y	60.7	Low	58.1	Low	160 Å²	160	59 Å²	59	63%	0.627	30%	0.301	S	S	*	.	H	α-helix	trans	-67.5	-39.1	175.4	-171.1	-92.9	0	0	0	112.3	E76 Q77 K78 Q83 D84	E76-Y80 WeakPolarHBondContact O-CB 3.49Å; E76-Y80 PolarHBondContact O-N 3.19Å; Q77-Y80 WeakPolarHBondContact O-CB 3.18Å; Q77-Y80 PolarHBondContact O-N 3.45Å; K78-Y80 VanDerWaalsContact C-N 3.27Å; K78-Y80 PolarHBondContact O-N 2.75Å; Y80-Q83 PolarHBondContact O-N 2.87Å; Y80-D84 PolarHBondContact O-N 2.84Å
81	E	61.6	Low	59	Low	86 Å²	86	60.3 Å²	60.3	40%	0.402	31%	0.307	S	S	.	.	H	α-helix	trans	-62.9	-44.2	172.6	-72.2	179.3	-178	0	0	111.8	Q77 K78 Q83 D84 V85	Q77-E81 WeakPolarHBondContact O-CG 3.12Å; Q77-E81 PolarHBondContact O-N 3.35Å; K78-E81 PolarHBondContact O-N 2.99Å; E81-Q83 VanDerWaalsContact C-N 3.3Å; E81-Q83 PolarHBondContact O-N 3.36Å; E81-D84 PolarHBondContact O-N 3.38Å; E81-V85 WeakPolarHBondContact O-CB 3.48Å; E81-V85 VanDerWaalsContact O-CG2 3.23Å; E81-V85 WeakPolarHBondContact O-CG2 3.38Å; E81-V85 PolarHBondContact O-N 3.37Å
82	I	64.6	Low	59.8	Low	1 Å²	1	62.9 Å²	62.9	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-62.1	-40.1	174.2	-69.3	168.3	0	0	0	110.6	F50 T53 L57 K78 I79 V85 Y86 P170 W173	F50-I82 HydrophobicContact CE2-CG2 4.38Å; T53-I82 HydrophobicContact CG2-CD1 4.23Å; T53-I82 HydrophobicContact CG2-CG1 3.75Å; L57-I82 HydrophobicContact CD1-CD1 3.48Å; L57-I82 VanDerWaalsContact CD1-CD1 3.48Å; K78-I82 VanDerWaalsContact O-CG1 3.29Å; K78-I82 WeakPolarHBondContact O-CG1 3.24Å; K78-I82 PolarHBondContact O-N 2.84Å; I79-I82 PolarHBondContact O-N 3.48Å; I82-V85 PolarHBondContact O-N 3.06Å; I82-Y86 WeakPolarHBondContact O-CB 3.47Å; I82-Y86 PolarHBondContact O-N 3.32Å; I82-P170 HydrophobicContact CB-CG 4.23Å; I82-P170 HydrophobicContact CG2-CG 3.8Å; I82-W173 HydrophobicContact CG2-CE3 3.96Å; I82-W173 HydrophobicContact CG2-CZ3 3.83Å
83	Q	60	Low	60.1	Low	43 Å²	43	60.3 Å²	60.3	20%	0.201	29%	0.29	C	S	.	.	H	α-helix	trans	-63.7	-42.3	175.7	-172.2	-177.6	-24.9	0	0	111.7	I79 Y80 E81 Y86 E87 P170 Q172	I79-Q83 WeakPolarHBondContact O-CB 3.38Å; I79-Q83 PolarHBondContact O-N 3.12Å; Y80-Q83 PolarHBondContact O-N 2.87Å; E81-Q83 VanDerWaalsContact C-N 3.3Å; E81-Q83 PolarHBondContact O-N 3.36Å; Q83-Y86 PolarHBondContact O-N 2.94Å; Q83-E87 HydrophobicContact CG-CG 4.13Å; Q83-E87 PolarHBondContact NE2-OE2 3.45Å; Q83-E87 WeakPolarHBondContact O-CB 3.02Å; Q83-E87 WeakPolarHBondContact O-CG 3.31Å; Q83-E87 PolarHBondContact O-N 3.28Å; Q83-P170 HydrophobicContact CB-CB 4.27Å; Q83-P170 HydrophobicContact CB-CG 4.18Å; Q83-Q172 VanDerWaalsContact NE2-CD 3.29Å; Q83-Q172 VanDerWaalsContact NE2-NE2 3.11Å
84	D	61.7	Low	60.4	Low	70 Å²	70	53.8 Å²	53.8	37%	0.374	26%	0.259	S	S	.	.	H	α-helix	trans	-67.3	-39.3	176.2	-170.4	60.1	0	0	0	112	Y80 E81 Y86 N88 S89	Y80-D84 PolarHBondContact O-N 2.84Å; E81-D84 PolarHBondContact O-N 3.38Å; D84-Y86 VanDerWaalsContact C-N 3.31Å; D84-Y86 PolarHBondContact O-N 2.79Å; D84-N88 WeakPolarHBondContact O-CA 3.21Å; D84-N88 WeakPolarHBondContact O-CB 3.44Å; D84-N88 PolarHBondContact O-N 2.79Å; D84-N88 PolarHBondContact OD1-ND2 2.76Å; D84-S89 PolarHBondContact O-N 2.91Å; D84-S89 VanDerWaalsContact O-N 3.17Å
85	V	61.8	Low	60.6	Low	9 Å²	9	55.5 Å²	55.5	6%	0.055	27%	0.265	C	S	.	.	I	π-helix	trans	-61.1	-42.3	173.4	167.5	0	0	0	0	111	F46 Y49 F50 E81 I82 S89 W90	F46-V85 HydrophobicContact CE2-CG1 3.6Å; F46-V85 HydrophobicContact CZ-CG1 3.51Å; Y49-V85 HydrophobicContact CD1-CG2 4.49Å; Y49-V85 HydrophobicContact CE1-CG2 3.98Å; F50-V85 HydrophobicContact CD2-CG1 3.57Å; F50-V85 HydrophobicContact CE2-CG1 3.93Å; F50-V85 HydrophobicContact CG-CG1 4.41Å; E81-V85 WeakPolarHBondContact O-CB 3.48Å; E81-V85 VanDerWaalsContact O-CG2 3.23Å; E81-V85 WeakPolarHBondContact O-CG2 3.38Å; E81-V85 PolarHBondContact O-N 3.37Å; I82-V85 PolarHBondContact O-N 3.06Å; V85-S89 WeakPolarHBondContact O-CB 2.89Å; V85-S89 PolarHBondContact O-N 3.2Å; V85-W90 PolarHBondContact O-N 3.01Å
86	Y	59.9	Low	60.6	Low	14 Å²	14	64.7 Å²	64.7	6%	0.055	30%	0.299	C	S	.	.	I	π-helix	trans	-73.4	-48.1	180	-174.5	-98.2	0	0	0	113.6	I82 Q83 D84 W90 L126 R129 W173 D176	I82-Y86 WeakPolarHBondContact O-CB 3.47Å; I82-Y86 PolarHBondContact O-N 3.32Å; Q83-Y86 PolarHBondContact O-N 2.94Å; D84-Y86 VanDerWaalsContact C-N 3.31Å; D84-Y86 PolarHBondContact O-N 2.79Å; Y86-W90 WeakPolarHBondContact O-CB 3.41Å; Y86-L126 HydrophobicContact CD2-CD2 3.87Å; Y86-L126 HydrophobicContact CE2-CD2 3.4Å; Y86-L126 VanDerWaalsContact CE2-CD2 3.4Å; Y86-R129 PolarHBondContact OH-NH1 3.03Å; Y86-W173 AromaticContact CD2-CD2 3.97Å; Y86-W173 HydrophobicContact CD2-CD2 3.97Å; Y86-W173 HydrophobicContact CD2-CE3 4.27Å; Y86-W173 HydrophobicContact CD2-CG 4.21Å; Y86-W173 HydrophobicContact CE1-CB 4.44Å; Y86-W173 HydrophobicContact CE1-CG 4.45Å; Y86-W173 HydrophobicContact CE2-CB 4.41Å; Y86-W173 AromaticContact CE2-CD1 3.53Å; Y86-W173 AromaticContact CE2-CD2 3.68Å; Y86-W173 HydrophobicContact CE2-CD2 3.68Å; Y86-W173 AromaticContact CE2-CE2 3.66Å; Y86-W173 HydrophobicContact CE2-CE3 4.44Å; Y86-W173 AromaticContact CE2-CG 3.63Å; Y86-W173 HydrophobicContact CE2-CG 3.63Å; Y86-W173 HydrophobicContact CE2-CZ2 4.39Å; Y86-W173 AromaticContact CE2-NE1 3.57Å; Y86-W173 AromaticContact CZ-CD1 3.55Å; Y86-W173 AromaticContact CZ-CG 3.75Å; Y86-D176 WeakPolarHBondContact CE1-OD2 3.1Å; Y86-D176 WeakPolarHBondContact OH-CB 3.48Å; Y86-D176 PolarHBondContact OH-OD2 2.77Å
87	E	61.3	Low	60.4	Low	54 Å²	54	63.4 Å²	63.4	25%	0.252	29%	0.292	S	S	.	.	I	π-helix	trans	-81.1	-37.6	-174.4	-67.8	-163.6	113.6	0	0	112.4	Q83 N91 Q172	Q83-E87 HydrophobicContact CG-CG 4.13Å; Q83-E87 PolarHBondContact NE2-OE2 3.45Å; Q83-E87 WeakPolarHBondContact O-CB 3.02Å; Q83-E87 WeakPolarHBondContact O-CG 3.31Å; Q83-E87 PolarHBondContact O-N 3.28Å; E87-N91 PolarHBondContact O-ND2 2.97Å; E87-Q172 PolarHBondContact OE1-OE1 3.4Å; E87-Q172 PolarHBondContact OE2-OE1 2.73Å
88	N	61.1	Low	60.4	Low	68 Å²	68	57.4 Å²	57.4	36%	0.364	26%	0.264	S	S	.	.	I	π-helix	trans	-107.6	-50.4	-171.7	-68	-42.8	0	0	0	112.4	D84 K92	D84-N88 WeakPolarHBondContact O-CA 3.21Å; D84-N88 WeakPolarHBondContact O-CB 3.44Å; D84-N88 PolarHBondContact O-N 2.79Å; D84-N88 PolarHBondContact OD1-ND2 2.76Å; N88-K92 VanDerWaalsContact O-CB 3.27Å; N88-K92 WeakPolarHBondContact O-CB 2.81Å; N88-K92 VanDerWaalsContact O-CD 3.31Å; N88-K92 WeakPolarHBondContact O-CD 3.48Å; N88-K92 WeakPolarHBondContact O-CG 3.28Å; N88-K92 PolarHBondContact O-N 2.89Å; N88-K92 VanDerWaalsContact O-N 3.08Å
89	S	58.6	Low	60	Low	38 Å²	38	62.5 Å²	62.5	27%	0.266	29%	0.286	S	S	.	.	I	π-helix	trans	-74.9	-43.6	-172.5	-61.6	0	0	0	0	112.3	D84 V85 K92 L93	D84-S89 PolarHBondContact O-N 2.91Å; D84-S89 VanDerWaalsContact O-N 3.17Å; V85-S89 WeakPolarHBondContact O-CB 2.89Å; V85-S89 PolarHBondContact O-N 3.2Å; S89-K92 PolarHBondContact O-N 3.32Å; S89-L93 WeakPolarHBondContact O-CB 3.49Å; S89-L93 VanDerWaalsContact O-CG 3.28Å; S89-L93 WeakPolarHBondContact O-CG 3.39Å; S89-L93 PolarHBondContact O-N 3.32Å
90	W	62.7	Low	59.3	Low	18 Å²	18	66.5 Å²	66.5	7%	0.068	31%	0.313	C	S	.	.	H	α-helix	trans	-61.8	-47.3	176.1	-176.6	-96.9	0	0	0	112.2	F46 V85 Y86 K92 L93 T94 W103 Y123 L126	F46-W90 AromaticContact CE1-CE3 3.71Å; F46-W90 HydrophobicContact CE1-CE3 3.71Å; F46-W90 HydrophobicContact CE1-CZ3 4.13Å; F46-W90 HydrophobicContact CZ-CE3 4.17Å; V85-W90 PolarHBondContact O-N 3.01Å; Y86-W90 WeakPolarHBondContact O-CB 3.41Å; W90-K92 PolarHBondContact O-N 3.17Å; W90-L93 PolarHBondContact O-N 3.28Å; W90-T94 WeakPolarHBondContact O-CB 3.4Å; W90-T94 PolarHBondContact O-N 2.91Å; W90-T94 PolarHBondContact O-OG1 3.24Å; W90-W103 HydrophobicContact CD2-CH2 4.22Å; W90-W103 AromaticContact CD2-CZ2 3.95Å; W90-W103 HydrophobicContact CD2-CZ2 3.95Å; W90-W103 AromaticContact CE2-CZ2 3.97Å; W90-W103 AromaticContact CE3-CH2 3.54Å; W90-W103 HydrophobicContact CE3-CH2 3.54Å; W90-W103 AromaticContact CE3-CZ2 3.74Å; W90-W103 HydrophobicContact CE3-CZ2 3.74Å; W90-W103 HydrophobicContact CE3-CZ3 4.12Å; W90-W103 AromaticContact CH2-CD2 3.52Å; W90-W103 HydrophobicContact CH2-CD2 3.52Å; W90-W103 AromaticContact CH2-CE2 3.54Å; W90-W103 AromaticContact CH2-CE3 3.52Å; W90-W103 HydrophobicContact CH2-CE3 3.52Å; W90-W103 HydrophobicContact CH2-CG 4.26Å; W90-W103 AromaticContact CH2-CH2 3.65Å; W90-W103 HydrophobicContact CH2-CH2 3.65Å; W90-W103 AromaticContact CH2-CZ2 3.63Å; W90-W103 HydrophobicContact CH2-CZ2 3.63Å; W90-W103 AromaticContact CH2-CZ3 3.58Å; W90-W103 HydrophobicContact CH2-CZ3 3.58Å; W90-W103 AromaticContact CZ2-CD2 3.92Å; W90-W103 HydrophobicContact CZ2-CD2 3.92Å; W90-W103 AromaticContact CZ2-CE2 3.6Å; W90-W103 HydrophobicContact CZ2-CE3 4.37Å; W90-W103 HydrophobicContact CZ2-CG 4.37Å; W90-W103 HydrophobicContact CZ2-CH2 4.3Å; W90-W103 AromaticContact CZ2-CZ2 3.82Å; W90-W103 HydrophobicContact CZ2-CZ2 3.82Å; W90-W103 AromaticContact CZ2-NE1 3.82Å; W90-W103 HydrophobicContact CZ3-CD2 4.15Å; W90-W103 AromaticContact CZ3-CE3 3.8Å; W90-W103 HydrophobicContact CZ3-CE3 3.8Å; W90-W103 AromaticContact CZ3-CH2 3.22Å; W90-W103 HydrophobicContact CZ3-CH2 3.22Å; W90-W103 AromaticContact CZ3-CZ2 3.59Å; W90-W103 HydrophobicContact CZ3-CZ2 3.59Å; W90-W103 AromaticContact CZ3-CZ3 3.32Å; W90-W103 HydrophobicContact CZ3-CZ3 3.32Å; W90-Y123 HydrophobicContact CH2-CE2 4.02Å; W90-Y123 HydrophobicContact CZ3-CE2 4.33Å; W90-L126 HydrophobicContact CE3-CD1 4.38Å; W90-L126 HydrophobicContact CH2-CB 4Å; W90-L126 HydrophobicContact CH2-CD1 4.42Å; W90-L126 HydrophobicContact CZ2-CB 3.81Å; W90-L126 HydrophobicContact CZ3-CD1 4.27Å
91	N	62.8	Low	58.7	Low	61 Å²	61	60.8 Å²	60.8	33%	0.326	30%	0.296	S	S	.	.	H	α-helix	trans	-63.7	-41.7	178.5	-77.3	-39.7	0	0	0	112	E87 T94 D95	E87-N91 PolarHBondContact O-ND2 2.97Å; N91-T94 PolarHBondContact O-N 2.74Å; N91-D95 WeakPolarHBondContact O-CB 3.34Å; N91-D95 PolarHBondContact O-N 2.8Å
92	K	61.7	Low	58.5	Low	123 Å²	123	59.4 Å²	59.4	54%	0.535	29%	0.294	S	S	.	.	H	α-helix	trans	-64.5	-40.1	175.9	-75.2	170.2	-171.3	170.9	0	112.7	N88 S89 W90 R96	N88-K92 VanDerWaalsContact O-CB 3.27Å; N88-K92 WeakPolarHBondContact O-CB 2.81Å; N88-K92 VanDerWaalsContact O-CD 3.31Å; N88-K92 WeakPolarHBondContact O-CD 3.48Å; N88-K92 WeakPolarHBondContact O-CG 3.28Å; N88-K92 PolarHBondContact O-N 2.89Å; N88-K92 VanDerWaalsContact O-N 3.08Å; S89-K92 PolarHBondContact O-N 3.32Å; W90-K92 PolarHBondContact O-N 3.17Å; K92-R96 VanDerWaalsContact O-CB 3.31Å; K92-R96 WeakPolarHBondContact O-CB 3.33Å; K92-R96 WeakPolarHBondContact O-CG 3.43Å; K92-R96 PolarHBondContact O-N 3.21Å; K92-R96 VanDerWaalsContact O-N 3.08Å
93	L	60.4	Low	58.3	Low	19 Å²	19	59.5 Å²	59.5	10%	0.099	30%	0.295	C	S	.	.	H	α-helix	trans	-70.6	-41.9	177.7	-72.3	172.5	0	0	0	111.3	V42 F46 S89 W90 R96 F97 W103	V42-L93 HydrophobicContact CG1-CD2 3.92Å; F46-L93 HydrophobicContact CB-CD1 3.95Å; F46-L93 HydrophobicContact CD1-CD1 3.85Å; F46-L93 HydrophobicContact CD2-CD1 3.54Å; F46-L93 HydrophobicContact CE1-CD1 4.24Å; F46-L93 HydrophobicContact CE2-CD1 3.92Å; F46-L93 HydrophobicContact CG-CD1 3.47Å; F46-L93 VanDerWaalsContact CG-CD1 3.47Å; F46-L93 HydrophobicContact CZ-CD1 4.26Å; S89-L93 WeakPolarHBondContact O-CB 3.49Å; S89-L93 VanDerWaalsContact O-CG 3.28Å; S89-L93 WeakPolarHBondContact O-CG 3.39Å; S89-L93 PolarHBondContact O-N 3.32Å; W90-L93 PolarHBondContact O-N 3.28Å; L93-R96 PolarHBondContact O-N 3.48Å; L93-F97 HydrophobicContact CD2-CD2 4.21Å; L93-F97 HydrophobicContact CD2-CE2 4.1Å; L93-F97 PolarHBondContact O-N 3.4Å; L93-W103 HydrophobicContact CB-CH2 4.37Å; L93-W103 HydrophobicContact CB-CZ2 4.27Å
94	T	58.7	Low	58.2	Low	1 Å²	1	58 Å²	58	1%	0.006	29%	0.288	C	S	.	.	H	α-helix	trans	-61.9	-44.7	176	-59.5	0	0	0	0	111.4	W90 N91 R96 F98 K99 W103 H130 K134	W90-T94 WeakPolarHBondContact O-CB 3.4Å; W90-T94 PolarHBondContact O-N 2.91Å; W90-T94 PolarHBondContact O-OG1 3.24Å; N91-T94 PolarHBondContact O-N 2.74Å; T94-R96 VanDerWaalsContact C-N 3.28Å; T94-R96 PolarHBondContact O-N 3.39Å; T94-F98 CarbonylContact O-C 3.57Å; T94-F98 WeakPolarHBondContact O-CA 3.31Å; T94-F98 PolarHBondContact O-N 2.7Å; T94-K99 PolarHBondContact O-N 3.09Å; T94-W103 PolarHBondContact OG1-NE1 3.34Å; T94-H130 WeakPolarHBondContact CG2-CE1 3.32Å; T94-H130 WeakPolarHBondContact CG2-ND1 3.31Å; T94-K134 HydrophobicContact CG2-CD 3.81Å
95	D	60	Low	57.9	Low	80 Å²	80	61 Å²	61	43%	0.428	30%	0.3	S	S	.	.	H	α-helix	trans	-71.9	-20.4	177.1	-74	-17.7	0	0	0	113.2	N91 K99 K134	N91-D95 WeakPolarHBondContact O-CB 3.34Å; N91-D95 PolarHBondContact O-N 2.8Å; D95-K99 WeakPolarHBondContact O-CE 3.41Å; D95-K99 VanDerWaalsContact O-CG 3.31Å; D95-K99 WeakPolarHBondContact O-CG 3.23Å; D95-K134 IonicContact OD1-NZ 3.9Å; D95-K134 PolarHBondContact OD1-NZ 2.95Å
96	R	58.6	Low	57.7	Low	195 Å²	195	61.3 Å²	61.3	74%	0.736	30%	0.303	S	S	*	.	H	α-helix	trans	-89.1	-39.8	178.1	-78.2	179.3	-175.9	-164.4	2	113.5	K92 L93 T94	K92-R96 VanDerWaalsContact O-CB 3.31Å; K92-R96 WeakPolarHBondContact O-CB 3.33Å; K92-R96 WeakPolarHBondContact O-CG 3.43Å; K92-R96 PolarHBondContact O-N 3.21Å; K92-R96 VanDerWaalsContact O-N 3.08Å; L93-R96 PolarHBondContact O-N 3.48Å; T94-R96 VanDerWaalsContact C-N 3.28Å; T94-R96 PolarHBondContact O-N 3.39Å
97	F	54	Low	57.5	Low	93 Å²	93	68.1 Å²	68.1	41%	0.408	34%	0.336	S	S	.	.	H	α-helix	trans	-115.9	-25.3	-169.4	-65.9	-78.3	0	0	0	114.3	P40 I43 L93	P40-F97 HydrophobicContact CG-CD1 4.31Å; P40-F97 HydrophobicContact CG-CE1 4.46Å; I43-F97 HydrophobicContact CD1-CB 4.22Å; I43-F97 HydrophobicContact CD1-CD2 4.31Å; I43-F97 HydrophobicContact CD1-CG 4.21Å; L93-F97 HydrophobicContact CD2-CD2 4.21Å; L93-F97 HydrophobicContact CD2-CE2 4.1Å; L93-F97 PolarHBondContact O-N 3.4Å
98	F	56.4	Low	57.1	Low	7 Å²	7	67.5 Å²	67.5	3%	0.031	34%	0.344	C	S	.	.			trans	-132.1	48.6	-169.1	-61.6	-72.4	0	0	0	112.6	I43 T94 T100 S101 P102 W103 P104 H130	I43-F98 HydrophobicContact CD1-CD2 4.41Å; I43-F98 HydrophobicContact CD1-CE2 3.37Å; I43-F98 HydrophobicContact CD1-CZ 3.83Å; I43-F98 HydrophobicContact CG1-CE2 4.36Å; T94-F98 CarbonylContact O-C 3.57Å; T94-F98 WeakPolarHBondContact O-CA 3.31Å; T94-F98 PolarHBondContact O-N 2.7Å; F98-T100 VanDerWaalsContact C-N 3.3Å; F98-T100 PolarHBondContact O-N 3.41Å; F98-S101 WeakPolarHBondContact CD1-OG 3.47Å; F98-P102 WeakPolarHBondContact CD1-O 3.45Å; F98-W103 AromaticContact CD2-CD1 3.76Å; F98-W103 AromaticContact CD2-CD2 3.91Å; F98-W103 HydrophobicContact CD2-CD2 3.91Å; F98-W103 AromaticContact CD2-CE2 3.64Å; F98-W103 AromaticContact CD2-CG 3.99Å; F98-W103 HydrophobicContact CD2-CG 3.99Å; F98-W103 HydrophobicContact CD2-CZ2 4.18Å; F98-W103 AromaticContact CD2-NE1 3.57Å; F98-W103 AromaticContact CE2-CD2 3.9Å; F98-W103 HydrophobicContact CE2-CD2 3.9Å; F98-W103 HydrophobicContact CE2-CE3 4.27Å; F98-W103 HydrophobicContact CE2-CG 4.16Å; F98-W103 HydrophobicContact CE2-CZ2 4.45Å; F98-W103 AromaticContact CG-CD1 3.84Å; F98-W103 HydrophobicContact CG-CG 4.29Å; F98-W103 AromaticContact CG-NE1 3.98Å; F98-P104 HydrophobicContact CZ-CG 4.39Å; F98-H130 PolarHBondContact O-CE1 3.43Å; F98-H130 PolarHBondContact O-NE2 3.24Å
99	K	52.9	Low	57	Low	141 Å²	141	64.3 Å²	64.3	61%	0.613	33%	0.327	S	S	*	.	S	Bend	trans	-65.9	-31.7	176.9	-70.5	-170.3	-175.8	-176.5	0	113.2	T94 D95	T94-K99 PolarHBondContact O-N 3.09Å; D95-K99 WeakPolarHBondContact O-CE 3.41Å; D95-K99 VanDerWaalsContact O-CG 3.31Å; D95-K99 WeakPolarHBondContact O-CG 3.23Å
100	T	45	Very low	56.7	Low	116 Å²	116	63.1 Å²	63.1	71%	0.712	32%	0.319	S	S	*	.	S	Bend	trans	-135.4	-8.1	-174.4	51.7	0	0	0	0	113.7	F98	F98-T100 VanDerWaalsContact C-N 3.3Å; F98-T100 PolarHBondContact O-N 3.41Å
101	S	48.2	Very low	56.4	Low	39 Å²	39	67.4 Å²	67.4	27%	0.273	35%	0.352	S	S	.	.	S	Bend	trans	-104.4	146.4	177.5	41.3	0	0	0	0	110.9	F98 H130	F98-S101 WeakPolarHBondContact CD1-OG 3.47Å; S101-H130 PolarHBondContact O-NE2 3.16Å
102	P	57.8	Low	56	Low	57 Å²	57	67.1 Å²	67.1	37%	0.37	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-66.3	154.3	168.7	29.5	-32.9	0	0	0	110	F98 Y127	F98-P102 WeakPolarHBondContact CD1-O 3.45Å; P102-Y127 HydrophobicContact CB-CE2 3.93Å
103	W	60.3	Low	55.5	Low	4 Å²	4	61.7 Å²	61.7	2%	0.015	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-65.7	166	169.3	-84.7	66.7	0	0	0	110.5	I43 L47 W90 L93 T94 F98 Y123 Y127 H130	I43-W103 HydrophobicContact CG2-CE3 4.27Å; I43-W103 HydrophobicContact CG2-CH2 4.43Å; I43-W103 HydrophobicContact CG2-CZ3 3.71Å; L47-W103 HydrophobicContact CD2-CZ3 4.45Å; W90-W103 HydrophobicContact CD2-CH2 4.22Å; W90-W103 AromaticContact CD2-CZ2 3.95Å; W90-W103 HydrophobicContact CD2-CZ2 3.95Å; W90-W103 AromaticContact CE2-CZ2 3.97Å; W90-W103 AromaticContact CE3-CH2 3.54Å; W90-W103 HydrophobicContact CE3-CH2 3.54Å; W90-W103 AromaticContact CE3-CZ2 3.74Å; W90-W103 HydrophobicContact CE3-CZ2 3.74Å; W90-W103 HydrophobicContact CE3-CZ3 4.12Å; W90-W103 AromaticContact CH2-CD2 3.52Å; W90-W103 HydrophobicContact CH2-CD2 3.52Å; W90-W103 AromaticContact CH2-CE2 3.54Å; W90-W103 AromaticContact CH2-CE3 3.52Å; W90-W103 HydrophobicContact CH2-CE3 3.52Å; W90-W103 HydrophobicContact CH2-CG 4.26Å; W90-W103 AromaticContact CH2-CH2 3.65Å; W90-W103 HydrophobicContact CH2-CH2 3.65Å; W90-W103 AromaticContact CH2-CZ2 3.63Å; W90-W103 HydrophobicContact CH2-CZ2 3.63Å; W90-W103 AromaticContact CH2-CZ3 3.58Å; W90-W103 HydrophobicContact CH2-CZ3 3.58Å; W90-W103 AromaticContact CZ2-CD2 3.92Å; W90-W103 HydrophobicContact CZ2-CD2 3.92Å; W90-W103 AromaticContact CZ2-CE2 3.6Å; W90-W103 HydrophobicContact CZ2-CE3 4.37Å; W90-W103 HydrophobicContact CZ2-CG 4.37Å; W90-W103 HydrophobicContact CZ2-CH2 4.3Å; W90-W103 AromaticContact CZ2-CZ2 3.82Å; W90-W103 HydrophobicContact CZ2-CZ2 3.82Å; W90-W103 AromaticContact CZ2-NE1 3.82Å; W90-W103 HydrophobicContact CZ3-CD2 4.15Å; W90-W103 AromaticContact CZ3-CE3 3.8Å; W90-W103 HydrophobicContact CZ3-CE3 3.8Å; W90-W103 AromaticContact CZ3-CH2 3.22Å; W90-W103 HydrophobicContact CZ3-CH2 3.22Å; W90-W103 AromaticContact CZ3-CZ2 3.59Å; W90-W103 HydrophobicContact CZ3-CZ2 3.59Å; W90-W103 AromaticContact CZ3-CZ3 3.32Å; W90-W103 HydrophobicContact CZ3-CZ3 3.32Å; L93-W103 HydrophobicContact CB-CH2 4.37Å; L93-W103 HydrophobicContact CB-CZ2 4.27Å; T94-W103 PolarHBondContact OG1-NE1 3.34Å; F98-W103 AromaticContact CD2-CD1 3.76Å; F98-W103 AromaticContact CD2-CD2 3.91Å; F98-W103 HydrophobicContact CD2-CD2 3.91Å; F98-W103 AromaticContact CD2-CE2 3.64Å; F98-W103 AromaticContact CD2-CG 3.99Å; F98-W103 HydrophobicContact CD2-CG 3.99Å; F98-W103 HydrophobicContact CD2-CZ2 4.18Å; F98-W103 AromaticContact CD2-NE1 3.57Å; F98-W103 AromaticContact CE2-CD2 3.9Å; F98-W103 HydrophobicContact CE2-CD2 3.9Å; F98-W103 HydrophobicContact CE2-CE3 4.27Å; F98-W103 HydrophobicContact CE2-CG 4.16Å; F98-W103 HydrophobicContact CE2-CZ2 4.45Å; F98-W103 AromaticContact CG-CD1 3.84Å; F98-W103 HydrophobicContact CG-CG 4.29Å; F98-W103 AromaticContact CG-NE1 3.98Å; W103-Y123 HydrophobicContact CE3-CE2 4.1Å; W103-Y127 HydrophobicContact CB-CD2 3.81Å; W103-Y127 HydrophobicContact CB-CE2 4.15Å; W103-Y127 WeakPolarHBondContact O-CE2 3.3Å; W103-H130 AromaticContact CD1-CD2 3.51Å; W103-H130 AromaticContact CD1-CG 3.99Å; W103-H130 AromaticContact CD1-NE2 3.87Å
104	P	58.9	Low	55.2	Low	11 Å²	11	64.1 Å²	64.1	7%	0.071	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-61.7	143.2	177.9	-20.1	32	0	0	0	112	I39 F98 I109 Y123	I39-P104 HydrophobicContact CD1-CB 3.7Å; I39-P104 HydrophobicContact CD1-CG 3.78Å; I39-P104 HydrophobicContact CG1-CB 3.96Å; I39-P104 HydrophobicContact CG1-CG 3.65Å; I39-P104 HydrophobicContact CG2-CG 4.36Å; F98-P104 HydrophobicContact CZ-CG 4.39Å; P104-I109 HydrophobicContact CB-CD1 4.08Å; P104-Y123 PolarHBondContact O-OH 3.34Å
105	E	55.8	Low	55	Low	133 Å²	133	69.6 Å²	69.6	62%	0.621	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-61	150	179.8	-72.2	-178.6	175.5	0	0	112.3	E107 G108	E105-E107 PolarHBondContact O-N 3.15Å; E105-E107 VanDerWaalsContact O-N 3.13Å; E105-G108 PolarHBondContact O-N 3.49Å
106	A	56.2	Low	55	Low	15 Å²	15	67.7 Å²	67.7	12%	0.124	38%	0.376	C	S	.	.	H	α-helix	trans	-59.5	-27.4	-174.6	0	0	0	0	0	113.2	I109 A110 K124	A106-I109 PolarHBondContact O-N 3.34Å; A106-A110 VanDerWaalsContact O-CB 3.26Å; A106-A110 WeakPolarHBondContact O-CB 3.33Å; A106-A110 PolarHBondContact O-N 2.9Å; A106-K124 HydrophobicContact CB-CD 4.12Å; A106-K124 HydrophobicContact CB-CG 3.73Å
107	E	55.8	Low	55.2	Low	158 Å²	158	61.3 Å²	61.3	74%	0.738	37%	0.365	S	S	*	.	H	α-helix	trans	-68.6	-34.6	177.2	-62.9	-169.9	165.8	0	0	112.6	E105 I109 S111	E105-E107 PolarHBondContact O-N 3.15Å; E105-E107 VanDerWaalsContact O-N 3.13Å; E107-I109 VanDerWaalsContact C-N 3.27Å; E107-I109 PolarHBondContact O-N 3.41Å; E107-S111 PolarHBondContact O-OG 2.91Å
108	G	53	Low	55.7	Low	41 Å²	41	57.4 Å²	57.4	42%	0.423	35%	0.348	S	S	.	.	H	α-helix	trans	-71.4	-22.4	174.6	0	0	0	0	0	113.5	E105	E105-G108 PolarHBondContact O-N 3.49Å
109	I	58.2	Low	56	Low	0 Å²	0	57 Å²	57	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-98.4	-28.2	-178.4	-68.5	165.2	0	0	0	111.8	I39 L47 P104 A106 E107 S111 L112 V113 F119 Y123	I39-I109 HydrophobicContact CD1-CG1 4.03Å; L47-I109 HydrophobicContact CD1-CD1 3.67Å; L47-I109 HydrophobicContact CD1-CG1 3.94Å; L47-I109 HydrophobicContact CD1-CG2 4.19Å; P104-I109 HydrophobicContact CB-CD1 4.08Å; A106-I109 PolarHBondContact O-N 3.34Å; E107-I109 VanDerWaalsContact C-N 3.27Å; E107-I109 PolarHBondContact O-N 3.41Å; I109-S111 PolarHBondContact O-N 3.46Å; I109-L112 WeakPolarHBondContact O-CB 3.34Å; I109-L112 PolarHBondContact O-N 3.29Å; I109-V113 HydrophobicContact CG2-CG2 3.76Å; I109-V113 WeakPolarHBondContact O-CB 3.3Å; I109-V113 WeakPolarHBondContact O-CG2 3.16Å; I109-V113 PolarHBondContact O-N 3.45Å; I109-V113 VanDerWaalsContact O-N 3.12Å; I109-F119 HydrophobicContact CG2-CE1 4.47Å; I109-Y123 HydrophobicContact CD1-CD1 4.19Å; I109-Y123 HydrophobicContact CD1-CE1 3.3Å; I109-Y123 HydrophobicContact CD1-CE2 3.79Å; I109-Y123 WeakPolarHBondContact CD1-OH 3.43Å; I109-Y123 HydrophobicContact CG1-CE1 4.5Å
110	A	54.3	Low	56.6	Low	13 Å²	13	51.5 Å²	51.5	11%	0.107	32%	0.324	C	S	.	.	H	α-helix	trans	-51.2	-43.4	171.5	0	0	0	0	0	112	A106 L112 V113 G114 N115 L120	A106-A110 VanDerWaalsContact O-CB 3.26Å; A106-A110 WeakPolarHBondContact O-CB 3.33Å; A106-A110 PolarHBondContact O-N 2.9Å; A110-L112 VanDerWaalsContact C-N 3.31Å; A110-L112 PolarHBondContact O-N 3.3Å; A110-V113 PolarHBondContact O-N 3.21Å; A110-G114 PolarHBondContact O-N 2.78Å; A110-N115 WeakPolarHBondContact CB-OD1 3.42Å; A110-N115 PolarHBondContact O-N 3.06Å; A110-L120 HydrophobicContact CB-CD1 4.05Å; A110-L120 HydrophobicContact CB-CD2 4.05Å
111	S	56	Low	57.6	Low	108 Å²	108	47.1 Å²	47.1	76%	0.755	30%	0.296	S	S	*	.	H	α-helix	trans	-64.7	-27.7	175.6	-51.5	0	0	0	0	114.4	E107 I109	E107-S111 PolarHBondContact O-OG 2.91Å; I109-S111 PolarHBondContact O-N 3.46Å
112	L	53.7	Low	58.4	Low	56 Å²	56	45.3 Å²	45.3	29%	0.293	28%	0.283	S	S	.	.	H	α-helix	trans	-87.9	-20.1	-179	-82.8	151.1	0	0	0	113.3	I39 K44 I109 A110	I39-L112 HydrophobicContact CD1-CD1 4.07Å; K44-L112 HydrophobicContact CD-CD1 4.47Å; K44-L112 HydrophobicContact CD-CD2 4.1Å; K44-L112 HydrophobicContact CG-CD1 4.3Å; K44-L112 HydrophobicContact CG-CD2 4.35Å; I109-L112 WeakPolarHBondContact O-CB 3.34Å; I109-L112 PolarHBondContact O-N 3.29Å; A110-L112 VanDerWaalsContact C-N 3.31Å; A110-L112 PolarHBondContact O-N 3.3Å
113	V	52.3	Low	58.7	Low	9 Å²	9	42.6 Å²	42.6	6%	0.055	27%	0.266	C	S	.	.	H	α-helix	trans	-114.1	-6.2	-166.9	179.5	0	0	0	0	112.4	H51 I109 A110 F119	H51-V113 HydrophobicContact CB-CG1 3.84Å; H51-V113 WeakPolarHBondContact CD2-CG1 3.45Å; H51-V113 PolarHBondContact CE1-O 3.26Å; H51-V113 VanDerWaalsContact CE1-O 3.27Å; H51-V113 WeakPolarHBondContact NE2-CG1 3.39Å; H51-V113 PolarHBondContact NE2-O 3.38Å; I109-V113 HydrophobicContact CG2-CG2 3.76Å; I109-V113 WeakPolarHBondContact O-CB 3.3Å; I109-V113 WeakPolarHBondContact O-CG2 3.16Å; I109-V113 PolarHBondContact O-N 3.45Å; I109-V113 VanDerWaalsContact O-N 3.12Å; A110-V113 PolarHBondContact O-N 3.21Å; V113-F119 HydrophobicContact CB-CD1 4.39Å; V113-F119 HydrophobicContact CB-CE1 4.46Å; V113-F119 HydrophobicContact CG1-CD1 3.56Å; V113-F119 HydrophobicContact CG1-CE1 3.92Å; V113-F119 HydrophobicContact CG1-CG 4.1Å; V113-F119 HydrophobicContact CG2-CD1 4.3Å; V113-F119 HydrophobicContact CG2-CE1 3.87Å
114	G	53.3	Low	59	Low	69 Å²	69	46 Å²	46	71%	0.711	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	29.7	176.8	0	0	0	0	0	113.5	A110 D116	A110-G114 PolarHBondContact O-N 2.78Å; G114-D116 VanDerWaalsContact C-N 3.32Å; G114-D116 PolarHBondContact O-N 3Å
115	N	55.3	Low	59.3	Low	117 Å²	117	45.5 Å²	45.5	63%	0.626	28%	0.277	S	S	*	.			trans	58	31.1	176.3	-77.5	-15.8	0	0	0	115.9	A110 A117	A110-N115 WeakPolarHBondContact CB-OD1 3.42Å; A110-N115 PolarHBondContact O-N 3.06Å; N115-A117 PolarHBondContact O-N 3.15Å
116	D	59.2	Low	59.6	Low	40 Å²	40	39.4 Å²	39.4	21%	0.214	25%	0.249	C	C	.	.			trans	-64.1	110.3	169.6	-179.1	10.7	0	0	0	110.4	H51 G114 V118 F119 L120	H51-D116 IonicContact NE2-OD2 3.7Å; G114-D116 VanDerWaalsContact C-N 3.32Å; G114-D116 PolarHBondContact O-N 3Å; D116-V118 VanDerWaalsContact C-N 3.27Å; D116-V118 PolarHBondContact O-N 3.36Å; D116-V118 PolarHBondContact OD1-N 3Å; D116-V118 VanDerWaalsContact OD1-N 3.14Å; D116-F119 HydrophobicContact CB-CB 4.07Å; D116-F119 PolarHBondContact O-N 3.02Å; D116-L120 WeakPolarHBondContact O-CB 3.39Å; D116-L120 VanDerWaalsContact O-CG 3.26Å; D116-L120 WeakPolarHBondContact O-CG 3.45Å; D116-L120 PolarHBondContact O-N 2.8Å
117	A	62.3	Low	60	Low	61 Å²	61	39.5 Å²	39.5	50%	0.504	25%	0.246	S	C	.	.	H	α-helix	trans	-61.9	-34.4	-176	0	0	0	0	0	112.2	N115 I121	N115-A117 PolarHBondContact O-N 3.15Å; A117-I121 VanDerWaalsContact O-CD1 3.31Å; A117-I121 WeakPolarHBondContact O-CD1 3.46Å; A117-I121 WeakPolarHBondContact O-CG1 3.45Å; A117-I121 PolarHBondContact O-N 2.91Å; A117-I121 VanDerWaalsContact O-N 3.1Å
118	V	64.1	Low	60.3	Low	10 Å²	10	32.4 Å²	32.4	6%	0.061	21%	0.212	C	C	.	.	H	α-helix	trans	-73	-46.4	-178.1	-178.2	0	0	0	0	110.3	I58 D116 L120 I121 L122 Y157 L167	I58-V118 HydrophobicContact CD1-CB 4.49Å; I58-V118 HydrophobicContact CD1-CG1 4.29Å; D116-V118 VanDerWaalsContact C-N 3.27Å; D116-V118 PolarHBondContact O-N 3.36Å; D116-V118 PolarHBondContact OD1-N 3Å; D116-V118 VanDerWaalsContact OD1-N 3.14Å; V118-L120 VanDerWaalsContact C-N 3.33Å; V118-L120 PolarHBondContact O-N 3.3Å; V118-I121 PolarHBondContact O-N 3.44Å; V118-L122 HydrophobicContact CG1-CD1 4.26Å; V118-L122 WeakPolarHBondContact O-CG 3.29Å; V118-L122 PolarHBondContact O-N 3.48Å; V118-L122 VanDerWaalsContact O-N 3.07Å; V118-Y157 HydrophobicContact CG1-CE1 4.35Å; V118-Y157 HydrophobicContact CG2-CE1 3.81Å; V118-Y157 HydrophobicContact CG2-CE2 3.92Å; V118-Y157 VanDerWaalsContact CG2-CZ 3.45Å; V118-Y157 WeakPolarHBondContact CG2-OH 3.35Å; V118-L167 HydrophobicContact CG1-CD1 4.3Å
119	F	64.3	Low	60.8	Low	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.9	-42.3	175	-177.1	-91.4	0	0	0	112.2	L47 F50 H51 I54 I109 V113 D116 I121 L122 Y123	L47-F119 HydrophobicContact CD2-CZ 4.43Å; F50-F119 HydrophobicContact CB-CE2 4.11Å; F50-F119 HydrophobicContact CB-CZ 4.41Å; F50-F119 HydrophobicContact CD1-CD2 4.27Å; F50-F119 AromaticContact CD1-CE2 3.22Å; F50-F119 HydrophobicContact CD1-CE2 3.22Å; F50-F119 AromaticContact CD1-CZ 3.64Å; F50-F119 HydrophobicContact CD1-CZ 3.64Å; F50-F119 AromaticContact CE1-CE2 3.89Å; F50-F119 HydrophobicContact CE1-CE2 3.89Å; F50-F119 HydrophobicContact CE1-CZ 4.44Å; F50-F119 AromaticContact CG-CE2 3.91Å; F50-F119 HydrophobicContact CG-CE2 3.91Å; F50-F119 HydrophobicContact CG-CZ 4.44Å; H51-F119 HydrophobicContact CB-CD2 3.96Å; H51-F119 HydrophobicContact CB-CE1 4.38Å; H51-F119 HydrophobicContact CB-CE2 3.7Å; H51-F119 HydrophobicContact CB-CG 4.38Å; H51-F119 HydrophobicContact CB-CZ 3.92Å; H51-F119 AromaticContact CD2-CD2 3.98Å; H51-F119 AromaticContact CD2-CG 3.82Å; H51-F119 VanDerWaalsContact N-CE2 3.29Å; I54-F119 HydrophobicContact CB-CD2 4.32Å; I54-F119 HydrophobicContact CD1-CD2 3.63Å; I54-F119 HydrophobicContact CD1-CE2 3.89Å; I109-F119 HydrophobicContact CG2-CE1 4.47Å; V113-F119 HydrophobicContact CB-CD1 4.39Å; V113-F119 HydrophobicContact CB-CE1 4.46Å; V113-F119 HydrophobicContact CG1-CD1 3.56Å; V113-F119 HydrophobicContact CG1-CE1 3.92Å; V113-F119 HydrophobicContact CG1-CG 4.1Å; V113-F119 HydrophobicContact CG2-CD1 4.3Å; V113-F119 HydrophobicContact CG2-CE1 3.87Å; D116-F119 HydrophobicContact CB-CB 4.07Å; D116-F119 PolarHBondContact O-N 3.02Å; F119-I121 VanDerWaalsContact C-N 3.32Å; F119-I121 PolarHBondContact O-N 3.39Å; F119-L122 PolarHBondContact O-N 3.12Å; F119-Y123 VanDerWaalsContact O-CB 3.29Å; F119-Y123 WeakPolarHBondContact O-CB 3.44Å; F119-Y123 PolarHBondContact O-N 2.89Å
120	L	63.8	Low	60.8	Low	24 Å²	24	33.7 Å²	33.7	13%	0.126	21%	0.205	C	C	.	.	H	α-helix	trans	-64.1	-37	178.5	-73.7	171.3	0	0	0	112.3	A110 D116 V118 K124	A110-L120 HydrophobicContact CB-CD1 4.05Å; A110-L120 HydrophobicContact CB-CD2 4.05Å; D116-L120 WeakPolarHBondContact O-CB 3.39Å; D116-L120 VanDerWaalsContact O-CG 3.26Å; D116-L120 WeakPolarHBondContact O-CG 3.45Å; D116-L120 PolarHBondContact O-N 2.8Å; V118-L120 VanDerWaalsContact C-N 3.33Å; V118-L120 PolarHBondContact O-N 3.3Å; L120-K124 VanDerWaalsContact O-CB 3.3Å; L120-K124 WeakPolarHBondContact O-CB 3.5Å; L120-K124 VanDerWaalsContact O-CG 3.22Å; L120-K124 WeakPolarHBondContact O-CG 3.46Å; L120-K124 PolarHBondContact O-N 3.49Å
121	I	66.1	Low	61	Low	25 Å²	25	33.2 Å²	33.2	13%	0.128	20%	0.201	C	C	.	.	H	α-helix	trans	-65.5	-45.8	174.9	-70	164.3	0	0	0	110.8	A117 V118 F119 K124 E125 N150 N153 L154	A117-I121 VanDerWaalsContact O-CD1 3.31Å; A117-I121 WeakPolarHBondContact O-CD1 3.46Å; A117-I121 WeakPolarHBondContact O-CG1 3.45Å; A117-I121 PolarHBondContact O-N 2.91Å; A117-I121 VanDerWaalsContact O-N 3.1Å; V118-I121 PolarHBondContact O-N 3.44Å; F119-I121 VanDerWaalsContact C-N 3.32Å; F119-I121 PolarHBondContact O-N 3.39Å; I121-K124 PolarHBondContact O-N 3.3Å; I121-E125 PolarHBondContact O-N 3.27Å; I121-N150 WeakPolarHBondContact CA-OD1 3.44Å; I121-N150 PolarHBondContact O-ND2 3.21Å; I121-N153 HydrophobicContact CD1-CB 4.27Å; I121-L154 HydrophobicContact CG2-CB 3.62Å; I121-L154 HydrophobicContact CG2-CD1 3.72Å; I121-L154 HydrophobicContact CG2-CG 4.17Å
122	L	65.1	Low	61.1	Low	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.6	-38.2	178.3	-67.4	172.9	0	0	0	112.3	I54 V118 F119 E125 L126 L154 L169 W173	I54-L122 HydrophobicContact CD1-CD1 4.22Å; V118-L122 HydrophobicContact CG1-CD1 4.26Å; V118-L122 WeakPolarHBondContact O-CG 3.29Å; V118-L122 PolarHBondContact O-N 3.48Å; V118-L122 VanDerWaalsContact O-N 3.07Å; F119-L122 PolarHBondContact O-N 3.12Å; L122-E125 WeakPolarHBondContact O-CB 3.31Å; L122-E125 PolarHBondContact O-N 3.45Å; L122-L126 PolarHBondContact O-N 3.34Å; L122-L126 VanDerWaalsContact O-N 3.08Å; L122-L154 HydrophobicContact CD2-CD1 4.26Å; L122-L169 HydrophobicContact CD1-CD2 4.39Å; L122-L169 HydrophobicContact CD2-CD1 4.01Å; L122-W173 HydrophobicContact CB-CH2 4.04Å; L122-W173 HydrophobicContact CB-CZ2 4.03Å; L122-W173 HydrophobicContact CD1-CH2 4.08Å; L122-W173 HydrophobicContact CD2-CH2 4.1Å; L122-W173 HydrophobicContact CD2-CZ2 3.86Å; L122-W173 HydrophobicContact CG-CH2 4.3Å; L122-W173 HydrophobicContact CG-CZ2 4.38Å
123	Y	65.1	Low	61.2	Low	1 Å²	1	28.8 Å²	28.8	0%	0.004	17%	0.173	C	C	.	.	H	α-helix	trans	-66.4	-42.8	174.6	178	-97.4	0	0	0	111.4	L47 W90 W103 P104 I109 F119 E125 L126 Y127	L47-Y123 HydrophobicContact CD2-CD2 3.74Å; L47-Y123 HydrophobicContact CD2-CE2 3.61Å; W90-Y123 HydrophobicContact CH2-CE2 4.02Å; W90-Y123 HydrophobicContact CZ3-CE2 4.33Å; W103-Y123 HydrophobicContact CE3-CE2 4.1Å; P104-Y123 PolarHBondContact O-OH 3.34Å; I109-Y123 HydrophobicContact CD1-CD1 4.19Å; I109-Y123 HydrophobicContact CD1-CE1 3.3Å; I109-Y123 HydrophobicContact CD1-CE2 3.79Å; I109-Y123 WeakPolarHBondContact CD1-OH 3.43Å; I109-Y123 HydrophobicContact CG1-CE1 4.5Å; F119-Y123 VanDerWaalsContact O-CB 3.29Å; F119-Y123 WeakPolarHBondContact O-CB 3.44Å; F119-Y123 PolarHBondContact O-N 2.89Å; Y123-E125 VanDerWaalsContact C-N 3.27Å; Y123-E125 PolarHBondContact O-N 3.36Å; Y123-L126 PolarHBondContact O-N 3.32Å; Y123-Y127 VanDerWaalsContact O-CB 3.31Å; Y123-Y127 WeakPolarHBondContact O-CB 3.36Å; Y123-Y127 PolarHBondContact O-N 2.84Å
124	K	66.5	Low	61.3	Low	75 Å²	75	31.4 Å²	31.4	33%	0.326	18%	0.183	S	C	.	.	H	α-helix	trans	-60.2	-37.6	173.2	-78.9	177.9	179.5	-170.1	0	111.6	A106 L120 I121 Y127 Y128 N150	A106-K124 HydrophobicContact CB-CD 4.12Å; A106-K124 HydrophobicContact CB-CG 3.73Å; L120-K124 VanDerWaalsContact O-CB 3.3Å; L120-K124 WeakPolarHBondContact O-CB 3.5Å; L120-K124 VanDerWaalsContact O-CG 3.22Å; L120-K124 WeakPolarHBondContact O-CG 3.46Å; L120-K124 PolarHBondContact O-N 3.49Å; I121-K124 PolarHBondContact O-N 3.3Å; K124-Y127 WeakPolarHBondContact O-CB 3.49Å; K124-Y127 PolarHBondContact O-N 3.04Å; K124-Y128 HydrophobicContact CB-CD2 4.4Å; K124-Y128 HydrophobicContact CB-CE2 4.03Å; K124-Y128 WeakPolarHBondContact O-CD2 3.48Å; K124-Y128 PolarHBondContact O-N 3.39Å; K124-N150 WeakPolarHBondContact CB-ND2 3.37Å
125	E	64.3	Low	61.2	Low	1 Å²	1	30.1 Å²	30.1	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-62.7	-47.5	175	-169.3	-156.3	122.7	0	0	112.1	I121 L122 Y123 Y127 Y128 R129 N150 Y151 W173 I177	I121-E125 PolarHBondContact O-N 3.27Å; L122-E125 WeakPolarHBondContact O-CB 3.31Å; L122-E125 PolarHBondContact O-N 3.45Å; Y123-E125 VanDerWaalsContact C-N 3.27Å; Y123-E125 PolarHBondContact O-N 3.36Å; E125-Y127 VanDerWaalsContact C-N 3.3Å; E125-Y127 PolarHBondContact O-N 3.21Å; E125-Y128 PolarHBondContact O-N 3.12Å; E125-R129 WeakPolarHBondContact O-CB 3.43Å; E125-R129 PolarHBondContact O-N 3.23Å; E125-N150 PolarHBondContact N-ND2 2.92Å; E125-Y151 HydrophobicContact CG-CE1 3.76Å; E125-Y151 WeakPolarHBondContact CG-OH 3.5Å; E125-W173 PolarHBondContact OE1-NE1 2.93Å; E125-I177 WeakPolarHBondContact OE1-CG1 3.25Å; E125-I177 VanDerWaalsContact OE2-CD1 3.29Å; E125-I177 WeakPolarHBondContact OE2-CD1 3.46Å
126	L	64.1	Low	60.6	Low	4 Å²	4	30.5 Å²	30.5	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-60.8	-40	175	-75.7	173.6	0	0	0	112.4	F50 Y86 W90 L122 Y123 R129 H130 W173	F50-L126 HydrophobicContact CE1-CD1 4Å; F50-L126 HydrophobicContact CZ-CD1 4.23Å; Y86-L126 HydrophobicContact CD2-CD2 3.87Å; Y86-L126 HydrophobicContact CE2-CD2 3.4Å; Y86-L126 VanDerWaalsContact CE2-CD2 3.4Å; W90-L126 HydrophobicContact CE3-CD1 4.38Å; W90-L126 HydrophobicContact CH2-CB 4Å; W90-L126 HydrophobicContact CH2-CD1 4.42Å; W90-L126 HydrophobicContact CZ2-CB 3.81Å; W90-L126 HydrophobicContact CZ3-CD1 4.27Å; L122-L126 PolarHBondContact O-N 3.34Å; L122-L126 VanDerWaalsContact O-N 3.08Å; Y123-L126 PolarHBondContact O-N 3.32Å; L126-R129 PolarHBondContact O-N 3.33Å; L126-H130 PolarHBondContact O-N 3.14Å; L126-W173 HydrophobicContact CD1-CZ2 4.36Å; L126-W173 HydrophobicContact CG-CZ2 4.34Å
127	Y	62.8	Low	60.1	Low	17 Å²	17	32 Å²	32	7%	0.067	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-53.4	176.6	175.6	-107.4	0	0	0	111.7	P102 W103 Y123 K124 E125 R129 H130 I131	P102-Y127 HydrophobicContact CB-CE2 3.93Å; W103-Y127 HydrophobicContact CB-CD2 3.81Å; W103-Y127 HydrophobicContact CB-CE2 4.15Å; W103-Y127 WeakPolarHBondContact O-CE2 3.3Å; Y123-Y127 VanDerWaalsContact O-CB 3.31Å; Y123-Y127 WeakPolarHBondContact O-CB 3.36Å; Y123-Y127 PolarHBondContact O-N 2.84Å; K124-Y127 WeakPolarHBondContact O-CB 3.49Å; K124-Y127 PolarHBondContact O-N 3.04Å; E125-Y127 VanDerWaalsContact C-N 3.3Å; E125-Y127 PolarHBondContact O-N 3.21Å; Y127-R129 VanDerWaalsContact C-N 3.34Å; Y127-R129 PolarHBondContact O-N 3.23Å; Y127-H130 PolarHBondContact O-N 3.24Å; Y127-I131 HydrophobicContact CD1-CD1 3.75Å; Y127-I131 HydrophobicContact CD2-CD1 4.47Å; Y127-I131 HydrophobicContact CE1-CD1 3.24Å; Y127-I131 HydrophobicContact CE1-CG1 4.45Å; Y127-I131 HydrophobicContact CE2-CD1 4Å; Y127-I131 HydrophobicContact CG-CD1 4.36Å; Y127-I131 VanDerWaalsContact CZ-CD1 3.4Å; Y127-I131 WeakPolarHBondContact O-CG1 3.35Å; Y127-I131 PolarHBondContact O-N 2.83Å
128	Y	62.6	Low	59.7	Low	9 Å²	9	30.6 Å²	30.6	4%	0.035	19%	0.19	C	C	.	.	H	α-helix	trans	-65.2	-38.6	178.9	-66.1	-58.7	0	0	0	111.2	K124 E125 H130 I131 Y132 Q143 E146 N150	K124-Y128 HydrophobicContact CB-CD2 4.4Å; K124-Y128 HydrophobicContact CB-CE2 4.03Å; K124-Y128 WeakPolarHBondContact O-CD2 3.48Å; K124-Y128 PolarHBondContact O-N 3.39Å; E125-Y128 PolarHBondContact O-N 3.12Å; Y128-H130 VanDerWaalsContact C-N 3.3Å; Y128-H130 PolarHBondContact O-N 3.39Å; Y128-I131 HydrophobicContact CD1-CD1 4.14Å; Y128-I131 WeakPolarHBondContact O-CB 3.47Å; Y128-I131 PolarHBondContact O-N 3.28Å; Y128-I131 VanDerWaalsContact O-N 3.11Å; Y128-Y132 VanDerWaalsContact O-CD2 3.28Å; Y128-Y132 WeakPolarHBondContact O-CD2 3.31Å; Y128-Y132 PolarHBondContact O-N 2.79Å; Y128-Q143 HydrophobicContact CE1-CB 4.28Å; Y128-E146 HydrophobicContact CE1-CB 4.4Å; Y128-E146 WeakPolarHBondContact OH-CB 3.45Å; Y128-E146 PolarHBondContact OH-OE2 3.3Å; Y128-N150 HydrophobicContact CE2-CB 4.31Å
129	R	63.4	Low	59.4	Low	58 Å²	58	30.9 Å²	30.9	22%	0.219	19%	0.192	C	C	.	.	H	α-helix	trans	-57	-43.3	174.3	-171.1	178.8	-169	-168.1	8.4	112.2	Y86 E125 L126 Y127 Y132 A133 D176	Y86-R129 PolarHBondContact OH-NH1 3.03Å; E125-R129 WeakPolarHBondContact O-CB 3.43Å; E125-R129 PolarHBondContact O-N 3.23Å; L126-R129 PolarHBondContact O-N 3.33Å; Y127-R129 VanDerWaalsContact C-N 3.34Å; Y127-R129 PolarHBondContact O-N 3.23Å; R129-Y132 PolarHBondContact O-N 3.39Å; R129-A133 VanDerWaalsContact O-CB 3.29Å; R129-A133 WeakPolarHBondContact O-CB 3.15Å; R129-A133 PolarHBondContact O-N 3.08Å; R129-D176 IonicContact CZ-OD1 3.03Å; R129-D176 IonicContact CZ-OD2 3.78Å; R129-D176 VanDerWaalsContact CZ-OD2 3.27Å; R129-D176 IonicContact NH1-OD2 3.06Å; R129-D176 PolarHBondContact NH1-OD2 2.88Å; R129-D176 IonicContact NH2-OD1 2.67Å; R129-D176 PolarHBondContact NH2-OD1 2.99Å; R129-D176 IonicContact NH2-OD2 3.95Å; R129-D176 PolarHBondContact NH2-OD2 3.33Å
130	H	58.6	Low	59.3	Low	10 Å²	10	34.3 Å²	34.3	5%	0.046	21%	0.213	C	C	.	.	H	α-helix	trans	-64.2	-40.6	176.1	178.9	62.1	0	0	0	112.3	T94 F98 S101 W103 L126 Y127 Y128 A133 K134	T94-H130 WeakPolarHBondContact CG2-CE1 3.32Å; T94-H130 WeakPolarHBondContact CG2-ND1 3.31Å; F98-H130 PolarHBondContact O-CE1 3.43Å; F98-H130 PolarHBondContact O-NE2 3.24Å; S101-H130 PolarHBondContact O-NE2 3.16Å; W103-H130 AromaticContact CD1-CD2 3.51Å; W103-H130 AromaticContact CD1-CG 3.99Å; W103-H130 AromaticContact CD1-NE2 3.87Å; L126-H130 PolarHBondContact O-N 3.14Å; Y127-H130 PolarHBondContact O-N 3.24Å; Y128-H130 VanDerWaalsContact C-N 3.3Å; Y128-H130 PolarHBondContact O-N 3.39Å; H130-A133 PolarHBondContact O-N 3.29Å; H130-K134 PolarHBondContact O-N 3.1Å
131	I	58.4	Low	59.2	Low	3 Å²	3	34.3 Å²	34.3	2%	0.015	21%	0.213	C	C	.	.	H	α-helix	trans	-60.4	-47.2	174.9	-68	167.8	0	0	0	111	Y127 Y128 A133 V135 P139	Y127-I131 HydrophobicContact CD1-CD1 3.75Å; Y127-I131 HydrophobicContact CD2-CD1 4.47Å; Y127-I131 HydrophobicContact CE1-CD1 3.24Å; Y127-I131 HydrophobicContact CE1-CG1 4.45Å; Y127-I131 HydrophobicContact CE2-CD1 4Å; Y127-I131 HydrophobicContact CG-CD1 4.36Å; Y127-I131 VanDerWaalsContact CZ-CD1 3.4Å; Y127-I131 WeakPolarHBondContact O-CG1 3.35Å; Y127-I131 PolarHBondContact O-N 2.83Å; Y128-I131 HydrophobicContact CD1-CD1 4.14Å; Y128-I131 WeakPolarHBondContact O-CB 3.47Å; Y128-I131 PolarHBondContact O-N 3.28Å; Y128-I131 VanDerWaalsContact O-N 3.11Å; I131-A133 VanDerWaalsContact C-N 3.33Å; I131-A133 PolarHBondContact O-N 3.49Å; I131-V135 HydrophobicContact CG1-CG2 4.5Å; I131-V135 HydrophobicContact CG2-CB 4.48Å; I131-V135 HydrophobicContact CG2-CG2 4.47Å; I131-V135 WeakPolarHBondContact O-CB 3.42Å; I131-V135 PolarHBondContact O-N 2.87Å; I131-P139 HydrophobicContact CG2-CB 3.86Å
132	Y	58.1	Low	59.1	Low	29 Å²	29	39.5 Å²	39.5	11%	0.114	24%	0.237	C	C	.	.	H	α-helix	trans	-66.1	-32.6	179.5	-87	-85.5	0	0	0	113.2	Y128 R129 P139 R144 Y183 Q184 S187	Y128-Y132 VanDerWaalsContact O-CD2 3.28Å; Y128-Y132 WeakPolarHBondContact O-CD2 3.31Å; Y128-Y132 PolarHBondContact O-N 2.79Å; R129-Y132 PolarHBondContact O-N 3.39Å; Y132-P139 HydrophobicContact CD1-CG 3.86Å; Y132-P139 HydrophobicContact CD2-CG 4.39Å; Y132-P139 HydrophobicContact CE1-CG 3.55Å; Y132-P139 HydrophobicContact CE2-CB 4.35Å; Y132-P139 HydrophobicContact CE2-CG 4.08Å; Y132-P139 HydrophobicContact CG-CG 4.3Å; Y132-R144 WeakPolarHBondContact OH-CG 3.21Å; Y132-Y183 HydrophobicContact CD1-CE1 4.04Å; Y132-Q184 HydrophobicContact CD1-CG 4.44Å; Y132-Q184 HydrophobicContact CD2-CG 4.09Å; Y132-Q184 HydrophobicContact CE1-CG 4.01Å; Y132-Q184 VanDerWaalsContact CE2-CD 3.41Å; Y132-Q184 HydrophobicContact CE2-CG 3.67Å; Y132-Q184 HydrophobicContact CG-CG 4.47Å; Y132-S187 WeakPolarHBondContact CE1-OG 3.27Å
133	A	56.8	Low	59.1	Low	43 Å²	43	41.6 Å²	41.6	36%	0.355	25%	0.247	S	C	.	.	H	α-helix	trans	-88.9	-36	-175	0	0	0	0	0	114.6	R129 H130 I131	R129-A133 VanDerWaalsContact O-CB 3.29Å; R129-A133 WeakPolarHBondContact O-CB 3.15Å; R129-A133 PolarHBondContact O-N 3.08Å; H130-A133 PolarHBondContact O-N 3.29Å; I131-A133 VanDerWaalsContact C-N 3.33Å; I131-A133 PolarHBondContact O-N 3.49Å
134	K	52.8	Low	59.1	Low	63 Å²	63	42.8 Å²	42.8	27%	0.274	25%	0.251	S	S	.	.	H	α-helix	trans	-123.1	-14.7	-166.7	-73	-174.9	178	176.9	0	115.5	T94 D95 H130 S136	T94-K134 HydrophobicContact CG2-CD 3.81Å; D95-K134 IonicContact OD1-NZ 3.9Å; D95-K134 PolarHBondContact OD1-NZ 2.95Å; H130-K134 PolarHBondContact O-N 3.1Å; K134-S136 PolarHBondContact O-N 3.45Å
135	V	51.7	Low	59.1	Low	42 Å²	42	39.9 Å²	39.9	26%	0.255	24%	0.239	S	C	.	.			trans	-86.6	107.7	179.2	-179.3	0	0	0	0	110.3	I131 G137 G138	I131-V135 HydrophobicContact CG1-CG2 4.5Å; I131-V135 HydrophobicContact CG2-CB 4.48Å; I131-V135 HydrophobicContact CG2-CG2 4.47Å; I131-V135 WeakPolarHBondContact O-CB 3.42Å; I131-V135 PolarHBondContact O-N 2.87Å; V135-G137 PolarHBondContact O-N 2.82Å; V135-G137 VanDerWaalsContact O-N 3.09Å; V135-G138 PolarHBondContact O-N 3.33Å; V135-G138 VanDerWaalsContact O-N 3.13Å
136	S	43.7	Very low	59.3	Low	125 Å²	125	44.9 Å²	44.9	87%	0.874	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-5.2	-179.9	36.8	0	0	0	0	115	K134	K134-S136 PolarHBondContact O-N 3.45Å
137	G	48.1	Very low	59.5	Low	71 Å²	71	44.7 Å²	44.7	73%	0.732	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-9	172.3	0	0	0	0	0	115.2	V135	V135-G137 PolarHBondContact O-N 2.82Å; V135-G137 VanDerWaalsContact O-N 3.09Å
138	G	52.8	Low	60	Low	33 Å²	33	44.9 Å²	44.9	34%	0.34	26%	0.262	S	S	.	.			trans	71.1	154.6	-173.2	0	0	0	0	0	113.3	V135	V135-G138 PolarHBondContact O-N 3.33Å; V135-G138 VanDerWaalsContact O-N 3.13Å
139	P	59.3	Low	60.4	Low	15 Å²	15	50.1 Å²	50.1	10%	0.097	28%	0.282	C	S	.	.			trans	-67.1	135.6	177.8	20.4	-25.2	0	0	0	110.4	I131 Y132 Q143 R144	I131-P139 HydrophobicContact CG2-CB 3.86Å; Y132-P139 HydrophobicContact CD1-CG 3.86Å; Y132-P139 HydrophobicContact CD2-CG 4.39Å; Y132-P139 HydrophobicContact CE1-CG 3.55Å; Y132-P139 HydrophobicContact CE2-CB 4.35Å; Y132-P139 HydrophobicContact CE2-CG 4.08Å; Y132-P139 HydrophobicContact CG-CG 4.3Å; P139-Q143 HydrophobicContact CB-CB 4.42Å; P139-R144 HydrophobicContact CB-CG 3.97Å; P139-R144 HydrophobicContact CG-CG 4.09Å; P139-R144 PolarHBondContact O-NE 3.03Å; P139-R144 PolarHBondContact O-NH2 2.88Å
140	T	61.8	Low	60.9	Low	73 Å²	73	47.7 Å²	47.7	45%	0.448	27%	0.274	S	S	.	.			trans	-61.5	156.2	172.2	62.1	0	0	0	0	110.1	E142 Q143 R144	T140-E142 VanDerWaalsContact C-N 3.25Å; T140-E142 PolarHBondContact O-N 3.42Å; T140-Q143 PolarHBondContact O-N 2.73Å; T140-Q143 WeakPolarHBondContact OG1-CB 3.27Å; T140-Q143 WeakPolarHBondContact OG1-CG 3.17Å; T140-Q143 PolarHBondContact OG1-N 3.3Å; T140-Q143 PolarHBondContact OG1-OE1 2.77Å; T140-R144 WeakPolarHBondContact O-CG 3.25Å; T140-R144 PolarHBondContact O-N 3.44Å
141	L	62.1	Low	61.5	Low	24 Å²	24	47.3 Å²	47.3	13%	0.126	27%	0.272	C	S	.	.	H	α-helix	trans	-53.4	-45.4	178.7	-92.1	161.9	0	0	0	111.6	R144 F145 Y191 E202 L206	L141-R144 WeakPolarHBondContact O-CB 3.38Å; L141-R144 PolarHBondContact O-N 2.73Å; L141-R144 VanDerWaalsContact O-N 3.16Å; L141-F145 HydrophobicContact CB-CE2 4.35Å; L141-F145 HydrophobicContact CD2-CE2 4.05Å; L141-F145 WeakPolarHBondContact O-CD2 3.39Å; L141-F145 PolarHBondContact O-N 2.64Å; L141-Y191 HydrophobicContact CD2-CE1 3.66Å; L141-Y191 HydrophobicContact CG-CE1 4.14Å; L141-E202 HydrophobicContact CD1-CB 3.85Å; L141-E202 HydrophobicContact CD1-CG 3.61Å; L141-L206 HydrophobicContact CD2-CD2 4.2Å
142	E	62.8	Low	62.1	Low	133 Å²	133	48.3 Å²	48.3	62%	0.621	28%	0.279	S	S	*	.	H	α-helix	trans	-59.6	-46.7	177.6	-67.3	173.8	166.9	0	0	112.2	T140 R144 F145 E146	T140-E142 VanDerWaalsContact C-N 3.25Å; T140-E142 PolarHBondContact O-N 3.42Å; E142-R144 PolarHBondContact O-N 3.15Å; E142-F145 WeakPolarHBondContact O-CB 3.36Å; E142-F145 PolarHBondContact O-N 3.16Å; E142-E146 WeakPolarHBondContact O-CG 3.32Å; E142-E146 PolarHBondContact O-N 3.41Å
143	Q	65.6	Low	62.7	Low	44 Å²	44	51 Å²	51	21%	0.206	30%	0.295	C	S	.	.	H	α-helix	trans	-60.3	-30	176.6	-73.7	168.4	-4.7	0	0	113	Y128 P139 T140 S147	Y128-Q143 HydrophobicContact CE1-CB 4.28Å; P139-Q143 HydrophobicContact CB-CB 4.42Å; T140-Q143 PolarHBondContact O-N 2.73Å; T140-Q143 WeakPolarHBondContact OG1-CB 3.27Å; T140-Q143 WeakPolarHBondContact OG1-CG 3.17Å; T140-Q143 PolarHBondContact OG1-N 3.3Å; T140-Q143 PolarHBondContact OG1-OE1 2.77Å; Q143-S147 VanDerWaalsContact O-CB 3.28Å; Q143-S147 WeakPolarHBondContact O-CB 3.45Å; Q143-S147 PolarHBondContact O-N 3.05Å; Q143-S147 PolarHBondContact O-OG 3.11Å
144	R	65.3	Low	63.4	Low	27 Å²	27	49.1 Å²	49.1	10%	0.102	28%	0.279	C	S	.	.	H	α-helix	trans	-75.7	-27.3	175.4	-58.5	179.4	-165.9	-174.1	2.5	113.2	Y132 P139 T140 L141 E142 S147 Y148 Y191 W213	Y132-R144 WeakPolarHBondContact OH-CG 3.21Å; P139-R144 HydrophobicContact CB-CG 3.97Å; P139-R144 HydrophobicContact CG-CG 4.09Å; P139-R144 PolarHBondContact O-NE 3.03Å; P139-R144 PolarHBondContact O-NH2 2.88Å; T140-R144 WeakPolarHBondContact O-CG 3.25Å; T140-R144 PolarHBondContact O-N 3.44Å; L141-R144 WeakPolarHBondContact O-CB 3.38Å; L141-R144 PolarHBondContact O-N 2.73Å; L141-R144 VanDerWaalsContact O-N 3.16Å; E142-R144 PolarHBondContact O-N 3.15Å; R144-S147 PolarHBondContact O-OG 3.4Å; R144-Y148 PolarHBondContact O-N 3.22Å; R144-Y191 VanDerWaalsContact NH1-CB 3.25Å; R144-Y191 VanDerWaalsContact NH1-CD2 3.29Å; R144-W213 PolarHBondContact O-NE1 2.86Å
145	F	66.9	Low	64.3	Low	14 Å²	14	46.2 Å²	46.2	6%	0.061	27%	0.267	C	S	.	.	H	α-helix	trans	-77.2	-46.3	174.6	-71.2	-64.3	0	0	0	110	L141 E142 S147 Y148 Y149 F188 F205 L206 N209 I212	L141-F145 HydrophobicContact CB-CE2 4.35Å; L141-F145 HydrophobicContact CD2-CE2 4.05Å; L141-F145 WeakPolarHBondContact O-CD2 3.39Å; L141-F145 PolarHBondContact O-N 2.64Å; E142-F145 WeakPolarHBondContact O-CB 3.36Å; E142-F145 PolarHBondContact O-N 3.16Å; F145-S147 VanDerWaalsContact C-N 3.32Å; F145-S147 PolarHBondContact O-N 2.77Å; F145-Y148 WeakPolarHBondContact O-CB 3.3Å; F145-Y148 PolarHBondContact O-N 2.83Å; F145-Y149 HydrophobicContact CB-CE2 4.4Å; F145-Y149 WeakPolarHBondContact O-CD2 3.25Å; F145-Y149 PolarHBondContact O-N 3.18Å; F145-F188 HydrophobicContact CE1-CE2 4.48Å; F145-F188 HydrophobicContact CE1-CZ 4.41Å; F145-F188 HydrophobicContact CZ-CE2 4.41Å; F145-F205 AromaticContact CD2-CE1 3.87Å; F145-F205 HydrophobicContact CD2-CE1 3.87Å; F145-F205 AromaticContact CE2-CD1 3.77Å; F145-F205 HydrophobicContact CE2-CD1 3.77Å; F145-F205 AromaticContact CE2-CE1 3.43Å; F145-F205 HydrophobicContact CE2-CE1 3.43Å; F145-F205 VanDerWaalsContact CE2-CE1 3.43Å; F145-F205 HydrophobicContact CZ-CD1 4.26Å; F145-F205 HydrophobicContact CZ-CE1 4.12Å; F145-L206 HydrophobicContact CZ-CD2 4.35Å; F145-N209 HydrophobicContact CE1-CB 4.42Å; F145-I212 HydrophobicContact CD1-CB 3.96Å; F145-I212 HydrophobicContact CD1-CD1 3.27Å; F145-I212 HydrophobicContact CD1-CG1 4.14Å; F145-I212 HydrophobicContact CD1-CG2 3.39Å; F145-I212 HydrophobicContact CE1-CB 3.77Å; F145-I212 HydrophobicContact CE1-CD1 3.47Å; F145-I212 VanDerWaalsContact CE1-CD1 3.47Å; F145-I212 HydrophobicContact CE1-CG1 4.15Å; F145-I212 HydrophobicContact CE1-CG2 3.61Å; F145-I212 HydrophobicContact CG-CD1 4.31Å
146	E	67.9	Low	65.3	Low	105 Å²	105	48 Å²	48	49%	0.491	28%	0.275	S	S	.	.	H	α-helix	trans	-63.1	-38.2	176.1	-64.8	-174.4	158.1	0	0	112.6	Y128 E142 Y148 Y149 N150	Y128-E146 HydrophobicContact CE1-CB 4.4Å; Y128-E146 WeakPolarHBondContact OH-CB 3.45Å; Y128-E146 PolarHBondContact OH-OE2 3.3Å; E142-E146 WeakPolarHBondContact O-CG 3.32Å; E142-E146 PolarHBondContact O-N 3.41Å; E146-Y148 VanDerWaalsContact C-N 3.34Å; E146-Y148 PolarHBondContact O-N 3.13Å; E146-Y149 PolarHBondContact O-N 2.97Å; E146-N150 WeakPolarHBondContact O-CB 3.37Å; E146-N150 PolarHBondContact O-N 3.38Å
147	S	68.8	Low	66.4	Low	0 Å²	0	46 Å²	46	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.2	-44.4	174.3	77.6	0	0	0	0	111.1	Q143 R144 F145 N150 Y151 Q184	Q143-S147 VanDerWaalsContact O-CB 3.28Å; Q143-S147 WeakPolarHBondContact O-CB 3.45Å; Q143-S147 PolarHBondContact O-N 3.05Å; Q143-S147 PolarHBondContact O-OG 3.11Å; R144-S147 PolarHBondContact O-OG 3.4Å; F145-S147 VanDerWaalsContact C-N 3.32Å; F145-S147 PolarHBondContact O-N 2.77Å; S147-N150 WeakPolarHBondContact O-CB 3.44Å; S147-N150 PolarHBondContact O-N 2.99Å; S147-Y151 WeakPolarHBondContact O-CD2 3.43Å; S147-Y151 PolarHBondContact O-N 3.21Å; S147-Q184 PolarHBondContact OG-OE1 2.82Å
148	Y	72.1	Confident	67.3	Low	21 Å²	21	43 Å²	43	8%	0.082	22%	0.216	C	C	.	.	H	α-helix	trans	-59.6	-47.7	175.4	-179.8	-111.1	0	0	0	112.6	R144 F145 E146 N150 Y151 C152 I212 W213	R144-Y148 PolarHBondContact O-N 3.22Å; F145-Y148 WeakPolarHBondContact O-CB 3.3Å; F145-Y148 PolarHBondContact O-N 2.83Å; E146-Y148 VanDerWaalsContact C-N 3.34Å; E146-Y148 PolarHBondContact O-N 3.13Å; Y148-N150 VanDerWaalsContact C-N 3.26Å; Y148-N150 PolarHBondContact O-N 2.84Å; Y148-Y151 PolarHBondContact O-N 2.86Å; Y148-C152 WeakPolarHBondContact O-CB 3.34Å; Y148-C152 PolarHBondContact O-N 3.2Å; Y148-C152 PolarHBondContact O-SG 2.68Å; Y148-I212 HydrophobicContact CD1-CB 4.43Å; Y148-I212 HydrophobicContact CD1-CG2 3.46Å; Y148-I212 VanDerWaalsContact CD1-CG2 3.46Å; Y148-I212 HydrophobicContact CE1-CB 4.49Å; Y148-I212 HydrophobicContact CE1-CG2 3.94Å; Y148-I212 HydrophobicContact CG-CG2 3.92Å; Y148-W213 AromaticContact CD2-CD2 3.39Å; Y148-W213 HydrophobicContact CD2-CD2 3.39Å; Y148-W213 AromaticContact CD2-CE2 3.4Å; Y148-W213 VanDerWaalsContact CD2-CE2 3.4Å; Y148-W213 AromaticContact CD2-CE3 3.62Å; Y148-W213 HydrophobicContact CD2-CE3 3.62Å; Y148-W213 AromaticContact CD2-CG 3.96Å; Y148-W213 HydrophobicContact CD2-CG 3.96Å; Y148-W213 AromaticContact CD2-CH2 3.93Å; Y148-W213 HydrophobicContact CD2-CH2 3.93Å; Y148-W213 AromaticContact CD2-CZ2 3.69Å; Y148-W213 HydrophobicContact CD2-CZ2 3.69Å; Y148-W213 AromaticContact CD2-CZ3 3.9Å; Y148-W213 HydrophobicContact CD2-CZ3 3.9Å; Y148-W213 AromaticContact CD2-NE1 3.88Å; Y148-W213 AromaticContact CE2-CD2 3.92Å; Y148-W213 HydrophobicContact CE2-CD2 3.92Å; Y148-W213 AromaticContact CE2-CE3 3.85Å; Y148-W213 HydrophobicContact CE2-CE3 3.85Å; Y148-W213 HydrophobicContact CE2-CG 4.34Å; Y148-W213 HydrophobicContact CE2-CZ3 4.29Å; Y148-W213 HydrophobicContact CG-CD2 4.14Å; Y148-W213 AromaticContact CG-CE2 3.84Å; Y148-W213 HydrophobicContact CG-CG 4.39Å; Y148-W213 HydrophobicContact CG-CZ2 4.22Å; Y148-W213 AromaticContact CG-NE1 3.86Å
149	Y	71.6	Confident	67.8	Low	119 Å²	119	42.8 Å²	42.8	47%	0.467	21%	0.206	S	C	.	.	H	α-helix	trans	-61.7	-37	176.7	-72.7	-62.2	0	0	0	111.6	F145 E146 C152 N153 I212	F145-Y149 HydrophobicContact CB-CE2 4.4Å; F145-Y149 WeakPolarHBondContact O-CD2 3.25Å; F145-Y149 PolarHBondContact O-N 3.18Å; E146-Y149 PolarHBondContact O-N 2.97Å; Y149-C152 PolarHBondContact O-N 3.22Å; Y149-N153 WeakPolarHBondContact O-CB 3.3Å; Y149-N153 PolarHBondContact O-N 3.31Å; Y149-N153 PolarHBondContact O-ND2 3.47Å; Y149-I212 HydrophobicContact CE2-CD1 4.29Å; Y149-I212 WeakPolarHBondContact OH-CD1 3.45Å
150	N	73.4	Confident	68	Low	8 Å²	8	47.6 Å²	47.6	4%	0.043	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-43.7	175.5	-167.2	51.7	0	0	0	112.3	I121 K124 E125 Y128 E146 S147 Y148 N153 L154	I121-N150 WeakPolarHBondContact CA-OD1 3.44Å; I121-N150 PolarHBondContact O-ND2 3.21Å; K124-N150 WeakPolarHBondContact CB-ND2 3.37Å; E125-N150 PolarHBondContact N-ND2 2.92Å; Y128-N150 HydrophobicContact CE2-CB 4.31Å; E146-N150 WeakPolarHBondContact O-CB 3.37Å; E146-N150 PolarHBondContact O-N 3.38Å; S147-N150 WeakPolarHBondContact O-CB 3.44Å; S147-N150 PolarHBondContact O-N 2.99Å; Y148-N150 VanDerWaalsContact C-N 3.26Å; Y148-N150 PolarHBondContact O-N 2.84Å; N150-N153 PolarHBondContact O-N 2.8Å; N150-L154 WeakPolarHBondContact O-CB 3.49Å; N150-L154 PolarHBondContact O-N 3.18Å
151	Y	71.6	Confident	67.9	Low	1 Å²	1	45.5 Å²	45.5	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-42.1	173.2	-76.2	-70	0	0	0	111.9	E125 S147 Y148 N153 L154 F155 I177 E180 F181 Q184	E125-Y151 HydrophobicContact CG-CE1 3.76Å; E125-Y151 WeakPolarHBondContact CG-OH 3.5Å; S147-Y151 WeakPolarHBondContact O-CD2 3.43Å; S147-Y151 PolarHBondContact O-N 3.21Å; Y148-Y151 PolarHBondContact O-N 2.86Å; Y151-N153 VanDerWaalsContact C-N 3.3Å; Y151-N153 PolarHBondContact O-N 3.29Å; Y151-L154 PolarHBondContact O-N 2.95Å; Y151-F155 HydrophobicContact CD1-CE2 4.23Å; Y151-F155 WeakPolarHBondContact O-CB 3.44Å; Y151-F155 WeakPolarHBondContact O-CD2 3.19Å; Y151-F155 WeakPolarHBondContact O-CG 3.36Å; Y151-F155 PolarHBondContact O-N 3.23Å; Y151-I177 HydrophobicContact CD1-CG2 4.24Å; Y151-I177 HydrophobicContact CE1-CG2 3.92Å; Y151-E180 VanDerWaalsContact OH-CG 3.3Å; Y151-E180 WeakPolarHBondContact OH-CG 3.32Å; Y151-F181 HydrophobicContact CD1-CB 4.4Å; Y151-F181 HydrophobicContact CD1-CD2 4.15Å; Y151-F181 HydrophobicContact CD2-CD2 4.17Å; Y151-F181 HydrophobicContact CE1-CB 4.46Å; Y151-F181 AromaticContact CG-CD2 3.78Å; Y151-F181 HydrophobicContact CG-CD2 3.78Å; Y151-F181 HydrophobicContact CG-CE2 4.41Å; Y151-Q184 VanDerWaalsContact CE2-OE1 3.23Å; Y151-Q184 PolarHBondContact OH-NE2 3.41Å
152	C	70.9	Confident	67	Low	24 Å²	24	52.7 Å²	52.7	16%	0.162	26%	0.26	C	S	.	.	H	α-helix	trans	-60.2	-40.4	174	-74.6	0	0	0	0	111.9	Y148 Y149 N156	Y148-C152 WeakPolarHBondContact O-CB 3.34Å; Y148-C152 PolarHBondContact O-N 3.2Å; Y148-C152 PolarHBondContact O-SG 2.68Å; Y149-C152 PolarHBondContact O-N 3.22Å; C152-N156 WeakPolarHBondContact O-CB 3.19Å; C152-N156 PolarHBondContact O-N 2.85Å; C152-N156 PolarHBondContact O-ND2 3.27Å; C152-N156 VanDerWaalsContact O-ND2 3.14Å
153	N	70.1	Confident	66.4	Low	86 Å²	86	47.6 Å²	47.6	46%	0.46	24%	0.244	S	C	.	.	H	α-helix	trans	-65.5	-42.8	175.5	-70.6	-18.5	0	0	0	111.7	I121 Y149 N150 Y151 N156 Y157	I121-N153 HydrophobicContact CD1-CB 4.27Å; Y149-N153 WeakPolarHBondContact O-CB 3.3Å; Y149-N153 PolarHBondContact O-N 3.31Å; Y149-N153 PolarHBondContact O-ND2 3.47Å; N150-N153 PolarHBondContact O-N 2.8Å; Y151-N153 VanDerWaalsContact C-N 3.3Å; Y151-N153 PolarHBondContact O-N 3.29Å; N153-N156 PolarHBondContact O-N 3.43Å; N153-Y157 WeakPolarHBondContact O-CB 3.49Å; N153-Y157 PolarHBondContact O-N 3.4Å
154	L	72.6	Confident	65.8	Low	3 Å²	3	46.8 Å²	46.8	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-60.7	-49.3	175	-176.1	65	0	0	0	111.5	I121 L122 N150 Y151 Y157 I158 I177	I121-L154 HydrophobicContact CG2-CB 3.62Å; I121-L154 HydrophobicContact CG2-CD1 3.72Å; I121-L154 HydrophobicContact CG2-CG 4.17Å; L122-L154 HydrophobicContact CD2-CD1 4.26Å; N150-L154 WeakPolarHBondContact O-CB 3.49Å; N150-L154 PolarHBondContact O-N 3.18Å; Y151-L154 PolarHBondContact O-N 2.95Å; L154-Y157 WeakPolarHBondContact O-CB 3.31Å; L154-Y157 PolarHBondContact O-N 2.92Å; L154-I158 HydrophobicContact CD1-CD1 4.23Å; L154-I158 HydrophobicContact CG-CD1 4.06Å; L154-I158 VanDerWaalsContact O-CG1 3.3Å; L154-I158 WeakPolarHBondContact O-CG1 3.26Å; L154-I158 PolarHBondContact O-N 3.44Å; L154-I177 HydrophobicContact CD2-CD1 4.1Å; L154-I177 HydrophobicContact CD2-CG2 3.82Å
155	F	70.9	Confident	65.4	Low	3 Å²	3	45.9 Å²	45.9	1%	0.013	24%	0.24	C	C	.	.	H	α-helix	trans	-68	-37.7	179.6	-67.5	-55.3	0	0	0	112	Y151 Y157 I158 L159 I177 I178 F181 V221 L225	Y151-F155 HydrophobicContact CD1-CE2 4.23Å; Y151-F155 WeakPolarHBondContact O-CB 3.44Å; Y151-F155 WeakPolarHBondContact O-CD2 3.19Å; Y151-F155 WeakPolarHBondContact O-CG 3.36Å; Y151-F155 PolarHBondContact O-N 3.23Å; F155-Y157 VanDerWaalsContact C-N 3.33Å; F155-Y157 PolarHBondContact O-N 3.15Å; F155-I158 PolarHBondContact O-N 3.28Å; F155-L159 HydrophobicContact CB-CD1 4.28Å; F155-L159 WeakPolarHBondContact O-CB 3.47Å; F155-L159 WeakPolarHBondContact O-CG 3.27Å; F155-L159 PolarHBondContact O-N 3.43Å; F155-I177 HydrophobicContact CZ-CG2 4.42Å; F155-I178 HydrophobicContact CE1-CD1 3.92Å; F155-I178 HydrophobicContact CZ-CD1 4.01Å; F155-F181 HydrophobicContact CE2-CD1 4.02Å; F155-F181 AromaticContact CE2-CD2 3.82Å; F155-F181 HydrophobicContact CE2-CD2 3.82Å; F155-F181 HydrophobicContact CE2-CE1 4.07Å; F155-F181 AromaticContact CE2-CE2 3.9Å; F155-F181 HydrophobicContact CE2-CE2 3.9Å; F155-F181 AromaticContact CE2-CG 3.89Å; F155-F181 HydrophobicContact CE2-CG 3.89Å; F155-F181 HydrophobicContact CE2-CZ 4.01Å; F155-F181 HydrophobicContact CZ-CD1 4.26Å; F155-F181 HydrophobicContact CZ-CG 4.23Å; F155-V221 HydrophobicContact CB-CG1 3.94Å; F155-V221 HydrophobicContact CD1-CG1 4Å; F155-V221 HydrophobicContact CD2-CG1 3.68Å; F155-V221 HydrophobicContact CE1-CG1 4.45Å; F155-V221 HydrophobicContact CE2-CG1 4.17Å; F155-V221 HydrophobicContact CG-CG1 3.6Å; F155-L225 HydrophobicContact CD1-CD1 3.92Å; F155-L225 HydrophobicContact CE1-CD1 3.91Å
156	N	72.1	Confident	64.9	Low	80 Å²	80	46.4 Å²	46.4	43%	0.428	25%	0.245	S	C	.	.	H	α-helix	trans	-63.9	-38.7	173.3	-75.8	-25.9	0	0	0	111.6	C152 N153 I158 L159 N160	C152-N156 WeakPolarHBondContact O-CB 3.19Å; C152-N156 PolarHBondContact O-N 2.85Å; C152-N156 PolarHBondContact O-ND2 3.27Å; C152-N156 VanDerWaalsContact O-ND2 3.14Å; N153-N156 PolarHBondContact O-N 3.43Å; N156-I158 VanDerWaalsContact C-N 3.31Å; N156-I158 PolarHBondContact O-N 3.4Å; N156-L159 PolarHBondContact O-N 3.03Å; N156-N160 WeakPolarHBondContact O-CA 3.44Å; N156-N160 VanDerWaalsContact O-CB 3.26Å; N156-N160 WeakPolarHBondContact O-CB 3.48Å; N156-N160 PolarHBondContact O-N 3.04Å
157	Y	67.7	Low	64.5	Low	82 Å²	82	41.6 Å²	41.6	32%	0.322	22%	0.223	S	C	.	.	H	α-helix	trans	-61.8	-40.1	174.2	-177.8	-102.2	0	0	0	111.6	V118 N153 L154 F155 A161	V118-Y157 HydrophobicContact CG1-CE1 4.35Å; V118-Y157 HydrophobicContact CG2-CE1 3.81Å; V118-Y157 HydrophobicContact CG2-CE2 3.92Å; V118-Y157 VanDerWaalsContact CG2-CZ 3.45Å; V118-Y157 WeakPolarHBondContact CG2-OH 3.35Å; N153-Y157 WeakPolarHBondContact O-CB 3.49Å; N153-Y157 PolarHBondContact O-N 3.4Å; L154-Y157 WeakPolarHBondContact O-CB 3.31Å; L154-Y157 PolarHBondContact O-N 2.92Å; F155-Y157 VanDerWaalsContact C-N 3.33Å; F155-Y157 PolarHBondContact O-N 3.15Å; Y157-A161 WeakPolarHBondContact O-CB 3.46Å
158	I	67.1	Low	64.1	Low	8 Å²	8	42.8 Å²	42.8	4%	0.041	23%	0.228	C	C	.	.	H	α-helix	trans	-75.9	-36.3	178.7	-64.1	165.9	0	0	0	112.2	L154 F155 N156 L225 K228 Y257 L260	L154-I158 HydrophobicContact CD1-CD1 4.23Å; L154-I158 HydrophobicContact CG-CD1 4.06Å; L154-I158 VanDerWaalsContact O-CG1 3.3Å; L154-I158 WeakPolarHBondContact O-CG1 3.26Å; L154-I158 PolarHBondContact O-N 3.44Å; F155-I158 PolarHBondContact O-N 3.28Å; N156-I158 VanDerWaalsContact C-N 3.31Å; N156-I158 PolarHBondContact O-N 3.4Å; I158-L225 HydrophobicContact CG2-CD2 4.26Å; I158-K228 PolarHBondContact O-NZ 3.25Å; I158-Y257 HydrophobicContact CG2-CE1 3.72Å; I158-Y257 PolarHBondContact O-OH 2.91Å; I158-Y257 VanDerWaalsContact O-OH 3.13Å; I158-L260 HydrophobicContact CD1-CD2 4.47Å; I158-L260 HydrophobicContact CG2-CD2 3.83Å
159	L	63.9	Low	63.8	Low	28 Å²	28	42.3 Å²	42.3	15%	0.147	23%	0.227	C	C	.	.	H	α-helix	trans	-88.8	-33.2	-173	-71	171.4	0	0	0	113.8	F155 N156 L225 K228	F155-L159 HydrophobicContact CB-CD1 4.28Å; F155-L159 WeakPolarHBondContact O-CB 3.47Å; F155-L159 WeakPolarHBondContact O-CG 3.27Å; F155-L159 PolarHBondContact O-N 3.43Å; N156-L159 PolarHBondContact O-N 3.03Å; L159-L225 HydrophobicContact CD2-CD2 3.62Å; L159-L225 HydrophobicContact CD2-CG 4.05Å; L159-L225 HydrophobicContact CG-CD2 4.04Å; L159-K228 VanDerWaalsContact C-NZ 3.3Å; L159-K228 HydrophobicContact CD2-CD 4.15Å; L159-K228 PolarHBondContact O-NZ 3.02Å
160	N	63.2	Low	63.6	Low	116 Å²	116	36.7 Å²	36.7	62%	0.62	21%	0.205	S	C	*	.	S	Bend	trans	-104.4	6.9	-175.6	-60.9	-25.7	0	0	0	114.1	N156 D162	N156-N160 WeakPolarHBondContact O-CA 3.44Å; N156-N160 VanDerWaalsContact O-CB 3.26Å; N156-N160 WeakPolarHBondContact O-CB 3.48Å; N156-N160 PolarHBondContact O-N 3.04Å; N160-D162 PolarHBondContact O-N 3.23Å
161	A	58.3	Low	63.3	Low	30 Å²	30	38 Å²	38	25%	0.248	21%	0.212	C	C	.	.			trans	-66	130.7	172.7	0	0	0	0	0	111.5	Y157 G163 Y251	Y157-A161 WeakPolarHBondContact O-CB 3.46Å; A161-G163 WeakPolarHBondContact CB-O 3.32Å; A161-G163 PolarHBondContact O-N 2.99Å; A161-Y251 PolarHBondContact O-OH 3.28Å
162	D	43.3	Very low	63.1	Low	175 Å²	175	39.7 Å²	39.7	94%	0.936	22%	0.22	S	C	*	.	S	Bend	trans	-65.6	1.4	177.9	-73.5	-37	0	0	0	114.1	N160	N160-D162 PolarHBondContact O-N 3.23Å
163	G	51.5	Low	63.2	Low	26 Å²	26	38.6 Å²	38.6	27%	0.268	21%	0.213	S	C	.	.	S	Bend	trans	-158.6	177.4	173.8	0	0	0	0	0	110.6	A161 A165 Y251	A161-G163 WeakPolarHBondContact CB-O 3.32Å; A161-G163 PolarHBondContact O-N 2.99Å; G163-A165 PolarHBondContact O-N 3.4Å; G163-A165 VanDerWaalsContact O-N 3.17Å; G163-Y251 VanDerWaalsContact C-CE1 3.49Å
164	P	53.3	Low	63.2	Low	27 Å²	27	34.7 Å²	34.7	18%	0.175	19%	0.192	C	C	.	.			trans	-55.8	123.3	174.5	-19.7	30.5	0	0	0	109.4	L65 Y251 H254 Y257	L65-P164 HydrophobicContact CD2-CB 4.05Å; L65-P164 HydrophobicContact CD2-CG 4.09Å; P164-Y251 HydrophobicContact CB-CD1 4.47Å; P164-Y251 HydrophobicContact CG-CD1 4.41Å; P164-Y251 HydrophobicContact CG-CE1 4.43Å; P164-H254 VanDerWaalsContact CB-CD2 3.47Å; P164-H254 WeakPolarHBondContact CB-CD2 3.47Å; P164-H254 WeakPolarHBondContact CB-NE2 3.37Å; P164-H254 WeakPolarHBondContact CG-NE2 3.34Å; P164-Y257 HydrophobicContact CB-CE2 4.39Å
165	A	56.9	Low	63.3	Low	8 Å²	8	34.8 Å²	34.8	7%	0.066	19%	0.192	C	C	.	.			trans	-57.8	128.7	177.8	0	0	0	0	0	108.4	G163 L167 Y257	G163-A165 PolarHBondContact O-N 3.4Å; G163-A165 VanDerWaalsContact O-N 3.17Å; A165-L167 PolarHBondContact O-N 3.49Å; A165-Y257 WeakPolarHBondContact CB-OH 3.41Å; A165-Y257 PolarHBondContact N-OH 2.82Å
166	P	54.9	Low	63.5	Low	24 Å²	24	34.9 Å²	34.9	16%	0.156	19%	0.193	C	C	.	.	S	Bend	trans	-75.9	43	-179.9	33.5	-37.3	0	0	0	111.1	I58 K61 V62 L65	I58-P166 HydrophobicContact CG2-CG 4.2Å; K61-P166 HydrophobicContact CB-CB 3.99Å; V62-P166 HydrophobicContact CG2-CB 3.54Å; V62-P166 HydrophobicContact CG2-CG 3.77Å; L65-P166 HydrophobicContact CD1-CB 3.95Å
167	L	60.3	Low	63.7	Low	5 Å²	5	31.4 Å²	31.4	3%	0.026	17%	0.174	C	C	.	.			trans	-117	127.3	178.8	-169.3	69.8	0	0	0	107.1	I58 V118 A165 L169 L256	I58-L167 HydrophobicContact CG1-CD1 4.35Å; V118-L167 HydrophobicContact CG1-CD1 4.3Å; A165-L167 PolarHBondContact O-N 3.49Å; L167-L169 HydrophobicContact CD1-CD2 4.03Å; L167-L169 HydrophobicContact CD1-CG 4.41Å; L167-L169 HydrophobicContact CD2-CD1 4Å; L167-L169 HydrophobicContact CD2-CD2 4.39Å; L167-L169 HydrophobicContact CD2-CG 4.02Å; L167-L169 HydrophobicContact CG-CD2 4.16Å; L167-L169 HydrophobicContact CG-CG 3.98Å; L167-L256 VanDerWaalsContact O-CD1 3.32Å; L167-L256 WeakPolarHBondContact O-CD1 3.24Å
168	E	59.8	Low	64.2	Low	25 Å²	25	27.5 Å²	27.5	12%	0.117	16%	0.158	C	C	.	.			trans	-125.2	117.3	162.7	-80.1	-167.8	179.9	0	0	108.5	L57 K61 I75 I79 L256	L57-E168 HydrophobicContact CD2-CB 4.44Å; L57-E168 WeakPolarHBondContact CD2-O 3.2Å; K61-E168 HydrophobicContact CD-CG 4.06Å; K61-E168 WeakPolarHBondContact CE-OE1 3.37Å; K61-E168 WeakPolarHBondContact CE-OE2 3.18Å; K61-E168 IonicContact NZ-OE1 2.75Å; K61-E168 PolarHBondContact NZ-OE1 3.45Å; K61-E168 IonicContact NZ-OE2 3.13Å; K61-E168 PolarHBondContact NZ-OE2 2.88Å; I75-E168 VanDerWaalsContact CG2-OE2 3.25Å; I75-E168 WeakPolarHBondContact CG2-OE2 3.24Å; I79-E168 HydrophobicContact CD1-CB 4.08Å; E168-L256 HydrophobicContact CG-CB 4.38Å
169	L	65.6	Low	64.6	Low	10 Å²	10	28.4 Å²	28.4	5%	0.052	16%	0.163	C	C	.	.			trans	-105.5	152.7	176.7	-62.4	179.7	0	0	0	110	L122 L167 N171 W173 L174 I177 L256	L122-L169 HydrophobicContact CD1-CD2 4.39Å; L122-L169 HydrophobicContact CD2-CD1 4.01Å; L167-L169 HydrophobicContact CD1-CD2 4.03Å; L167-L169 HydrophobicContact CD1-CG 4.41Å; L167-L169 HydrophobicContact CD2-CD1 4Å; L167-L169 HydrophobicContact CD2-CD2 4.39Å; L167-L169 HydrophobicContact CD2-CG 4.02Å; L167-L169 HydrophobicContact CG-CD2 4.16Å; L167-L169 HydrophobicContact CG-CG 3.98Å; L169-N171 PolarHBondContact O-N 2.98Å; L169-W173 HydrophobicContact CD2-CE3 3.9Å; L169-W173 HydrophobicContact CD2-CH2 4.4Å; L169-W173 HydrophobicContact CD2-CZ3 3.75Å; L169-L174 HydrophobicContact CB-CD2 3.87Å; L169-L174 HydrophobicContact CB-CG 3.95Å; L169-L174 HydrophobicContact CD1-CD2 4.02Å; L169-L174 HydrophobicContact CG-CD2 4.42Å; L169-I177 HydrophobicContact CD1-CD1 3.95Å; L169-L256 HydrophobicContact CB-CD1 4.49Å
170	P	68.3	Low	65.1	Low	2 Å²	2	28 Å²	28	1%	0.013	16%	0.161	C	C	.	.			trans	-53.7	140.4	171.3	-21.2	29.4	0	0	0	112	I79 I82 Q83 Q172 W173 L174	I79-P170 HydrophobicContact CG2-CB 3.99Å; I79-P170 HydrophobicContact CG2-CG 3.88Å; I82-P170 HydrophobicContact CB-CG 4.23Å; I82-P170 HydrophobicContact CG2-CG 3.8Å; Q83-P170 HydrophobicContact CB-CB 4.27Å; Q83-P170 HydrophobicContact CB-CG 4.18Å; P170-Q172 PolarHBondContact O-N 3.4Å; P170-Q172 VanDerWaalsContact O-N 3.13Å; P170-W173 HydrophobicContact CB-CB 4.41Å; P170-W173 PolarHBondContact O-N 2.94Å; P170-L174 PolarHBondContact O-N 3.29Å
171	N	66.5	Low	65.7	Low	35 Å²	35	22.6 Å²	22.6	19%	0.187	13%	0.132	C	C	.	.	H	α-helix	trans	-56	-33.8	-179.3	-64.4	-34.9	0	0	0	113.2	L169 W175 M259 F263 V299	L169-N171 PolarHBondContact O-N 2.98Å; N171-W175 PolarHBondContact O-N 2.85Å; N171-W175 VanDerWaalsContact O-N 3.08Å; N171-M259 WeakPolarHBondContact OD1-CG 3.32Å; N171-F263 HydrophobicContact CB-CZ 4.33Å; N171-F263 VanDerWaalsContact O-CE2 3.26Å; N171-F263 WeakPolarHBondContact O-CE2 3.08Å; N171-F263 WeakPolarHBondContact O-CZ 3.37Å; N171-V299 HydrophobicContact CB-CG2 4.05Å
172	Q	68.7	Low	66.6	Low	37 Å²	37	21.3 Å²	21.3	17%	0.173	12%	0.121	C	C	.	.	H	α-helix	trans	-69.3	-40	176.6	-65.9	174.7	-7.6	0	0	112.1	Q83 E87 P170 W175 D176 V299	Q83-Q172 VanDerWaalsContact NE2-CD 3.29Å; Q83-Q172 VanDerWaalsContact NE2-NE2 3.11Å; E87-Q172 PolarHBondContact OE1-OE1 3.4Å; E87-Q172 PolarHBondContact OE2-OE1 2.73Å; P170-Q172 PolarHBondContact O-N 3.4Å; P170-Q172 VanDerWaalsContact O-N 3.13Å; Q172-W175 PolarHBondContact O-N 3.16Å; Q172-D176 WeakPolarHBondContact O-CB 3.27Å; Q172-D176 VanDerWaalsContact O-CG 3.31Å; Q172-D176 PolarHBondContact O-N 3.11Å; Q172-V299 HydrophobicContact CG-CG1 4.49Å; Q172-V299 HydrophobicContact CG-CG2 4.1Å
173	W	71.6	Confident	68.2	Low	1 Å²	1	17.7 Å²	17.7	0%	0.004	10%	0.095	C	C	.	.	H	α-helix	trans	-66.9	-46.9	176.7	-168.5	-1.4	0	0	0	109.5	F50 I82 Y86 L122 E125 L126 L169 P170 W175 D176 I177	F50-W173 HydrophobicContact CE1-CH2 4.38Å; F50-W173 HydrophobicContact CE2-CZ3 4.47Å; F50-W173 AromaticContact CZ-CH2 3.65Å; F50-W173 HydrophobicContact CZ-CH2 3.65Å; F50-W173 AromaticContact CZ-CZ3 3.92Å; F50-W173 HydrophobicContact CZ-CZ3 3.92Å; I82-W173 HydrophobicContact CG2-CE3 3.96Å; I82-W173 HydrophobicContact CG2-CZ3 3.83Å; Y86-W173 AromaticContact CD2-CD2 3.97Å; Y86-W173 HydrophobicContact CD2-CD2 3.97Å; Y86-W173 HydrophobicContact CD2-CE3 4.27Å; Y86-W173 HydrophobicContact CD2-CG 4.21Å; Y86-W173 HydrophobicContact CE1-CB 4.44Å; Y86-W173 HydrophobicContact CE1-CG 4.45Å; Y86-W173 HydrophobicContact CE2-CB 4.41Å; Y86-W173 AromaticContact CE2-CD1 3.53Å; Y86-W173 AromaticContact CE2-CD2 3.68Å; Y86-W173 HydrophobicContact CE2-CD2 3.68Å; Y86-W173 AromaticContact CE2-CE2 3.66Å; Y86-W173 HydrophobicContact CE2-CE3 4.44Å; Y86-W173 AromaticContact CE2-CG 3.63Å; Y86-W173 HydrophobicContact CE2-CG 3.63Å; Y86-W173 HydrophobicContact CE2-CZ2 4.39Å; Y86-W173 AromaticContact CE2-NE1 3.57Å; Y86-W173 AromaticContact CZ-CD1 3.55Å; Y86-W173 AromaticContact CZ-CG 3.75Å; L122-W173 HydrophobicContact CB-CH2 4.04Å; L122-W173 HydrophobicContact CB-CZ2 4.03Å; L122-W173 HydrophobicContact CD1-CH2 4.08Å; L122-W173 HydrophobicContact CD2-CH2 4.1Å; L122-W173 HydrophobicContact CD2-CZ2 3.86Å; L122-W173 HydrophobicContact CG-CH2 4.3Å; L122-W173 HydrophobicContact CG-CZ2 4.38Å; E125-W173 PolarHBondContact OE1-NE1 2.93Å; L126-W173 HydrophobicContact CD1-CZ2 4.36Å; L126-W173 HydrophobicContact CG-CZ2 4.34Å; L169-W173 HydrophobicContact CD2-CE3 3.9Å; L169-W173 HydrophobicContact CD2-CH2 4.4Å; L169-W173 HydrophobicContact CD2-CZ3 3.75Å; P170-W173 HydrophobicContact CB-CB 4.41Å; P170-W173 PolarHBondContact O-N 2.94Å; W173-W175 VanDerWaalsContact C-N 3.27Å; W173-W175 PolarHBondContact O-N 3.04Å; W173-D176 CarbonylContact O-C 3.14Å; W173-D176 WeakPolarHBondContact O-CA 3.44Å; W173-D176 WeakPolarHBondContact O-CB 3.39Å; W173-D176 PolarHBondContact O-N 3.39Å; W173-I177 WeakPolarHBondContact O-CG1 3.49Å; W173-I177 PolarHBondContact O-N 3.47Å
174	L	71.7	Confident	69.1	Low	4 Å²	4	16.5 Å²	16.5	2%	0.021	8%	0.082	C	C	.	.	H	α-helix	trans	-53.9	-42.3	174.9	-68.9	176.7	0	0	0	113.2	L169 P170 I177 I178 L256 M259 F263	L169-L174 HydrophobicContact CB-CD2 3.87Å; L169-L174 HydrophobicContact CB-CG 3.95Å; L169-L174 HydrophobicContact CD1-CD2 4.02Å; L169-L174 HydrophobicContact CG-CD2 4.42Å; P170-L174 PolarHBondContact O-N 3.29Å; L174-I177 PolarHBondContact O-N 3.45Å; L174-I178 PolarHBondContact O-N 3Å; L174-L256 HydrophobicContact CD1-CD1 4.1Å; L174-L256 HydrophobicContact CD1-CG 4.25Å; L174-L256 HydrophobicContact CD2-CD1 3.88Å; L174-L256 HydrophobicContact CD2-CG 4.47Å; L174-M259 HydrophobicContact CD1-CB 4.41Å; L174-F263 HydrophobicContact CB-CD2 3.94Å; L174-F263 HydrophobicContact CB-CE2 3.88Å
175	W	74	Confident	70	Confident	5 Å²	5	15.4 Å²	15.4	2%	0.019	7%	0.074	C	C	.	.	H	α-helix	trans	-61.7	-48.4	172.8	170.5	-104.9	0	0	0	111.5	N171 Q172 W173 I177 I178 D179 F263 V266 V299 C302 T305	N171-W175 PolarHBondContact O-N 2.85Å; N171-W175 VanDerWaalsContact O-N 3.08Å; Q172-W175 PolarHBondContact O-N 3.16Å; W173-W175 VanDerWaalsContact C-N 3.27Å; W173-W175 PolarHBondContact O-N 3.04Å; W175-I177 VanDerWaalsContact C-N 3.3Å; W175-I177 PolarHBondContact O-N 3.3Å; W175-I178 PolarHBondContact O-N 3.14Å; W175-D179 HydrophobicContact CZ2-CB 4.28Å; W175-D179 WeakPolarHBondContact O-CB 3.4Å; W175-D179 PolarHBondContact O-N 2.87Å; W175-F263 HydrophobicContact CB-CD1 4.25Å; W175-F263 HydrophobicContact CB-CD2 4.41Å; W175-F263 HydrophobicContact CB-CE1 4.09Å; W175-F263 HydrophobicContact CB-CE2 4.26Å; W175-F263 HydrophobicContact CB-CG 4.41Å; W175-F263 HydrophobicContact CB-CZ 4.1Å; W175-F263 HydrophobicContact CD2-CD1 4.32Å; W175-F263 HydrophobicContact CE3-CB 4.1Å; W175-F263 AromaticContact CE3-CD1 3.47Å; W175-F263 HydrophobicContact CE3-CD1 3.47Å; W175-F263 VanDerWaalsContact CE3-CD1 3.47Å; W175-F263 HydrophobicContact CE3-CE1 4.14Å; W175-F263 AromaticContact CE3-CG 3.97Å; W175-F263 HydrophobicContact CE3-CG 3.97Å; W175-F263 HydrophobicContact CZ3-CD1 4.23Å; W175-V266 HydrophobicContact CH2-CB 4.41Å; W175-V266 HydrophobicContact CH2-CG1 3.54Å; W175-V266 HydrophobicContact CZ3-CB 3.94Å; W175-V266 HydrophobicContact CZ3-CG1 3.56Å; W175-V299 HydrophobicContact CG-CG1 4.45Å; W175-C302 HydrophobicContact CD2-CB 3.75Å; W175-C302 HydrophobicContact CE3-CB 3.8Å; W175-C302 HydrophobicContact CG-CB 4.34Å; W175-C302 HydrophobicContact CH2-CB 4.21Å; W175-C302 HydrophobicContact CZ2-CB 4.18Å; W175-C302 HydrophobicContact CZ3-CB 4.03Å; W175-T305 HydrophobicContact CH2-CG2 4.14Å; W175-T305 HydrophobicContact CZ2-CG2 4.1Å
176	D	74.3	Confident	70.7	Confident	5 Å²	5	15.8 Å²	15.8	3%	0.027	8%	0.075	C	C	.	.	H	α-helix	trans	-58.7	-37.9	178	-75.7	-22.9	0	0	0	112.1	Y86 R129 Q172 W173 E180 K347	Y86-D176 WeakPolarHBondContact CE1-OD2 3.1Å; Y86-D176 WeakPolarHBondContact OH-CB 3.48Å; Y86-D176 PolarHBondContact OH-OD2 2.77Å; R129-D176 IonicContact CZ-OD1 3.03Å; R129-D176 IonicContact CZ-OD2 3.78Å; R129-D176 VanDerWaalsContact CZ-OD2 3.27Å; R129-D176 IonicContact NH1-OD2 3.06Å; R129-D176 PolarHBondContact NH1-OD2 2.88Å; R129-D176 IonicContact NH2-OD1 2.67Å; R129-D176 PolarHBondContact NH2-OD1 2.99Å; R129-D176 IonicContact NH2-OD2 3.95Å; R129-D176 PolarHBondContact NH2-OD2 3.33Å; Q172-D176 WeakPolarHBondContact O-CB 3.27Å; Q172-D176 VanDerWaalsContact O-CG 3.31Å; Q172-D176 PolarHBondContact O-N 3.11Å; W173-D176 CarbonylContact O-C 3.14Å; W173-D176 WeakPolarHBondContact O-CA 3.44Å; W173-D176 WeakPolarHBondContact O-CB 3.39Å; W173-D176 PolarHBondContact O-N 3.39Å; D176-E180 WeakPolarHBondContact O-CB 3.48Å; D176-E180 PolarHBondContact O-N 3.26Å; D176-K347 IonicContact OD2-NZ 3.56Å
177	I	76.5	Confident	71.4	Confident	6 Å²	6	15.7 Å²	15.7	3%	0.031	8%	0.075	C	C	.	.	H	α-helix	trans	-59.5	-50.7	175.9	-48.4	-162.8	0	0	0	110.4	E125 Y151 L154 F155 L169 W173 L174 W175 F181	E125-I177 WeakPolarHBondContact OE1-CG1 3.25Å; E125-I177 VanDerWaalsContact OE2-CD1 3.29Å; E125-I177 WeakPolarHBondContact OE2-CD1 3.46Å; Y151-I177 HydrophobicContact CD1-CG2 4.24Å; Y151-I177 HydrophobicContact CE1-CG2 3.92Å; L154-I177 HydrophobicContact CD2-CD1 4.1Å; L154-I177 HydrophobicContact CD2-CG2 3.82Å; F155-I177 HydrophobicContact CZ-CG2 4.42Å; L169-I177 HydrophobicContact CD1-CD1 3.95Å; W173-I177 WeakPolarHBondContact O-CG1 3.49Å; W173-I177 PolarHBondContact O-N 3.47Å; L174-I177 PolarHBondContact O-N 3.45Å; W175-I177 VanDerWaalsContact C-N 3.3Å; W175-I177 PolarHBondContact O-N 3.3Å; I177-F181 VanDerWaalsContact O-CB 3.23Å; I177-F181 WeakPolarHBondContact O-CB 3.48Å; I177-F181 PolarHBondContact O-N 2.88Å
178	I	77.6	Confident	71.9	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-68.7	-42.9	-177.9	-63.7	-62.8	0	0	0	110.8	F155 L174 W175 F181 I182 L222 L225 L260 F263	F155-I178 HydrophobicContact CE1-CD1 3.92Å; F155-I178 HydrophobicContact CZ-CD1 4.01Å; L174-I178 PolarHBondContact O-N 3Å; W175-I178 PolarHBondContact O-N 3.14Å; I178-F181 PolarHBondContact O-N 3.17Å; I178-I182 HydrophobicContact CG2-CD1 3.98Å; I178-I182 VanDerWaalsContact O-CG1 3.31Å; I178-I182 WeakPolarHBondContact O-CG1 3.27Å; I178-I182 PolarHBondContact O-N 2.94Å; I178-I182 VanDerWaalsContact O-N 3.08Å; I178-L222 HydrophobicContact CD1-CD2 4.48Å; I178-L222 HydrophobicContact CG2-CD2 4.5Å; I178-L225 HydrophobicContact CD1-CD1 4.38Å; I178-L260 HydrophobicContact CD1-CD1 3.94Å; I178-L260 HydrophobicContact CG1-CD1 4.04Å; I178-F263 HydrophobicContact CG1-CB 4.24Å
179	D	75.5	Confident	72.2	Confident	27 Å²	27	15.1 Å²	15.1	14%	0.144	7%	0.073	C	C	.	.	H	α-helix	trans	-66.5	-40.9	-179.2	-164.8	62	0	0	0	111.9	W175 I182 Y183 R270	W175-D179 HydrophobicContact CZ2-CB 4.28Å; W175-D179 WeakPolarHBondContact O-CB 3.4Å; W175-D179 PolarHBondContact O-N 2.87Å; D179-I182 PolarHBondContact O-N 3.35Å; D179-Y183 WeakPolarHBondContact O-CB 3.24Å; D179-Y183 PolarHBondContact O-N 2.82Å; D179-R270 VanDerWaalsContact CG-NH1 3.32Å; D179-R270 PolarHBondContact O-NH1 3.48Å; D179-R270 VanDerWaalsContact O-NH1 3.15Å; D179-R270 IonicContact OD1-CZ 3.27Å; D179-R270 IonicContact OD1-NH1 2.95Å; D179-R270 PolarHBondContact OD1-NH1 3.29Å; D179-R270 IonicContact OD2-NH1 3.21Å
180	E	74.6	Confident	72.3	Confident	21 Å²	21	15.7 Å²	15.7	10%	0.098	8%	0.076	C	C	.	.	H	α-helix	trans	-67.3	-43	174.9	-173.2	63.3	-145.9	0	0	110.9	Y151 D176 I182 Y183 Q184	Y151-E180 VanDerWaalsContact OH-CG 3.3Å; Y151-E180 WeakPolarHBondContact OH-CG 3.32Å; D176-E180 WeakPolarHBondContact O-CB 3.48Å; D176-E180 PolarHBondContact O-N 3.26Å; E180-I182 VanDerWaalsContact C-N 3.3Å; E180-I182 PolarHBondContact O-N 3.24Å; E180-Y183 CarbonylContact O-C 3.49Å; E180-Y183 WeakPolarHBondContact O-CB 3.41Å; E180-Y183 PolarHBondContact O-N 2.86Å; E180-Y183 VanDerWaalsContact O-N 3.08Å; E180-Q184 HydrophobicContact CG-CG 4.34Å; E180-Q184 WeakPolarHBondContact O-CG 3.5Å; E180-Q184 PolarHBondContact O-N 3.16Å; E180-Q184 PolarHBondContact OE1-NE2 3.38Å
181	F	77.4	Confident	72.2	Confident	2 Å²	2	17.7 Å²	17.7	1%	0.009	8%	0.083	C	C	.	.	H	α-helix	trans	-56.6	-44.2	175.5	179.6	-116	0	0	0	111.9	Y151 F155 I177 I178 F185 W213 V218	Y151-F181 HydrophobicContact CD1-CB 4.4Å; Y151-F181 HydrophobicContact CD1-CD2 4.15Å; Y151-F181 HydrophobicContact CD2-CD2 4.17Å; Y151-F181 HydrophobicContact CE1-CB 4.46Å; Y151-F181 AromaticContact CG-CD2 3.78Å; Y151-F181 HydrophobicContact CG-CD2 3.78Å; Y151-F181 HydrophobicContact CG-CE2 4.41Å; F155-F181 HydrophobicContact CE2-CD1 4.02Å; F155-F181 AromaticContact CE2-CD2 3.82Å; F155-F181 HydrophobicContact CE2-CD2 3.82Å; F155-F181 HydrophobicContact CE2-CE1 4.07Å; F155-F181 AromaticContact CE2-CE2 3.9Å; F155-F181 HydrophobicContact CE2-CE2 3.9Å; F155-F181 AromaticContact CE2-CG 3.89Å; F155-F181 HydrophobicContact CE2-CG 3.89Å; F155-F181 HydrophobicContact CE2-CZ 4.01Å; F155-F181 HydrophobicContact CZ-CD1 4.26Å; F155-F181 HydrophobicContact CZ-CG 4.23Å; I177-F181 VanDerWaalsContact O-CB 3.23Å; I177-F181 WeakPolarHBondContact O-CB 3.48Å; I177-F181 PolarHBondContact O-N 2.88Å; I178-F181 PolarHBondContact O-N 3.17Å; F181-F185 PolarHBondContact O-N 2.91Å; F181-W213 AromaticContact CD2-CH2 3.58Å; F181-W213 HydrophobicContact CD2-CH2 3.58Å; F181-W213 AromaticContact CD2-CZ3 3.63Å; F181-W213 HydrophobicContact CD2-CZ3 3.63Å; F181-W213 HydrophobicContact CE2-CE3 4.37Å; F181-W213 AromaticContact CE2-CH2 3.65Å; F181-W213 HydrophobicContact CE2-CH2 3.65Å; F181-W213 AromaticContact CE2-CZ3 3.36Å; F181-W213 HydrophobicContact CE2-CZ3 3.36Å; F181-W213 HydrophobicContact CG-CZ3 4.41Å; F181-W213 AromaticContact CZ-CZ3 3.96Å; F181-W213 HydrophobicContact CZ-CZ3 3.96Å; F181-W213 WeakPolarHBondContact O-CZ3 3.44Å; F181-V218 HydrophobicContact CE1-CB 4.37Å; F181-V218 HydrophobicContact CE1-CG1 3.75Å; F181-V218 HydrophobicContact CE1-CG2 4.29Å; F181-V218 HydrophobicContact CZ-CB 4.49Å; F181-V218 HydrophobicContact CZ-CG1 4.31Å; F181-V218 HydrophobicContact CZ-CG2 4.01Å
182	I	76.4	Confident	71.9	Confident	3 Å²	3	17.3 Å²	17.3	2%	0.015	8%	0.08	C	C	.	.	H	α-helix	trans	-70.1	-36.6	176.3	-62.2	163.9	0	0	0	111.2	I178 D179 E180 F185 Q186 R270 L274	I178-I182 HydrophobicContact CG2-CD1 3.98Å; I178-I182 VanDerWaalsContact O-CG1 3.31Å; I178-I182 WeakPolarHBondContact O-CG1 3.27Å; I178-I182 PolarHBondContact O-N 2.94Å; I178-I182 VanDerWaalsContact O-N 3.08Å; D179-I182 PolarHBondContact O-N 3.35Å; E180-I182 VanDerWaalsContact C-N 3.3Å; E180-I182 PolarHBondContact O-N 3.24Å; I182-F185 PolarHBondContact O-N 2.9Å; I182-Q186 VanDerWaalsContact O-CB 3.31Å; I182-Q186 WeakPolarHBondContact O-CB 3.46Å; I182-Q186 PolarHBondContact O-N 3.05Å; I182-R270 HydrophobicContact CG2-CG 3.99Å; I182-L274 HydrophobicContact CG2-CD1 4.37Å
183	Y	76.7	Confident	71.5	Confident	99 Å²	99	16.1 Å²	16.1	39%	0.388	8%	0.075	S	C	.	.	H	α-helix	trans	-65.4	-41.9	175.8	177.6	-104.8	0	0	0	112.4	Y132 D179 E180 Q186 S187	Y132-Y183 HydrophobicContact CD1-CE1 4.04Å; D179-Y183 WeakPolarHBondContact O-CB 3.24Å; D179-Y183 PolarHBondContact O-N 2.82Å; E180-Y183 CarbonylContact O-C 3.49Å; E180-Y183 WeakPolarHBondContact O-CB 3.41Å; E180-Y183 PolarHBondContact O-N 2.86Å; E180-Y183 VanDerWaalsContact O-N 3.08Å; Y183-Q186 WeakPolarHBondContact O-CB 3.42Å; Y183-Q186 PolarHBondContact O-N 3.49Å; Y183-S187 WeakPolarHBondContact O-CB 3.33Å; Y183-S187 PolarHBondContact O-N 3.46Å; Y183-S187 PolarHBondContact O-OG 3.42Å
184	Q	70.6	Confident	71	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64.3	-42.8	175.1	-69.8	-170.9	15.5	0	0	111.1	Y132 S147 Y151 E180 Q186 S187 F188 W213	Y132-Q184 HydrophobicContact CD1-CG 4.44Å; Y132-Q184 HydrophobicContact CD2-CG 4.09Å; Y132-Q184 HydrophobicContact CE1-CG 4.01Å; Y132-Q184 VanDerWaalsContact CE2-CD 3.41Å; Y132-Q184 HydrophobicContact CE2-CG 3.67Å; Y132-Q184 HydrophobicContact CG-CG 4.47Å; S147-Q184 PolarHBondContact OG-OE1 2.82Å; Y151-Q184 VanDerWaalsContact CE2-OE1 3.23Å; Y151-Q184 PolarHBondContact OH-NE2 3.41Å; E180-Q184 HydrophobicContact CG-CG 4.34Å; E180-Q184 WeakPolarHBondContact O-CG 3.5Å; E180-Q184 PolarHBondContact O-N 3.16Å; E180-Q184 PolarHBondContact OE1-NE2 3.38Å; Q184-Q186 VanDerWaalsContact C-N 3.33Å; Q184-Q186 PolarHBondContact O-N 3.42Å; Q184-S187 WeakPolarHBondContact CA-OG 3.46Å; Q184-S187 PolarHBondContact O-N 3.28Å; Q184-S187 PolarHBondContact O-OG 2.86Å; Q184-F188 VanDerWaalsContact O-CB 3.24Å; Q184-F188 WeakPolarHBondContact O-CB 3.49Å; Q184-F188 PolarHBondContact O-N 3.34Å; Q184-W213 HydrophobicContact CB-CH2 3.68Å; Q184-W213 HydrophobicContact CB-CZ2 3.74Å
185	F	71.9	Confident	70.4	Confident	4 Å²	4	22.3 Å²	22.3	2%	0.018	10%	0.104	C	C	.	.	H	α-helix	trans	-57.6	-45.1	170.8	176.6	-107.6	0	0	0	112.2	F181 I182 S189 W213 V215 V218 L271 L412	F181-F185 PolarHBondContact O-N 2.91Å; I182-F185 PolarHBondContact O-N 2.9Å; F185-S189 VanDerWaalsContact O-CB 3.26Å; F185-S189 WeakPolarHBondContact O-CB 3.5Å; F185-S189 PolarHBondContact O-N 3.49Å; F185-S189 PolarHBondContact O-OG 3.29Å; F185-W213 HydrophobicContact CB-CE3 3.67Å; F185-W213 HydrophobicContact CB-CZ3 3.67Å; F185-W213 HydrophobicContact CD2-CB 4.07Å; F185-W213 HydrophobicContact CD2-CD2 4.38Å; F185-W213 AromaticContact CD2-CE3 3.74Å; F185-W213 HydrophobicContact CD2-CE3 3.74Å; F185-W213 HydrophobicContact CE2-CB 4.43Å; F185-W213 WeakPolarHBondContact CE2-O 3.4Å; F185-W213 HydrophobicContact CG-CE3 4.19Å; F185-V215 HydrophobicContact CE2-CG2 4.38Å; F185-V215 HydrophobicContact CZ-CB 4.48Å; F185-V215 HydrophobicContact CZ-CG2 3.72Å; F185-V218 HydrophobicContact CD2-CG2 3.88Å; F185-V218 HydrophobicContact CE2-CG2 4.33Å; F185-V218 HydrophobicContact CG-CG2 4.29Å; F185-L271 HydrophobicContact CD1-CD1 3.87Å; F185-L271 HydrophobicContact CE1-CD1 3.57Å; F185-L412 HydrophobicContact CD1-CD1 3.96Å; F185-L412 HydrophobicContact CE1-CD1 3.67Å
186	Q	71.4	Confident	69.3	Low	17 Å²	17	25.9 Å²	25.9	8%	0.079	13%	0.134	C	C	.	.	H	α-helix	trans	-65.2	-45.2	179.7	-177.1	178	17.8	0	0	112.1	I182 Y183 Q184 S189 Q190 K410 L412	I182-Q186 VanDerWaalsContact O-CB 3.31Å; I182-Q186 WeakPolarHBondContact O-CB 3.46Å; I182-Q186 PolarHBondContact O-N 3.05Å; Y183-Q186 WeakPolarHBondContact O-CB 3.42Å; Y183-Q186 PolarHBondContact O-N 3.49Å; Q184-Q186 VanDerWaalsContact C-N 3.33Å; Q184-Q186 PolarHBondContact O-N 3.42Å; Q186-S189 PolarHBondContact O-N 3.43Å; Q186-Q190 WeakPolarHBondContact O-CB 3.44Å; Q186-Q190 VanDerWaalsContact O-CG 3.28Å; Q186-Q190 WeakPolarHBondContact O-CG 3.42Å; Q186-Q190 PolarHBondContact O-N 3.11Å; Q186-K410 PolarHBondContact NE2-O 3.48Å; Q186-L412 HydrophobicContact CB-CD1 4.15Å; Q186-L412 HydrophobicContact CG-CD1 4.17Å; Q186-L412 HydrophobicContact CG-CD2 3.93Å; Q186-L412 HydrophobicContact CG-CG 4.32Å
187	S	70.9	Confident	68.3	Low	22 Å²	22	35.4 Å²	35.4	15%	0.154	18%	0.175	C	C	.	.	H	α-helix	trans	-67.5	-39.8	179	66.6	0	0	0	0	111.7	Y132 Y183 Q184 Q190 Y191	Y132-S187 WeakPolarHBondContact CE1-OG 3.27Å; Y183-S187 WeakPolarHBondContact O-CB 3.33Å; Y183-S187 PolarHBondContact O-N 3.46Å; Y183-S187 PolarHBondContact O-OG 3.42Å; Q184-S187 WeakPolarHBondContact CA-OG 3.46Å; Q184-S187 PolarHBondContact O-N 3.28Å; Q184-S187 PolarHBondContact O-OG 2.86Å; S187-Q190 PolarHBondContact O-N 3.04Å; S187-Y191 VanDerWaalsContact O-CB 3.23Å; S187-Y191 WeakPolarHBondContact O-CB 3.36Å; S187-Y191 PolarHBondContact O-N 3.49Å
188	F	69.2	Low	67.4	Low	3 Å²	3	36.5 Å²	36.5	1%	0.013	18%	0.18	C	C	.	.	H	α-helix	trans	-65	-44	174.5	-176.6	-100.8	0	0	0	111.4	F145 Q184 Y191 R192 L206 W213	F145-F188 HydrophobicContact CE1-CE2 4.48Å; F145-F188 HydrophobicContact CE1-CZ 4.41Å; F145-F188 HydrophobicContact CZ-CE2 4.41Å; Q184-F188 VanDerWaalsContact O-CB 3.24Å; Q184-F188 WeakPolarHBondContact O-CB 3.49Å; Q184-F188 PolarHBondContact O-N 3.34Å; F188-Y191 CarbonylContact O-C 3.6Å; F188-Y191 PolarHBondContact O-N 3.04Å; F188-R192 HydrophobicContact CE1-CG 4.22Å; F188-R192 HydrophobicContact CZ-CG 4.36Å; F188-R192 WeakPolarHBondContact O-CB 3.48Å; F188-R192 PolarHBondContact O-N 2.97Å; F188-L206 HydrophobicContact CE2-CD2 4.09Å; F188-L206 HydrophobicContact CZ-CD2 3.84Å; F188-W213 HydrophobicContact CB-CG 4.45Å; F188-W213 HydrophobicContact CD1-CB 3.54Å; F188-W213 AromaticContact CD1-CD1 3.64Å; F188-W213 AromaticContact CD1-CG 3.77Å; F188-W213 HydrophobicContact CD1-CG 3.77Å; F188-W213 HydrophobicContact CE1-CB 3.78Å; F188-W213 AromaticContact CE1-CD1 3.92Å; F188-W213 HydrophobicContact CE1-CG 4.2Å; F188-W213 HydrophobicContact CG-CB 4.37Å; F188-W213 AromaticContact CG-CD1 3.69Å; F188-W213 HydrophobicContact CG-CG 4.13Å
189	S	67.6	Low	66.4	Low	14 Å²	14	39.5 Å²	39.5	10%	0.098	20%	0.201	C	C	.	.	H	α-helix	trans	-62.6	-44.8	176.6	-63.3	0	0	0	0	111.8	F185 Q186 Y191 R192 C193	F185-S189 VanDerWaalsContact O-CB 3.26Å; F185-S189 WeakPolarHBondContact O-CB 3.5Å; F185-S189 PolarHBondContact O-N 3.49Å; F185-S189 PolarHBondContact O-OG 3.29Å; Q186-S189 PolarHBondContact O-N 3.43Å; S189-Y191 VanDerWaalsContact C-N 3.34Å; S189-Y191 PolarHBondContact O-N 2.99Å; S189-R192 PolarHBondContact O-N 3.42Å; S189-C193 PolarHBondContact O-N 3.28Å; S189-C193 PolarHBondContact O-SG 3.36Å; S189-C193 VanDerWaalsContact O-SG 3.32Å
190	Q	67.8	Low	65.4	Low	22 Å²	22	46.2 Å²	46.2	10%	0.103	23%	0.231	C	C	.	.	H	α-helix	trans	-63	-40.8	173.9	-73.7	172.9	19.8	0	0	112	Q186 S187 C193 K194 K410 L412 H427	Q186-Q190 WeakPolarHBondContact O-CB 3.44Å; Q186-Q190 VanDerWaalsContact O-CG 3.28Å; Q186-Q190 WeakPolarHBondContact O-CG 3.42Å; Q186-Q190 PolarHBondContact O-N 3.11Å; S187-Q190 PolarHBondContact O-N 3.04Å; Q190-C193 PolarHBondContact O-N 2.73Å; Q190-K194 WeakPolarHBondContact O-CG 3.29Å; Q190-K194 PolarHBondContact O-N 3.47Å; Q190-K410 VanDerWaalsContact NE2-CB 3.3Å; Q190-K410 VanDerWaalsContact NE2-CD 3.29Å; Q190-L412 HydrophobicContact CG-CD2 4.2Å; Q190-H427 PolarHBondContact O-CD2 3.3Å
191	Y	65.2	Low	64.6	Low	44 Å²	44	52.6 Å²	52.6	17%	0.173	26%	0.261	C	S	.	.	H	α-helix	trans	-65.5	-41.7	175.8	177.6	-100.7	0	0	0	111.2	L141 R144 S187 F188 S189 C193 K194 K198 E202	L141-Y191 HydrophobicContact CD2-CE1 3.66Å; L141-Y191 HydrophobicContact CG-CE1 4.14Å; R144-Y191 VanDerWaalsContact NH1-CB 3.25Å; R144-Y191 VanDerWaalsContact NH1-CD2 3.29Å; S187-Y191 VanDerWaalsContact O-CB 3.23Å; S187-Y191 WeakPolarHBondContact O-CB 3.36Å; S187-Y191 PolarHBondContact O-N 3.49Å; F188-Y191 CarbonylContact O-C 3.6Å; F188-Y191 PolarHBondContact O-N 3.04Å; S189-Y191 VanDerWaalsContact C-N 3.34Å; S189-Y191 PolarHBondContact O-N 2.99Å; Y191-C193 VanDerWaalsContact C-N 3.3Å; Y191-C193 PolarHBondContact O-N 3.25Å; Y191-K194 PolarHBondContact O-N 3.4Å; Y191-K198 HydrophobicContact CE1-CD 4.44Å; Y191-K198 VanDerWaalsContact CE1-CE 3.44Å; Y191-K198 WeakPolarHBondContact O-CE 3.36Å; Y191-K198 PolarHBondContact O-NZ 3.2Å; Y191-E202 PolarHBondContact OH-OE1 3.32Å; Y191-E202 PolarHBondContact OH-OE2 3.48Å
192	R	60.9	Low	63.8	Low	28 Å²	28	55.4 Å²	55.4	11%	0.106	27%	0.274	C	S	.	.	H	α-helix	trans	-58.5	-41.6	173.7	-110.5	178.2	60.1	170.4	-21.8	111.9	F188 S189 K194 L206 V416	F188-R192 HydrophobicContact CE1-CG 4.22Å; F188-R192 HydrophobicContact CZ-CG 4.36Å; F188-R192 WeakPolarHBondContact O-CB 3.48Å; F188-R192 PolarHBondContact O-N 2.97Å; S189-R192 PolarHBondContact O-N 3.42Å; R192-K194 VanDerWaalsContact C-N 3.34Å; R192-K194 PolarHBondContact O-N 3.1Å; R192-L206 HydrophobicContact CG-CD1 4.33Å; R192-L206 HydrophobicContact CG-CD2 4.18Å; R192-V416 VanDerWaalsContact NH2-CB 3.26Å
193	C	59.3	Low	63.1	Low	12 Å²	12	57 Å²	57	8%	0.081	28%	0.282	C	S	.	.	H	α-helix	trans	-74.5	-19	178.4	-66.4	0	0	0	0	114.2	S189 Q190 Y191 T195 H427	S189-C193 PolarHBondContact O-N 3.28Å; S189-C193 PolarHBondContact O-SG 3.36Å; S189-C193 VanDerWaalsContact O-SG 3.32Å; Q190-C193 PolarHBondContact O-N 2.73Å; Y191-C193 VanDerWaalsContact C-N 3.3Å; Y191-C193 PolarHBondContact O-N 3.25Å; C193-T195 PolarHBondContact O-N 3.03Å; C193-H427 HydrophobicContact CB-CB 3.82Å
194	K	62.4	Low	62.3	Low	117 Å²	117	57.9 Å²	57.9	51%	0.509	29%	0.29	S	S	.	.			trans	-86.8	77.4	174.1	-73	173.4	-175	177.8	0	110.2	Q190 Y191 R192 K198	Q190-K194 WeakPolarHBondContact O-CG 3.29Å; Q190-K194 PolarHBondContact O-N 3.47Å; Y191-K194 PolarHBondContact O-N 3.4Å; R192-K194 VanDerWaalsContact C-N 3.34Å; R192-K194 PolarHBondContact O-N 3.1Å; K194-K198 VanDerWaalsContact O-CE 3.23Å; K194-K198 WeakPolarHBondContact O-CE 3.25Å
195	T	57.8	Low	61.8	Low	18 Å²	18	62.1 Å²	62.1	11%	0.11	31%	0.308	C	S	.	.			trans	-80.3	-19	178	47.9	0	0	0	0	113.5	C193 K197 Y419	C193-T195 PolarHBondContact O-N 3.03Å; T195-K197 VanDerWaalsContact C-N 3.28Å; T195-K197 PolarHBondContact O-N 3.49Å; T195-K197 VanDerWaalsContact O-N 3.14Å; T195-Y419 HydrophobicContact CG2-CD1 4.43Å; T195-Y419 HydrophobicContact CG2-CE1 4.37Å
196	A	51	Low	61.4	Low	79 Å²	79	62.1 Å²	62.1	65%	0.653	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-3.2	-171.1	0	0	0	0	0	116.8
197	K	53.1	Low	60.8	Low	206 Å²	206	67 Å²	67	90%	0.896	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.8	13.7	-178.3	-76.1	-167.9	174.6	-169.7	0	113.6	T195	T195-K197 VanDerWaalsContact C-N 3.28Å; T195-K197 PolarHBondContact O-N 3.49Å; T195-K197 VanDerWaalsContact O-N 3.14Å
198	K	58.8	Low	60.5	Low	29 Å²	29	71.3 Å²	71.3	13%	0.126	35%	0.348	C	S	.	.			trans	-105.1	151.1	-170.6	-66.9	-171.2	179.4	-175.5	0	112.8	Y191 K194 E202 I203	Y191-K198 HydrophobicContact CE1-CD 4.44Å; Y191-K198 VanDerWaalsContact CE1-CE 3.44Å; Y191-K198 WeakPolarHBondContact O-CE 3.36Å; Y191-K198 PolarHBondContact O-NZ 3.2Å; K194-K198 VanDerWaalsContact O-CE 3.23Å; K194-K198 WeakPolarHBondContact O-CE 3.25Å; K198-E202 WeakPolarHBondContact CB-OE2 3.45Å; K198-I203 HydrophobicContact CB-CD1 4.46Å; K198-I203 HydrophobicContact CB-CG1 4.31Å
199	S	55.3	Low	60	Low	63 Å²	63	73.9 Å²	73.9	44%	0.441	36%	0.361	S	S	.	.			trans	-73.4	151.5	171.2	-170.2	0	0	0	0	110.7	E201 E202 I203	S199-E201 PolarHBondContact O-N 3.41Å; S199-E202 PolarHBondContact N-OE2 3.21Å; S199-E202 PolarHBondContact O-N 3.5Å; S199-E202 VanDerWaalsContact O-N 3.16Å; S199-I203 PolarHBondContact O-N 3.2Å
200	E	55.3	Low	59.6	Low	167 Å²	167	76.5 Å²	76.5	78%	0.78	38%	0.378	S	S	*	.	H	α-helix	trans	-59.4	-34.2	177	-76.1	179.8	155.5	0	0	111.9	E202 I203 E204	E200-E202 PolarHBondContact O-N 2.99Å; E200-I203 PolarHBondContact O-N 3.49Å; E200-E204 PolarHBondContact O-N 3.45Å
201	E	56.5	Low	59.1	Low	156 Å²	156	83.5 Å²	83.5	73%	0.729	41%	0.408	S	S	*	.	H	α-helix	trans	-63.7	-37	175.6	-65.5	177.2	164.7	0	0	112.9	S199 I203 E204 F205	S199-E201 PolarHBondContact O-N 3.41Å; E201-I203 VanDerWaalsContact C-N 3.32Å; E201-I203 PolarHBondContact O-N 3.01Å; E201-E204 PolarHBondContact O-N 3.21Å; E201-F205 WeakPolarHBondContact O-CB 3.39Å; E201-F205 PolarHBondContact O-N 3.5Å
202	E	61.8	Low	58.8	Low	60 Å²	60	81.9 Å²	81.9	28%	0.28	40%	0.402	S	S	.	.	H	α-helix	trans	-70.7	-31.6	177.1	-64.1	-175.4	135.7	0	0	111.6	L141 Y191 K198 S199 E200 L206	L141-E202 HydrophobicContact CD1-CB 3.85Å; L141-E202 HydrophobicContact CD1-CG 3.61Å; Y191-E202 PolarHBondContact OH-OE1 3.32Å; Y191-E202 PolarHBondContact OH-OE2 3.48Å; K198-E202 WeakPolarHBondContact CB-OE2 3.45Å; S199-E202 PolarHBondContact N-OE2 3.21Å; S199-E202 PolarHBondContact O-N 3.5Å; S199-E202 VanDerWaalsContact O-N 3.16Å; E200-E202 PolarHBondContact O-N 2.99Å; E202-L206 WeakPolarHBondContact O-CB 3.34Å; E202-L206 WeakPolarHBondContact O-CD1 3.33Å; E202-L206 WeakPolarHBondContact O-CG 3.4Å; E202-L206 PolarHBondContact O-N 3.14Å; E202-L206 VanDerWaalsContact O-N 3.09Å
203	I	61.4	Low	58.9	Low	36 Å²	36	80.9 Å²	80.9	19%	0.185	40%	0.399	C	S	.	.	H	α-helix	trans	-72.4	-40.9	177.6	-66.3	171.3	0	0	0	109.9	K198 S199 E200 E201 L206 R207 Y419	K198-I203 HydrophobicContact CB-CD1 4.46Å; K198-I203 HydrophobicContact CB-CG1 4.31Å; S199-I203 PolarHBondContact O-N 3.2Å; E200-I203 PolarHBondContact O-N 3.49Å; E201-I203 VanDerWaalsContact C-N 3.32Å; E201-I203 PolarHBondContact O-N 3.01Å; I203-L206 PolarHBondContact O-N 3.47Å; I203-R207 WeakPolarHBondContact O-CB 3.24Å; I203-R207 PolarHBondContact O-N 2.79Å; I203-Y419 HydrophobicContact CG2-CD1 3.6Å; I203-Y419 HydrophobicContact CG2-CE1 4.19Å; I203-Y419 HydrophobicContact CG2-CG 4.02Å
204	E	60	Low	59.3	Low	119 Å²	119	83.1 Å²	83.1	56%	0.556	41%	0.41	S	S	*	.	H	α-helix	trans	-68.2	-38.3	176.1	-162.6	160.5	-151.9	0	0	111.9	E200 E201 L206 R207 N208	E200-E204 PolarHBondContact O-N 3.45Å; E201-E204 PolarHBondContact O-N 3.21Å; E204-L206 PolarHBondContact O-N 3.33Å; E204-R207 WeakPolarHBondContact O-CB 3.46Å; E204-R207 PolarHBondContact O-N 3.31Å; E204-N208 PolarHBondContact O-N 2.88Å; E204-N208 PolarHBondContact O-ND2 3.37Å
205	F	60	Low	59.5	Low	88 Å²	88	78.4 Å²	78.4	39%	0.386	39%	0.391	S	S	.	.	H	α-helix	trans	-65.8	-36.9	173.8	-161.4	-100.8	0	0	0	113.2	F145 E201 R207 N208 N209	F145-F205 AromaticContact CD2-CE1 3.87Å; F145-F205 HydrophobicContact CD2-CE1 3.87Å; F145-F205 AromaticContact CE2-CD1 3.77Å; F145-F205 HydrophobicContact CE2-CD1 3.77Å; F145-F205 AromaticContact CE2-CE1 3.43Å; F145-F205 HydrophobicContact CE2-CE1 3.43Å; F145-F205 VanDerWaalsContact CE2-CE1 3.43Å; F145-F205 HydrophobicContact CZ-CD1 4.26Å; F145-F205 HydrophobicContact CZ-CE1 4.12Å; E201-F205 WeakPolarHBondContact O-CB 3.39Å; E201-F205 PolarHBondContact O-N 3.5Å; F205-R207 VanDerWaalsContact C-N 3.34Å; F205-N208 PolarHBondContact O-N 3.5Å; F205-N209 PolarHBondContact O-N 3.41Å
206	L	62.5	Low	60.3	Low	4 Å²	4	83.2 Å²	83.2	2%	0.021	41%	0.412	C	S	.	.	H	α-helix	trans	-69.8	-30.9	172.9	-72.9	168.4	0	0	0	112.6	L141 F145 F188 R192 E202 I203 E204	L141-L206 HydrophobicContact CD2-CD2 4.2Å; F145-L206 HydrophobicContact CZ-CD2 4.35Å; F188-L206 HydrophobicContact CE2-CD2 4.09Å; F188-L206 HydrophobicContact CZ-CD2 3.84Å; R192-L206 HydrophobicContact CG-CD1 4.33Å; R192-L206 HydrophobicContact CG-CD2 4.18Å; E202-L206 WeakPolarHBondContact O-CB 3.34Å; E202-L206 WeakPolarHBondContact O-CD1 3.33Å; E202-L206 WeakPolarHBondContact O-CG 3.4Å; E202-L206 PolarHBondContact O-N 3.14Å; E202-L206 VanDerWaalsContact O-N 3.09Å; I203-L206 PolarHBondContact O-N 3.47Å; E204-L206 PolarHBondContact O-N 3.33Å
207	R	60.3	Low	61.4	Low	121 Å²	121	81.3 Å²	81.3	46%	0.457	39%	0.394	S	S	.	.	H	α-helix	trans	-69.7	-36.2	175.7	-176	-178.1	-75.5	-173.1	-12.4	111.8	I203 E204 F205 N209 P210 D420	I203-R207 WeakPolarHBondContact O-CB 3.24Å; I203-R207 PolarHBondContact O-N 2.79Å; E204-R207 WeakPolarHBondContact O-CB 3.46Å; E204-R207 PolarHBondContact O-N 3.31Å; F205-R207 VanDerWaalsContact C-N 3.34Å; R207-N209 VanDerWaalsContact C-N 3.31Å; R207-N209 PolarHBondContact O-N 2.77Å; R207-P210 WeakPolarHBondContact O-CD 3.35Å; R207-D420 IonicContact NH2-OD1 2.73Å; R207-D420 PolarHBondContact NH2-OD1 2.68Å
208	N	63.1	Low	62.5	Low	112 Å²	112	71.6 Å²	71.6	60%	0.599	35%	0.351	S	S	*	.	H	α-helix	trans	-71.6	-24.5	178	-70.2	-21.9	0	0	0	113.1	E204 F205 P210	E204-N208 PolarHBondContact O-N 2.88Å; E204-N208 PolarHBondContact O-ND2 3.37Å; F205-N208 PolarHBondContact O-N 3.5Å; N208-P210 VanDerWaalsContact O-CD 3.32Å; N208-P210 WeakPolarHBondContact O-CD 3.21Å
209	N	58.7	Low	63.3	Low	56 Å²	56	71.5 Å²	71.5	30%	0.299	35%	0.352	S	S	.	.			trans	-121.6	61.6	-177.6	-71.1	-44.8	0	0	0	113.9	F145 F205 R207 K211 I212	F145-N209 HydrophobicContact CE1-CB 4.42Å; F205-N209 PolarHBondContact O-N 3.41Å; R207-N209 VanDerWaalsContact C-N 3.31Å; R207-N209 PolarHBondContact O-N 2.77Å; N209-K211 PolarHBondContact O-N 3.07Å; N209-I212 HydrophobicContact CB-CD1 3.8Å; N209-I212 HydrophobicContact CB-CG1 4.25Å
210	P	59.2	Low	64.5	Low	69 Å²	69	73.4 Å²	73.4	45%	0.448	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-15.1	-177.7	30.7	-35.1	0	0	0	113.5	R207 N208	R207-P210 WeakPolarHBondContact O-CD 3.35Å; N208-P210 VanDerWaalsContact O-CD 3.32Å; N208-P210 WeakPolarHBondContact O-CD 3.21Å
211	K	57.7	Low	65.6	Low	170 Å²	170	66.6 Å²	66.6	74%	0.739	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-17.1	-175.6	-62.6	-177.2	-178.1	177.4	0	113.7	N209	N209-K211 PolarHBondContact O-N 3.07Å
212	I	59.7	Low	66.6	Low	10 Å²	10	59.1 Å²	59.1	5%	0.051	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	130.2	-177.4	-56.9	178.7	0	0	0	108.2	F145 Y148 Y149 N209	F145-I212 HydrophobicContact CD1-CB 3.96Å; F145-I212 HydrophobicContact CD1-CD1 3.27Å; F145-I212 HydrophobicContact CD1-CG1 4.14Å; F145-I212 HydrophobicContact CD1-CG2 3.39Å; F145-I212 HydrophobicContact CE1-CB 3.77Å; F145-I212 HydrophobicContact CE1-CD1 3.47Å; F145-I212 VanDerWaalsContact CE1-CD1 3.47Å; F145-I212 HydrophobicContact CE1-CG1 4.15Å; F145-I212 HydrophobicContact CE1-CG2 3.61Å; F145-I212 HydrophobicContact CG-CD1 4.31Å; Y148-I212 HydrophobicContact CD1-CB 4.43Å; Y148-I212 HydrophobicContact CD1-CG2 3.46Å; Y148-I212 VanDerWaalsContact CD1-CG2 3.46Å; Y148-I212 HydrophobicContact CE1-CB 4.49Å; Y148-I212 HydrophobicContact CE1-CG2 3.94Å; Y148-I212 HydrophobicContact CG-CG2 3.92Å; Y149-I212 HydrophobicContact CE2-CD1 4.29Å; Y149-I212 WeakPolarHBondContact OH-CD1 3.45Å; N209-I212 HydrophobicContact CB-CD1 3.8Å; N209-I212 HydrophobicContact CB-CG1 4.25Å
213	W	62.6	Low	67.5	Low	6 Å²	6	59.4 Å²	59.4	2%	0.023	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	56	45.7	-171	-65.7	108.4	0	0	0	113.2	R144 Y148 F181 Q184 F185 F188 V218	R144-W213 PolarHBondContact O-NE1 2.86Å; Y148-W213 AromaticContact CD2-CD2 3.39Å; Y148-W213 HydrophobicContact CD2-CD2 3.39Å; Y148-W213 AromaticContact CD2-CE2 3.4Å; Y148-W213 VanDerWaalsContact CD2-CE2 3.4Å; Y148-W213 AromaticContact CD2-CE3 3.62Å; Y148-W213 HydrophobicContact CD2-CE3 3.62Å; Y148-W213 AromaticContact CD2-CG 3.96Å; Y148-W213 HydrophobicContact CD2-CG 3.96Å; Y148-W213 AromaticContact CD2-CH2 3.93Å; Y148-W213 HydrophobicContact CD2-CH2 3.93Å; Y148-W213 AromaticContact CD2-CZ2 3.69Å; Y148-W213 HydrophobicContact CD2-CZ2 3.69Å; Y148-W213 AromaticContact CD2-CZ3 3.9Å; Y148-W213 HydrophobicContact CD2-CZ3 3.9Å; Y148-W213 AromaticContact CD2-NE1 3.88Å; Y148-W213 AromaticContact CE2-CD2 3.92Å; Y148-W213 HydrophobicContact CE2-CD2 3.92Å; Y148-W213 AromaticContact CE2-CE3 3.85Å; Y148-W213 HydrophobicContact CE2-CE3 3.85Å; Y148-W213 HydrophobicContact CE2-CG 4.34Å; Y148-W213 HydrophobicContact CE2-CZ3 4.29Å; Y148-W213 HydrophobicContact CG-CD2 4.14Å; Y148-W213 AromaticContact CG-CE2 3.84Å; Y148-W213 HydrophobicContact CG-CG 4.39Å; Y148-W213 HydrophobicContact CG-CZ2 4.22Å; Y148-W213 AromaticContact CG-NE1 3.86Å; F181-W213 AromaticContact CD2-CH2 3.58Å; F181-W213 HydrophobicContact CD2-CH2 3.58Å; F181-W213 AromaticContact CD2-CZ3 3.63Å; F181-W213 HydrophobicContact CD2-CZ3 3.63Å; F181-W213 HydrophobicContact CE2-CE3 4.37Å; F181-W213 AromaticContact CE2-CH2 3.65Å; F181-W213 HydrophobicContact CE2-CH2 3.65Å; F181-W213 AromaticContact CE2-CZ3 3.36Å; F181-W213 HydrophobicContact CE2-CZ3 3.36Å; F181-W213 HydrophobicContact CG-CZ3 4.41Å; F181-W213 AromaticContact CZ-CZ3 3.96Å; F181-W213 HydrophobicContact CZ-CZ3 3.96Å; F181-W213 WeakPolarHBondContact O-CZ3 3.44Å; Q184-W213 HydrophobicContact CB-CH2 3.68Å; Q184-W213 HydrophobicContact CB-CZ2 3.74Å; F185-W213 HydrophobicContact CB-CE3 3.67Å; F185-W213 HydrophobicContact CB-CZ3 3.67Å; F185-W213 HydrophobicContact CD2-CB 4.07Å; F185-W213 HydrophobicContact CD2-CD2 4.38Å; F185-W213 AromaticContact CD2-CE3 3.74Å; F185-W213 HydrophobicContact CD2-CE3 3.74Å; F185-W213 HydrophobicContact CE2-CB 4.43Å; F185-W213 WeakPolarHBondContact CE2-O 3.4Å; F185-W213 HydrophobicContact CG-CE3 4.19Å; F188-W213 HydrophobicContact CB-CG 4.45Å; F188-W213 HydrophobicContact CD1-CB 3.54Å; F188-W213 AromaticContact CD1-CD1 3.64Å; F188-W213 AromaticContact CD1-CG 3.77Å; F188-W213 HydrophobicContact CD1-CG 3.77Å; F188-W213 HydrophobicContact CE1-CB 3.78Å; F188-W213 AromaticContact CE1-CD1 3.92Å; F188-W213 HydrophobicContact CE1-CG 4.2Å; F188-W213 HydrophobicContact CG-CB 4.37Å; F188-W213 AromaticContact CG-CD1 3.69Å; F188-W213 HydrophobicContact CG-CG 4.13Å; W213-V218 HydrophobicContact CE3-CG2 3.99Å; W213-V218 HydrophobicContact CZ3-CG2 4.36Å
214	N	67.4	Low	68.2	Low	60 Å²	60	60.2 Å²	60.2	32%	0.321	30%	0.303	S	S	.	.			trans	-70.3	134.4	167.7	-173.8	-2.9	0	0	0	109.9	H216 S217 V218	N214-H216 PolarHBondContact O-N 2.97Å; N214-H216 PolarHBondContact OD1-N 3.44Å; N214-H216 VanDerWaalsContact OD1-N 3.14Å; N214-H216 PolarHBondContact OD1-ND1 2.93Å; N214-S217 PolarHBondContact O-N 2.91Å; N214-V218 PolarHBondContact O-N 3.47Å; N214-V218 VanDerWaalsContact O-N 3.09Å
215	V	66.9	Low	68.7	Low	17 Å²	17	54.8 Å²	54.8	10%	0.103	28%	0.277	C	S	.	.	H	α-helix	trans	-49.5	-41.2	172.8	179.4	0	0	0	0	110.3	F185 V218 L219 L275 P414	F185-V215 HydrophobicContact CE2-CG2 4.38Å; F185-V215 HydrophobicContact CZ-CB 4.48Å; F185-V215 HydrophobicContact CZ-CG2 3.72Å; V215-V218 PolarHBondContact O-N 3.42Å; V215-L219 HydrophobicContact CG1-CD1 3.75Å; V215-L219 HydrophobicContact CG1-CG 4.25Å; V215-L219 WeakPolarHBondContact O-CB 3.4Å; V215-L219 VanDerWaalsContact O-CG 3.31Å; V215-L219 WeakPolarHBondContact O-CG 3.44Å; V215-L219 PolarHBondContact O-N 3.23Å; V215-L275 HydrophobicContact CG1-CD1 3.96Å; V215-L275 HydrophobicContact CG1-CD2 4.27Å; V215-L275 HydrophobicContact CG2-CD2 4.46Å; V215-P414 HydrophobicContact CG2-CB 4.47Å
216	H	74.1	Confident	69.3	Low	120 Å²	120	50.8 Å²	50.8	56%	0.556	26%	0.26	S	S	*	.	H	α-helix	trans	-65.2	-40.7	179	-59.1	84	0	0	0	112.5	N214 N220	N214-H216 PolarHBondContact O-N 2.97Å; N214-H216 PolarHBondContact OD1-N 3.44Å; N214-H216 VanDerWaalsContact OD1-N 3.14Å; N214-H216 PolarHBondContact OD1-ND1 2.93Å; H216-N220 WeakPolarHBondContact O-CB 3.18Å; H216-N220 PolarHBondContact O-N 3.28Å; H216-N220 PolarHBondContact O-ND2 2.92Å; H216-N220 PolarHBondContact O-OD1 3.46Å
217	S	75.1	Confident	69.7	Low	39 Å²	39	55.6 Å²	55.6	27%	0.273	29%	0.286	S	S	.	.	H	α-helix	trans	-66.4	-41.2	178.2	-57	0	0	0	0	111.2	N214 N220 V221	N214-S217 PolarHBondContact O-N 2.91Å; S217-N220 PolarHBondContact O-N 3.04Å; S217-V221 VanDerWaalsContact O-CG2 3.31Å; S217-V221 WeakPolarHBondContact O-CG2 3.32Å; S217-V221 PolarHBondContact O-N 3.28Å
218	V	75.6	Confident	70.2	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-65.9	-46.9	177.1	175.4	0	0	0	0	110.8	F181 F185 W213 N214 V215 N220 V221 L222 L271	F181-V218 HydrophobicContact CE1-CB 4.37Å; F181-V218 HydrophobicContact CE1-CG1 3.75Å; F181-V218 HydrophobicContact CE1-CG2 4.29Å; F181-V218 HydrophobicContact CZ-CB 4.49Å; F181-V218 HydrophobicContact CZ-CG1 4.31Å; F181-V218 HydrophobicContact CZ-CG2 4.01Å; F185-V218 HydrophobicContact CD2-CG2 3.88Å; F185-V218 HydrophobicContact CE2-CG2 4.33Å; F185-V218 HydrophobicContact CG-CG2 4.29Å; W213-V218 HydrophobicContact CE3-CG2 3.99Å; W213-V218 HydrophobicContact CZ3-CG2 4.36Å; N214-V218 PolarHBondContact O-N 3.47Å; N214-V218 VanDerWaalsContact O-N 3.09Å; V215-V218 PolarHBondContact O-N 3.42Å; V218-N220 VanDerWaalsContact C-N 3.35Å; V218-N220 PolarHBondContact O-N 3.41Å; V218-V221 PolarHBondContact O-N 2.91Å; V218-L222 HydrophobicContact CG1-CD1 4.25Å; V218-L222 WeakPolarHBondContact O-CG 3.4Å; V218-L222 PolarHBondContact O-N 3.33Å; V218-L271 HydrophobicContact CG1-CD2 3.77Å
219	L	76.9	Confident	70.1	Confident	28 Å²	28	46.6 Å²	46.6	15%	0.147	25%	0.245	C	C	.	.	H	α-helix	trans	-60.9	-43.4	175.1	-76	172.5	0	0	0	111.6	V215 V221 L222 H223 L268 L271	V215-L219 HydrophobicContact CG1-CD1 3.75Å; V215-L219 HydrophobicContact CG1-CG 4.25Å; V215-L219 WeakPolarHBondContact O-CB 3.4Å; V215-L219 VanDerWaalsContact O-CG 3.31Å; V215-L219 WeakPolarHBondContact O-CG 3.44Å; V215-L219 PolarHBondContact O-N 3.23Å; L219-V221 PolarHBondContact O-N 2.71Å; L219-L222 PolarHBondContact O-N 3.22Å; L219-H223 WeakPolarHBondContact O-CB 3.46Å; L219-H223 PolarHBondContact O-CD2 3.05Å; L219-H223 PolarHBondContact O-N 3.43Å; L219-L268 HydrophobicContact CD2-CD2 3.76Å; L219-L271 HydrophobicContact CD2-CD2 3.54Å; L219-L271 HydrophobicContact CD2-CG 4.3Å; L219-L271 HydrophobicContact CG-CD2 3.88Å
220	N	80.8	Confident	70.4	Confident	102 Å²	102	46.5 Å²	46.5	55%	0.545	24%	0.244	S	C	.	.	H	α-helix	trans	-62.5	-42.7	178.8	-75.3	-6.8	0	0	0	111.7	H216 S217 V218 S224	H216-N220 WeakPolarHBondContact O-CB 3.18Å; H216-N220 PolarHBondContact O-N 3.28Å; H216-N220 PolarHBondContact O-ND2 2.92Å; H216-N220 PolarHBondContact O-OD1 3.46Å; S217-N220 PolarHBondContact O-N 3.04Å; V218-N220 VanDerWaalsContact C-N 3.35Å; V218-N220 PolarHBondContact O-N 3.41Å; N220-S224 WeakPolarHBondContact O-CB 3.41Å; N220-S224 PolarHBondContact O-N 3.28Å; N220-S224 PolarHBondContact O-OG 3.12Å
221	V	78.1	Confident	70.6	Confident	24 Å²	24	43.4 Å²	43.4	15%	0.145	22%	0.224	C	C	.	.	H	α-helix	trans	-61.3	-48.2	175.8	169.5	0	0	0	0	110.3	F155 S217 V218 L219 S224 L225	F155-V221 HydrophobicContact CB-CG1 3.94Å; F155-V221 HydrophobicContact CD1-CG1 4Å; F155-V221 HydrophobicContact CD2-CG1 3.68Å; F155-V221 HydrophobicContact CE1-CG1 4.45Å; F155-V221 HydrophobicContact CE2-CG1 4.17Å; F155-V221 HydrophobicContact CG-CG1 3.6Å; S217-V221 VanDerWaalsContact O-CG2 3.31Å; S217-V221 WeakPolarHBondContact O-CG2 3.32Å; S217-V221 PolarHBondContact O-N 3.28Å; V218-V221 PolarHBondContact O-N 2.91Å; L219-V221 PolarHBondContact O-N 2.71Å; V221-S224 PolarHBondContact O-N 3.13Å; V221-L225 HydrophobicContact CG1-CD1 4.08Å; V221-L225 VanDerWaalsContact O-CG 3.27Å; V221-L225 WeakPolarHBondContact O-CG 3.27Å; V221-L225 PolarHBondContact O-N 3.15Å
222	L	77.4	Confident	71	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-44.1	-180	-68.8	173.9	0	0	0	112.5	I178 V218 L219 L225 V226 L268 L271	I178-L222 HydrophobicContact CD1-CD2 4.48Å; I178-L222 HydrophobicContact CG2-CD2 4.5Å; V218-L222 HydrophobicContact CG1-CD1 4.25Å; V218-L222 WeakPolarHBondContact O-CG 3.4Å; V218-L222 PolarHBondContact O-N 3.33Å; L219-L222 PolarHBondContact O-N 3.22Å; L222-L225 PolarHBondContact O-N 3.3Å; L222-V226 WeakPolarHBondContact O-CG2 3.34Å; L222-V226 PolarHBondContact O-N 3.46Å; L222-L268 HydrophobicContact CB-CD1 4.37Å; L222-L268 HydrophobicContact CB-CD2 3.58Å; L222-L268 HydrophobicContact CB-CG 3.8Å; L222-L268 HydrophobicContact CD1-CD2 3.85Å; L222-L268 HydrophobicContact CD1-CG 4.16Å; L222-L268 HydrophobicContact CG-CD2 4.38Å; L222-L271 HydrophobicContact CD1-CD2 4.15Å
223	H	79.4	Confident	71.1	Confident	65 Å²	65	44.3 Å²	44.3	30%	0.301	23%	0.226	S	C	.	.	H	α-helix	trans	-64.7	-41	174.9	-79	-61.3	0	0	0	112	L219 L225 V226 D227	L219-H223 WeakPolarHBondContact O-CB 3.46Å; L219-H223 PolarHBondContact O-CD2 3.05Å; L219-H223 PolarHBondContact O-N 3.43Å; H223-L225 VanDerWaalsContact C-N 3.28Å; H223-L225 PolarHBondContact O-N 3.27Å; H223-V226 CarbonylContact O-C 3.55Å; H223-V226 PolarHBondContact O-N 3.02Å; H223-V226 VanDerWaalsContact O-N 3.09Å; H223-D227 WeakPolarHBondContact O-CB 3.44Å; H223-D227 VanDerWaalsContact O-CG 3.29Å; H223-D227 PolarHBondContact O-N 2.79Å
224	S	76.4	Confident	71	Confident	54 Å²	54	44.3 Å²	44.3	38%	0.378	23%	0.226	S	C	.	.	H	α-helix	trans	-63	-36.4	176.9	-59.4	0	0	0	0	111.8	N220 V221 K228	N220-S224 WeakPolarHBondContact O-CB 3.41Å; N220-S224 PolarHBondContact O-N 3.28Å; N220-S224 PolarHBondContact O-OG 3.12Å; V221-S224 PolarHBondContact O-N 3.13Å; S224-K228 WeakPolarHBondContact O-CB 3.24Å; S224-K228 PolarHBondContact O-N 2.77Å
225	L	71.4	Confident	70.8	Confident	4 Å²	4	42.4 Å²	42.4	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-66.7	-39.9	173.2	-71.4	169.3	0	0	0	111.8	F155 I158 L159 I178 V221 L222 H223 S229 L260	F155-L225 HydrophobicContact CD1-CD1 3.92Å; F155-L225 HydrophobicContact CE1-CD1 3.91Å; I158-L225 HydrophobicContact CG2-CD2 4.26Å; L159-L225 HydrophobicContact CD2-CD2 3.62Å; L159-L225 HydrophobicContact CD2-CG 4.05Å; L159-L225 HydrophobicContact CG-CD2 4.04Å; I178-L225 HydrophobicContact CD1-CD1 4.38Å; V221-L225 HydrophobicContact CG1-CD1 4.08Å; V221-L225 VanDerWaalsContact O-CG 3.27Å; V221-L225 WeakPolarHBondContact O-CG 3.27Å; V221-L225 PolarHBondContact O-N 3.15Å; L222-L225 PolarHBondContact O-N 3.3Å; H223-L225 VanDerWaalsContact C-N 3.28Å; H223-L225 PolarHBondContact O-N 3.27Å; L225-S229 WeakPolarHBondContact O-CB 3.25Å; L225-S229 PolarHBondContact O-N 2.9Å; L225-S229 PolarHBondContact O-OG 3.41Å; L225-L260 HydrophobicContact CD2-CD2 3.61Å; L225-L260 HydrophobicContact CD2-CG 4.15Å
226	V	71.4	Confident	70.6	Confident	5 Å²	5	46.2 Å²	46.2	3%	0.03	23%	0.232	C	C	.	.	H	α-helix	trans	-66.7	-42.8	175.5	173	0	0	0	0	111.4	L222 H223 S229 N230 L265 L268	L222-V226 WeakPolarHBondContact O-CG2 3.34Å; L222-V226 PolarHBondContact O-N 3.46Å; H223-V226 CarbonylContact O-C 3.55Å; H223-V226 PolarHBondContact O-N 3.02Å; H223-V226 VanDerWaalsContact O-N 3.09Å; V226-S229 WeakPolarHBondContact CA-OG 3.07Å; V226-S229 PolarHBondContact O-N 3.49Å; V226-S229 PolarHBondContact O-OG 3.47Å; V226-N230 PolarHBondContact O-N 3.03Å; V226-L265 HydrophobicContact CB-CD2 4.5Å; V226-L265 HydrophobicContact CG1-CD2 3.84Å; V226-L265 HydrophobicContact CG2-CD2 3.75Å; V226-L265 HydrophobicContact CG2-CG 4Å; V226-L268 HydrophobicContact CG2-CD1 3.99Å
227	D	72.6	Confident	70	Confident	105 Å²	105	41.9 Å²	41.9	56%	0.561	21%	0.214	S	C	*	.	H	α-helix	trans	-69.5	-43.2	-179.3	-69.4	-21.6	0	0	0	111.2	H223 S229 N230	H223-D227 WeakPolarHBondContact O-CB 3.44Å; H223-D227 VanDerWaalsContact O-CG 3.29Å; H223-D227 PolarHBondContact O-N 2.79Å; D227-S229 VanDerWaalsContact C-N 3.3Å; D227-S229 PolarHBondContact O-N 3.4Å; D227-N230 PolarHBondContact O-N 2.93Å; D227-N230 PolarHBondContact O-OD1 2.92Å
228	K	68.9	Low	69.3	Low	42 Å²	42	45.1 Å²	45.1	18%	0.183	22%	0.221	C	C	.	.	H	α-helix	trans	-66.3	-32	176.8	-165.5	168.9	-173.7	-179.5	0	112.6	I158 L159 S224 Y257	I158-K228 PolarHBondContact O-NZ 3.25Å; L159-K228 VanDerWaalsContact C-NZ 3.3Å; L159-K228 HydrophobicContact CD2-CD 4.15Å; L159-K228 PolarHBondContact O-NZ 3.02Å; S224-K228 WeakPolarHBondContact O-CB 3.24Å; S224-K228 PolarHBondContact O-N 2.77Å; K228-Y257 HydrophobicContact CD-CE1 4.46Å
229	S	62.2	Low	68.5	Low	1 Å²	1	46.4 Å²	46.4	1%	0.007	23%	0.229	C	C	.	.	H	α-helix	trans	-82.1	-16.7	177	66.3	0	0	0	0	113.8	L225 V226 D227 I231 Q234 Y257	L225-S229 WeakPolarHBondContact O-CB 3.25Å; L225-S229 PolarHBondContact O-N 2.9Å; L225-S229 PolarHBondContact O-OG 3.41Å; V226-S229 WeakPolarHBondContact CA-OG 3.07Å; V226-S229 PolarHBondContact O-N 3.49Å; V226-S229 PolarHBondContact O-OG 3.47Å; D227-S229 VanDerWaalsContact C-N 3.3Å; D227-S229 PolarHBondContact O-N 3.4Å; S229-I231 PolarHBondContact O-N 2.95Å; S229-I231 VanDerWaalsContact OG-CD1 3.23Å; S229-I231 WeakPolarHBondContact OG-CD1 3.49Å; S229-I231 WeakPolarHBondContact OG-CG1 3.4Å; S229-Q234 PolarHBondContact O-NE2 3.36Å; S229-Q234 VanDerWaalsContact O-NE2 3.15Å; S229-Y257 VanDerWaalsContact CB-O 3.24Å; S229-Y257 WeakPolarHBondContact CB-O 3.45Å
230	N	64.1	Low	67.8	Low	54 Å²	54	49.5 Å²	49.5	29%	0.289	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	28.1	-176	-79.4	-50.4	0	0	0	114.2	V226 D227 N232 R233 Q234	V226-N230 PolarHBondContact O-N 3.03Å; D227-N230 PolarHBondContact O-N 2.93Å; D227-N230 PolarHBondContact O-OD1 2.92Å; N230-N232 VanDerWaalsContact C-N 3.29Å; N230-N232 PolarHBondContact O-N 3.42Å; N230-R233 PolarHBondContact O-N 3.09Å; N230-R233 VanDerWaalsContact O-N 3.15Å; N230-Q234 PolarHBondContact O-N 3.36Å; N230-Q234 VanDerWaalsContact O-N 3.13Å
231	I	65.1	Low	66.8	Low	4 Å²	4	48.1 Å²	48.1	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-64.7	-34	-170.7	-76.2	168.4	0	0	0	112.3	S229 R233 Q234 L235 K258 L265	S229-I231 PolarHBondContact O-N 2.95Å; S229-I231 VanDerWaalsContact OG-CD1 3.23Å; S229-I231 WeakPolarHBondContact OG-CD1 3.49Å; S229-I231 WeakPolarHBondContact OG-CG1 3.4Å; I231-R233 VanDerWaalsContact C-N 3.26Å; I231-R233 PolarHBondContact O-N 3.06Å; I231-Q234 PolarHBondContact O-N 2.98Å; I231-Q234 VanDerWaalsContact O-N 3.12Å; I231-L235 HydrophobicContact CG2-CD1 3.47Å; I231-L235 VanDerWaalsContact CG2-CD1 3.47Å; I231-L235 HydrophobicContact CG2-CG 3.75Å; I231-L235 WeakPolarHBondContact O-CB 3.19Å; I231-L235 VanDerWaalsContact O-CG 3.24Å; I231-L235 WeakPolarHBondContact O-CG 3.19Å; I231-L235 PolarHBondContact O-N 2.93Å; I231-K258 WeakPolarHBondContact CD1-O 3.31Å; I231-L265 HydrophobicContact CG2-CD1 3.82Å
232	N	64.2	Low	66	Low	51 Å²	51	48.4 Å²	48.4	27%	0.273	27%	0.271	S	S	.	.	H	α-helix	trans	-56.7	-43.3	177.4	-72.1	-22.2	0	0	0	111.4	N230 L235 E236 N287	N230-N232 VanDerWaalsContact C-N 3.29Å; N230-N232 PolarHBondContact O-N 3.42Å; N232-L235 PolarHBondContact O-N 3.34Å; N232-E236 VanDerWaalsContact O-CG 3.27Å; N232-E236 WeakPolarHBondContact O-CG 3.3Å; N232-E236 PolarHBondContact O-N 2.97Å; N232-N287 PolarHBondContact O-ND2 2.8Å
233	R	62.8	Low	64.9	Low	149 Å²	149	53.1 Å²	53.1	56%	0.562	30%	0.296	S	S	*	.	H	α-helix	trans	-71.5	-38.1	176.8	-64.6	-179.6	178.4	169.5	1.4	112.2	N230 I231 L235 E236 V237 V247	N230-R233 PolarHBondContact O-N 3.09Å; N230-R233 VanDerWaalsContact O-N 3.15Å; I231-R233 VanDerWaalsContact C-N 3.26Å; I231-R233 PolarHBondContact O-N 3.06Å; R233-L235 VanDerWaalsContact C-N 3.33Å; R233-L235 PolarHBondContact O-N 3.45Å; R233-E236 PolarHBondContact O-N 3.37Å; R233-V237 VanDerWaalsContact O-CG2 3.25Å; R233-V237 WeakPolarHBondContact O-CG2 3.42Å; R233-V237 PolarHBondContact O-N 2.66Å; R233-V247 HydrophobicContact CB-CG1 3.76Å
234	Q	59.4	Low	63.8	Low	6 Å²	6	51 Å²	51	3%	0.028	29%	0.288	C	S	.	.	H	α-helix	trans	-63.6	-38.9	175.2	-65.2	-174.5	22.5	0	0	112.3	S229 N230 I231 Y238 P244 A248 G252	S229-Q234 PolarHBondContact O-NE2 3.36Å; S229-Q234 VanDerWaalsContact O-NE2 3.15Å; N230-Q234 PolarHBondContact O-N 3.36Å; N230-Q234 VanDerWaalsContact O-N 3.13Å; I231-Q234 PolarHBondContact O-N 2.98Å; I231-Q234 VanDerWaalsContact O-N 3.12Å; Q234-Y238 WeakPolarHBondContact O-CB 3.43Å; Q234-Y238 PolarHBondContact O-N 3.01Å; Q234-P244 HydrophobicContact CB-CB 4.36Å; Q234-A248 HydrophobicContact CG-CB 4.18Å; Q234-A248 VanDerWaalsContact NE2-CB 3.28Å; Q234-G252 PolarHBondContact NE2-O 3.08Å
235	L	63.2	Low	62.7	Low	19 Å²	19	53.5 Å²	53.5	10%	0.099	29%	0.294	C	S	.	.	H	α-helix	trans	-72.4	-36.6	178.6	-71	176.7	0	0	0	112.2	I231 N232 R233 Y238 T239 L265 N287 I288 Y296	I231-L235 HydrophobicContact CG2-CD1 3.47Å; I231-L235 VanDerWaalsContact CG2-CD1 3.47Å; I231-L235 HydrophobicContact CG2-CG 3.75Å; I231-L235 WeakPolarHBondContact O-CB 3.19Å; I231-L235 VanDerWaalsContact O-CG 3.24Å; I231-L235 WeakPolarHBondContact O-CG 3.19Å; I231-L235 PolarHBondContact O-N 2.93Å; N232-L235 PolarHBondContact O-N 3.34Å; R233-L235 VanDerWaalsContact C-N 3.33Å; R233-L235 PolarHBondContact O-N 3.45Å; L235-Y238 PolarHBondContact O-N 2.94Å; L235-T239 WeakPolarHBondContact O-CB 3.33Å; L235-T239 PolarHBondContact O-N 3.4Å; L235-T239 PolarHBondContact O-OG1 2.8Å; L235-L265 HydrophobicContact CD1-CD1 4.22Å; L235-N287 HydrophobicContact CB-CB 4.11Å; L235-I288 HydrophobicContact CD1-CD1 4.45Å; L235-I288 HydrophobicContact CD1-CG1 3.68Å; L235-Y296 VanDerWaalsContact CD2-OH 3.25Å; L235-Y296 WeakPolarHBondContact CD2-OH 3.47Å
236	E	64.6	Low	62.1	Low	97 Å²	97	57.2 Å²	57.2	45%	0.453	32%	0.32	S	S	.	.	H	α-helix	trans	-60.4	-48	170.9	-77.2	165.8	-159.9	0	0	111	N232 R233 T239 S240 N287	N232-E236 VanDerWaalsContact O-CG 3.27Å; N232-E236 WeakPolarHBondContact O-CG 3.3Å; N232-E236 PolarHBondContact O-N 2.97Å; R233-E236 PolarHBondContact O-N 3.37Å; E236-T239 PolarHBondContact O-N 3.32Å; E236-S240 PolarHBondContact O-N 3.35Å; E236-S240 PolarHBondContact O-OG 3.26Å; E236-N287 PolarHBondContact OE1-ND2 3.43Å
237	V	59.5	Low	61.3	Low	30 Å²	30	59.7 Å²	59.7	18%	0.182	34%	0.335	C	S	.	.	H	α-helix	trans	-64.6	-42.8	178.6	174.1	0	0	0	0	111	R233 T239 S240 G241 G242 D243 V247	R233-V237 VanDerWaalsContact O-CG2 3.25Å; R233-V237 WeakPolarHBondContact O-CG2 3.42Å; R233-V237 PolarHBondContact O-N 2.66Å; V237-T239 VanDerWaalsContact C-N 3.34Å; V237-T239 PolarHBondContact O-N 3.35Å; V237-S240 WeakPolarHBondContact CA-OG 3.26Å; V237-S240 CarbonylContact O-C 3.59Å; V237-S240 PolarHBondContact O-N 2.82Å; V237-S240 PolarHBondContact O-OG 3.06Å; V237-G241 PolarHBondContact O-N 3.37Å; V237-G242 WeakPolarHBondContact O-CA 3.28Å; V237-G242 PolarHBondContact O-N 3.35Å; V237-D243 WeakPolarHBondContact CG1-O 3.48Å; V237-V247 HydrophobicContact CG2-CB 4.3Å; V237-V247 HydrophobicContact CG2-CG2 3.74Å
238	Y	61.5	Low	60.3	Low	107 Å²	107	54.8 Å²	54.8	42%	0.42	31%	0.309	S	S	.	.	H	α-helix	trans	-59.8	-43.6	174.9	-172	-104.9	0	0	0	112.3	Q234 L235 S240 G241 P244	Q234-Y238 WeakPolarHBondContact O-CB 3.43Å; Q234-Y238 PolarHBondContact O-N 3.01Å; L235-Y238 PolarHBondContact O-N 2.94Å; Y238-S240 VanDerWaalsContact C-N 3.31Å; Y238-S240 PolarHBondContact O-N 3.48Å; Y238-G241 PolarHBondContact O-N 2.99Å; Y238-P244 HydrophobicContact CD2-CG 3.62Å; Y238-P244 HydrophobicContact CG-CG 4.28Å
239	T	59	Low	59.9	Low	27 Å²	27	54.8 Å²	54.8	17%	0.166	32%	0.321	C	S	.	.	H	α-helix	trans	-67.1	-33.8	178.7	-57.2	0	0	0	0	111.9	L235 E236 V237 G241 E289 I497	L235-T239 WeakPolarHBondContact O-CB 3.33Å; L235-T239 PolarHBondContact O-N 3.4Å; L235-T239 PolarHBondContact O-OG1 2.8Å; E236-T239 PolarHBondContact O-N 3.32Å; V237-T239 VanDerWaalsContact C-N 3.34Å; V237-T239 PolarHBondContact O-N 3.35Å; T239-G241 PolarHBondContact O-N 2.9Å; T239-E289 HydrophobicContact CG2-CG 4.26Å; T239-E289 WeakPolarHBondContact CG2-OE1 3.37Å; T239-I497 HydrophobicContact CG2-CB 4.3Å; T239-I497 HydrophobicContact CG2-CD1 4.16Å; T239-I497 HydrophobicContact CG2-CG1 3.81Å; T239-I497 HydrophobicContact CG2-CG2 3.64Å
240	S	61.1	Low	59.5	Low	94 Å²	94	61.9 Å²	61.9	66%	0.657	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-2.1	172.2	73.8	0	0	0	0	114.3	E236 V237 Y238 G242	E236-S240 PolarHBondContact O-N 3.35Å; E236-S240 PolarHBondContact O-OG 3.26Å; V237-S240 WeakPolarHBondContact CA-OG 3.26Å; V237-S240 CarbonylContact O-C 3.59Å; V237-S240 PolarHBondContact O-N 2.82Å; V237-S240 PolarHBondContact O-OG 3.06Å; Y238-S240 VanDerWaalsContact C-N 3.31Å; Y238-S240 PolarHBondContact O-N 3.48Å; S240-G242 VanDerWaalsContact C-N 3.35Å
241	G	60.2	Low	59	Low	72 Å²	72	62.1 Å²	62.1	74%	0.742	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	13.6	-178.6	0	0	0	0	0	114.4	V237 Y238 T239	V237-G241 PolarHBondContact O-N 3.37Å; Y238-G241 PolarHBondContact O-N 2.99Å; T239-G241 PolarHBondContact O-N 2.9Å
242	G	60.9	Low	58.3	Low	30 Å²	30	62.1 Å²	62.1	31%	0.309	35%	0.352	S	S	.	.			trans	-88.6	168	175.6	0	0	0	0	0	113.2	V237 S240 P244	V237-G242 WeakPolarHBondContact O-CA 3.28Å; V237-G242 PolarHBondContact O-N 3.35Å; S240-G242 VanDerWaalsContact C-N 3.35Å; G242-P244 WeakPolarHBondContact O-CD 3.06Å
243	D	54.2	Low	58	Low	100 Å²	100	67.2 Å²	67.2	54%	0.535	37%	0.367	S	S	.	.			trans	-76.8	116.2	177.7	-177	15.5	0	0	0	111.2	V237 E245 S246	V237-D243 WeakPolarHBondContact CG1-O 3.48Å; D243-E245 PolarHBondContact O-N 3.35Å; D243-E245 VanDerWaalsContact O-N 3.16Å; D243-E245 PolarHBondContact OD1-N 2.88Å; D243-S246 PolarHBondContact O-N 3.42Å; D243-S246 PolarHBondContact O-OG 2.86Å
244	P	56.3	Low	58	Low	21 Å²	21	62 Å²	62	14%	0.136	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-61	-24.2	-178.6	-22.9	35.1	0	0	0	113.8	Q234 Y238 G242 S246 A248	Q234-P244 HydrophobicContact CB-CB 4.36Å; Y238-P244 HydrophobicContact CD2-CG 3.62Å; Y238-P244 HydrophobicContact CG-CG 4.28Å; G242-P244 WeakPolarHBondContact O-CD 3.06Å; P244-S246 VanDerWaalsContact C-N 3.25Å; P244-S246 PolarHBondContact O-N 2.88Å; P244-A248 WeakPolarHBondContact O-CB 3.36Å; P244-A248 PolarHBondContact O-N 3.09Å
245	E	54.8	Low	58.2	Low	105 Å²	105	64.2 Å²	64.2	49%	0.491	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-75.2	-16.6	-175	-152.2	166.6	164	0	0	113.2	D243 R253	D243-E245 PolarHBondContact O-N 3.35Å; D243-E245 VanDerWaalsContact O-N 3.16Å; D243-E245 PolarHBondContact OD1-N 2.88Å; E245-R253 HydrophobicContact CG-CG 3.79Å
246	S	57.5	Low	58.3	Low	83 Å²	83	63.6 Å²	63.6	58%	0.58	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-71.8	-28	177.5	65.7	0	0	0	0	113.7	D243 P244	D243-S246 PolarHBondContact O-N 3.42Å; D243-S246 PolarHBondContact O-OG 2.86Å; P244-S246 VanDerWaalsContact C-N 3.25Å; P244-S246 PolarHBondContact O-N 2.88Å
247	V	55	Low	58.4	Low	56 Å²	56	59.2 Å²	59.2	34%	0.339	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-3.7	-177	-173.5	0	0	0	0	112	R233 V237 G249	R233-V247 HydrophobicContact CB-CG1 3.76Å; V237-V247 HydrophobicContact CG2-CB 4.3Å; V237-V247 HydrophobicContact CG2-CG2 3.74Å; V247-G249 VanDerWaalsContact C-N 3.33Å; V247-G249 PolarHBondContact O-N 3.37Å
248	A	52.3	Low	58.8	Low	2 Å²	2	61.1 Å²	61.1	2%	0.017	35%	0.348	C	S	.	.	S	Bend	trans	-68.5	-23	-173.6	0	0	0	0	0	115.1	Q234 P244 G252 R253	Q234-A248 HydrophobicContact CG-CB 4.18Å; Q234-A248 VanDerWaalsContact NE2-CB 3.28Å; P244-A248 WeakPolarHBondContact O-CB 3.36Å; P244-A248 PolarHBondContact O-N 3.09Å; A248-G252 WeakPolarHBondContact O-CA 3.48Å; A248-G252 PolarHBondContact O-N 2.94Å; A248-R253 HydrophobicContact CB-CG 4.37Å
249	G	59.1	Low	59.1	Low	42 Å²	42	57.1 Å²	57.1	43%	0.433	33%	0.333	S	S	.	.	H	α-helix	trans	63.5	-174.9	-170	0	0	0	0	0	112.8	V247 Y251 R253	V247-G249 VanDerWaalsContact C-N 3.33Å; V247-G249 PolarHBondContact O-N 3.37Å; G249-Y251 VanDerWaalsContact C-N 3.34Å; G249-Y251 PolarHBondContact O-N 3.49Å; G249-R253 WeakPolarHBondContact O-CG 3.44Å
250	E	54.5	Low	59.7	Low	150 Å²	150	56 Å²	56	70%	0.701	33%	0.326	S	S	*	.	H	α-helix	trans	-66.9	-33.5	-179.3	-66.4	-178.9	168.7	0	0	112.7	H254	E250-H254 PolarHBondContact O-CD2 2.87Å
251	Y	53.4	Low	60.2	Low	60 Å²	60	51.6 Å²	51.6	24%	0.235	30%	0.295	C	S	.	.	H	α-helix	trans	-79.6	-36.1	179.3	-67.3	-80.7	0	0	0	113.6	A161 G163 P164 G249 R253 H254 Y257	A161-Y251 PolarHBondContact O-OH 3.28Å; G163-Y251 VanDerWaalsContact C-CE1 3.49Å; P164-Y251 HydrophobicContact CB-CD1 4.47Å; P164-Y251 HydrophobicContact CG-CD1 4.41Å; P164-Y251 HydrophobicContact CG-CE1 4.43Å; G249-Y251 VanDerWaalsContact C-N 3.34Å; G249-Y251 PolarHBondContact O-N 3.49Å; Y251-R253 VanDerWaalsContact C-N 3.33Å; Y251-R253 PolarHBondContact O-N 3.41Å; Y251-H254 PolarHBondContact O-N 3.11Å; Y251-Y257 HydrophobicContact CD1-CE2 4.06Å; Y251-Y257 VanDerWaalsContact O-CB 3.31Å; Y251-Y257 WeakPolarHBondContact O-CB 3.28Å; Y251-Y257 WeakPolarHBondContact O-CD2 3.49Å
252	G	51.4	Low	60.8	Low	3 Å²	3	49 Å²	49	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-79.6	-11.1	-175.8	0	0	0	0	0	115.1	Q234 A248 H254	Q234-G252 PolarHBondContact NE2-O 3.08Å; A248-G252 WeakPolarHBondContact O-CA 3.48Å; A248-G252 PolarHBondContact O-N 2.94Å; G252-H254 VanDerWaalsContact C-N 3.26Å
253	R	56.6	Low	61.4	Low	159 Å²	159	47.9 Å²	47.9	60%	0.6	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-27	171.4	-75.8	-180	179.1	174.2	0.7	112.2	E245 A248 G249 Y251	E245-R253 HydrophobicContact CG-CG 3.79Å; A248-R253 HydrophobicContact CB-CG 4.37Å; G249-R253 WeakPolarHBondContact O-CG 3.44Å; Y251-R253 VanDerWaalsContact C-N 3.33Å; Y251-R253 PolarHBondContact O-N 3.41Å
254	H	63.4	Low	62.4	Low	39 Å²	39	43.1 Å²	43.1	18%	0.181	22%	0.224	C	C	.	.	S	Bend	trans	-77.3	132.3	178.9	-69.9	-74.8	0	0	0	111.8	L65 P164 E250 Y251 G252 L256 Y257 K258	L65-H254 VanDerWaalsContact CD2-CE1 3.44Å; L65-H254 WeakPolarHBondContact CD2-CE1 3.46Å; P164-H254 VanDerWaalsContact CB-CD2 3.47Å; P164-H254 WeakPolarHBondContact CB-CD2 3.47Å; P164-H254 WeakPolarHBondContact CB-NE2 3.37Å; P164-H254 WeakPolarHBondContact CG-NE2 3.34Å; E250-H254 PolarHBondContact O-CD2 2.87Å; Y251-H254 PolarHBondContact O-N 3.11Å; G252-H254 VanDerWaalsContact C-N 3.26Å; H254-L256 PolarHBondContact O-N 2.92Å; H254-Y257 HydrophobicContact CB-CD2 4.04Å; H254-Y257 PolarHBondContact O-N 2.85Å; H254-K258 PolarHBondContact O-N 3.32Å; H254-K258 VanDerWaalsContact O-N 3.16Å
255	S	63.7	Low	63.4	Low	53 Å²	53	42.2 Å²	42.2	37%	0.371	22%	0.218	S	C	.	.	H	α-helix	trans	-56.3	-36.4	179.5	-172.4	0	0	0	0	112.2	M259	S255-M259 WeakPolarHBondContact O-CB 3.41Å; S255-M259 VanDerWaalsContact O-CG 3.28Å; S255-M259 WeakPolarHBondContact O-CG 3.26Å; S255-M259 PolarHBondContact O-N 3.24Å
256	L	65.3	Low	64.4	Low	6 Å²	6	37.3 Å²	37.3	3%	0.031	20%	0.195	C	C	.	.	H	α-helix	trans	-61	-54	177.6	-179.8	124	0	0	0	112.2	L167 E168 L169 L174 H254 K258 M259 L260	L167-L256 VanDerWaalsContact O-CD1 3.32Å; L167-L256 WeakPolarHBondContact O-CD1 3.24Å; E168-L256 HydrophobicContact CG-CB 4.38Å; L169-L256 HydrophobicContact CB-CD1 4.49Å; L174-L256 HydrophobicContact CD1-CD1 4.1Å; L174-L256 HydrophobicContact CD1-CG 4.25Å; L174-L256 HydrophobicContact CD2-CD1 3.88Å; L174-L256 HydrophobicContact CD2-CG 4.47Å; H254-L256 PolarHBondContact O-N 2.92Å; L256-K258 VanDerWaalsContact C-N 3.32Å; L256-K258 PolarHBondContact O-N 3.49Å; L256-M259 PolarHBondContact O-N 2.71Å; L256-L260 HydrophobicContact CD2-CD2 4.5Å; L256-L260 WeakPolarHBondContact O-CB 3.38Å; L256-L260 PolarHBondContact O-N 2.89Å
257	Y	66.3	Low	65.4	Low	4 Å²	4	33.4 Å²	33.4	2%	0.016	17%	0.168	C	C	.	.	H	α-helix	trans	-66.9	-35.4	-178.1	-72	-77.3	0	0	0	111.9	I158 P164 A165 K228 S229 Y251 H254 G261	I158-Y257 HydrophobicContact CG2-CE1 3.72Å; I158-Y257 PolarHBondContact O-OH 2.91Å; I158-Y257 VanDerWaalsContact O-OH 3.13Å; P164-Y257 HydrophobicContact CB-CE2 4.39Å; A165-Y257 WeakPolarHBondContact CB-OH 3.41Å; A165-Y257 PolarHBondContact N-OH 2.82Å; K228-Y257 HydrophobicContact CD-CE1 4.46Å; S229-Y257 VanDerWaalsContact CB-O 3.24Å; S229-Y257 WeakPolarHBondContact CB-O 3.45Å; Y251-Y257 HydrophobicContact CD1-CE2 4.06Å; Y251-Y257 VanDerWaalsContact O-CB 3.31Å; Y251-Y257 WeakPolarHBondContact O-CB 3.28Å; Y251-Y257 WeakPolarHBondContact O-CD2 3.49Å; H254-Y257 HydrophobicContact CB-CD2 4.04Å; H254-Y257 PolarHBondContact O-N 2.85Å; Y257-G261 PolarHBondContact O-N 3.43Å
258	K	67.5	Low	66.6	Low	71 Å²	71	30.8 Å²	30.8	31%	0.309	15%	0.152	S	C	.	.	H	α-helix	trans	-64.3	-40.2	174.9	-175.6	173.8	-176.6	171	0	112.7	I231 H254 L256	I231-K258 WeakPolarHBondContact CD1-O 3.31Å; H254-K258 PolarHBondContact O-N 3.32Å; H254-K258 VanDerWaalsContact O-N 3.16Å; L256-K258 VanDerWaalsContact C-N 3.32Å; L256-K258 PolarHBondContact O-N 3.49Å
259	M	69.3	Low	67.9	Low	23 Å²	23	30.7 Å²	30.7	11%	0.113	15%	0.151	C	C	.	.	H	α-helix	trans	-79.2	-40	177.7	-67.6	-67.3	-178.2	0	0	111.5	N171 L174 S255 L256 Y262 F263	N171-M259 WeakPolarHBondContact OD1-CG 3.32Å; L174-M259 HydrophobicContact CD1-CB 4.41Å; S255-M259 WeakPolarHBondContact O-CB 3.41Å; S255-M259 VanDerWaalsContact O-CG 3.28Å; S255-M259 WeakPolarHBondContact O-CG 3.26Å; S255-M259 PolarHBondContact O-N 3.24Å; L256-M259 PolarHBondContact O-N 2.71Å; M259-Y262 WeakPolarHBondContact O-CB 3.23Å; M259-Y262 PolarHBondContact O-N 2.9Å; M259-F263 HydrophobicContact CB-CD2 4.4Å; M259-F263 HydrophobicContact CB-CE2 3.93Å; M259-F263 WeakPolarHBondContact O-CD2 3.23Å; M259-F263 VanDerWaalsContact O-CG 3.29Å; M259-F263 WeakPolarHBondContact O-CG 3.48Å; M259-F263 PolarHBondContact O-N 2.93Å
260	L	71.3	Confident	68.9	Low	4 Å²	4	29.4 Å²	29.4	2%	0.021	13%	0.134	C	C	.	.	H	α-helix	trans	-63.7	-45.2	-179.8	-176.5	63.5	0	0	0	112.3	I158 I178 L225 L256 Y262 F263 S264	I158-L260 HydrophobicContact CD1-CD2 4.47Å; I158-L260 HydrophobicContact CG2-CD2 3.83Å; I178-L260 HydrophobicContact CD1-CD1 3.94Å; I178-L260 HydrophobicContact CG1-CD1 4.04Å; L225-L260 HydrophobicContact CD2-CD2 3.61Å; L225-L260 HydrophobicContact CD2-CG 4.15Å; L256-L260 HydrophobicContact CD2-CD2 4.5Å; L256-L260 WeakPolarHBondContact O-CB 3.38Å; L256-L260 PolarHBondContact O-N 2.89Å; L260-Y262 VanDerWaalsContact C-N 3.29Å; L260-Y262 PolarHBondContact O-N 3.32Å; L260-F263 PolarHBondContact O-N 3.13Å; L260-S264 WeakPolarHBondContact O-CB 3.41Å; L260-S264 PolarHBondContact O-N 3.49Å; L260-S264 PolarHBondContact O-OG 2.89Å
261	G	71.7	Confident	70.1	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-69.4	-29.1	176.8	0	0	0	0	0	112.1	Y257 S264 L265	Y257-G261 PolarHBondContact O-N 3.43Å; G261-S264 WeakPolarHBondContact O-CB 3.18Å; G261-S264 PolarHBondContact O-N 2.8Å; G261-L265 WeakPolarHBondContact O-CG 3.21Å; G261-L265 PolarHBondContact O-N 3.42Å
262	Y	72.7	Confident	71.4	Confident	18 Å²	18	20 Å²	20	7%	0.071	9%	0.092	C	C	.	.	H	α-helix	trans	-68.5	-46.6	173.6	174.1	-94.9	0	0	0	110.9	M259 L260 S264 L265 V266 I288 Y296	M259-Y262 WeakPolarHBondContact O-CB 3.23Å; M259-Y262 PolarHBondContact O-N 2.9Å; L260-Y262 VanDerWaalsContact C-N 3.29Å; L260-Y262 PolarHBondContact O-N 3.32Å; Y262-S264 PolarHBondContact O-N 3.45Å; Y262-L265 WeakPolarHBondContact O-CB 3.36Å; Y262-L265 PolarHBondContact O-N 3.25Å; Y262-L265 VanDerWaalsContact O-N 3.08Å; Y262-V266 HydrophobicContact CE1-CG2 4.04Å; Y262-V266 PolarHBondContact O-N 2.87Å; Y262-V266 VanDerWaalsContact O-N 3.09Å; Y262-I288 HydrophobicContact CD2-CD1 4.07Å; Y262-I288 HydrophobicContact CE2-CD1 3.68Å; Y262-I288 HydrophobicContact CE2-CG1 4.16Å; Y262-I288 HydrophobicContact CE2-CG2 4.33Å; Y262-Y296 HydrophobicContact CD1-CD1 4.45Å; Y262-Y296 HydrophobicContact CD2-CD1 4.11Å; Y262-Y296 AromaticContact CD2-CE1 3.67Å; Y262-Y296 HydrophobicContact CD2-CE1 3.67Å; Y262-Y296 AromaticContact CE1-CD1 3.82Å; Y262-Y296 HydrophobicContact CE1-CD1 3.82Å; Y262-Y296 HydrophobicContact CE1-CE1 4.37Å; Y262-Y296 AromaticContact CE2-CD1 3.4Å; Y262-Y296 HydrophobicContact CE2-CD1 3.4Å; Y262-Y296 VanDerWaalsContact CE2-CD1 3.4Å; Y262-Y296 AromaticContact CE2-CE1 3.16Å; Y262-Y296 HydrophobicContact CE2-CE1 3.16Å; Y262-Y296 HydrophobicContact CE2-CG 4.37Å; Y262-Y296 AromaticContact CE2-CZ 3.95Å; Y262-Y296 HydrophobicContact CG-CE1 4.43Å; Y262-Y296 AromaticContact CZ-CD1 3.24Å; Y262-Y296 AromaticContact CZ-CE1 3.59Å; Y262-Y296 WeakPolarHBondContact OH-CD1 3.26Å
263	F	73.7	Confident	72.6	Confident	6 Å²	6	19.9 Å²	19.9	3%	0.026	9%	0.09	C	C	.	.	H	α-helix	trans	-61.5	-32.8	172.8	-62.3	-42.7	0	0	0	111.6	N171 L174 W175 I178 M259 L260 V266 G267 V299 C302	N171-F263 HydrophobicContact CB-CZ 4.33Å; N171-F263 VanDerWaalsContact O-CE2 3.26Å; N171-F263 WeakPolarHBondContact O-CE2 3.08Å; N171-F263 WeakPolarHBondContact O-CZ 3.37Å; L174-F263 HydrophobicContact CB-CD2 3.94Å; L174-F263 HydrophobicContact CB-CE2 3.88Å; W175-F263 HydrophobicContact CB-CD1 4.25Å; W175-F263 HydrophobicContact CB-CD2 4.41Å; W175-F263 HydrophobicContact CB-CE1 4.09Å; W175-F263 HydrophobicContact CB-CE2 4.26Å; W175-F263 HydrophobicContact CB-CG 4.41Å; W175-F263 HydrophobicContact CB-CZ 4.1Å; W175-F263 HydrophobicContact CD2-CD1 4.32Å; W175-F263 HydrophobicContact CE3-CB 4.1Å; W175-F263 AromaticContact CE3-CD1 3.47Å; W175-F263 HydrophobicContact CE3-CD1 3.47Å; W175-F263 VanDerWaalsContact CE3-CD1 3.47Å; W175-F263 HydrophobicContact CE3-CE1 4.14Å; W175-F263 AromaticContact CE3-CG 3.97Å; W175-F263 HydrophobicContact CE3-CG 3.97Å; W175-F263 HydrophobicContact CZ3-CD1 4.23Å; I178-F263 HydrophobicContact CG1-CB 4.24Å; M259-F263 HydrophobicContact CB-CD2 4.4Å; M259-F263 HydrophobicContact CB-CE2 3.93Å; M259-F263 WeakPolarHBondContact O-CD2 3.23Å; M259-F263 VanDerWaalsContact O-CG 3.29Å; M259-F263 WeakPolarHBondContact O-CG 3.48Å; M259-F263 PolarHBondContact O-N 2.93Å; L260-F263 PolarHBondContact O-N 3.13Å; F263-V266 PolarHBondContact O-N 2.84Å; F263-G267 PolarHBondContact O-N 3.37Å; F263-V299 HydrophobicContact CZ-CG2 4.38Å; F263-C302 HydrophobicContact CD1-CB 4.49Å; F263-C302 HydrophobicContact CE1-CB 4.17Å
264	S	75.4	Confident	73.5	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-66.9	-36.6	172.8	-57.1	0	0	0	0	112.4	L260 G261 Y262 G267 L268	L260-S264 WeakPolarHBondContact O-CB 3.41Å; L260-S264 PolarHBondContact O-N 3.49Å; L260-S264 PolarHBondContact O-OG 2.89Å; G261-S264 WeakPolarHBondContact O-CB 3.18Å; G261-S264 PolarHBondContact O-N 2.8Å; Y262-S264 PolarHBondContact O-N 3.45Å; S264-G267 CarbonylContact O-C 3.54Å; S264-G267 PolarHBondContact O-N 3.2Å; S264-L268 WeakPolarHBondContact O-CB 3.33Å; S264-L268 VanDerWaalsContact O-CG 3.32Å; S264-L268 WeakPolarHBondContact O-CG 3.48Å; S264-L268 PolarHBondContact O-N 2.98Å
265	L	77	Confident	73.8	Confident	2 Å²	2	11.6 Å²	11.6	1%	0.01	6%	0.059	C	C	.	.	H	α-helix	trans	-62.8	-43.7	171.6	-68.8	171.5	0	0	0	111.7	V226 I231 L235 G261 Y262 G267 L268 L269 V284 I288	V226-L265 HydrophobicContact CB-CD2 4.5Å; V226-L265 HydrophobicContact CG1-CD2 3.84Å; V226-L265 HydrophobicContact CG2-CD2 3.75Å; V226-L265 HydrophobicContact CG2-CG 4Å; I231-L265 HydrophobicContact CG2-CD1 3.82Å; L235-L265 HydrophobicContact CD1-CD1 4.22Å; G261-L265 WeakPolarHBondContact O-CG 3.21Å; G261-L265 PolarHBondContact O-N 3.42Å; Y262-L265 WeakPolarHBondContact O-CB 3.36Å; Y262-L265 PolarHBondContact O-N 3.25Å; Y262-L265 VanDerWaalsContact O-N 3.08Å; L265-G267 VanDerWaalsContact C-N 3.3Å; L265-G267 PolarHBondContact O-N 2.86Å; L265-L268 PolarHBondContact O-N 3.34Å; L265-L269 PolarHBondContact O-N 2.75Å; L265-V284 HydrophobicContact CB-CG1 4.4Å; L265-V284 HydrophobicContact CD2-CG1 3.61Å; L265-I288 HydrophobicContact CB-CD1 4.22Å; L265-I288 HydrophobicContact CD1-CD1 3.91Å
266	V	76.4	Confident	74.1	Confident	1 Å²	1	10.1 Å²	10.1	1%	0.006	5%	0.052	C	C	.	.	H	α-helix	trans	-65.5	-36.8	174.8	178.5	0	0	0	0	111	W175 Y262 F263 L269 R270 T306	W175-V266 HydrophobicContact CH2-CB 4.41Å; W175-V266 HydrophobicContact CH2-CG1 3.54Å; W175-V266 HydrophobicContact CZ3-CB 3.94Å; W175-V266 HydrophobicContact CZ3-CG1 3.56Å; Y262-V266 HydrophobicContact CE1-CG2 4.04Å; Y262-V266 PolarHBondContact O-N 2.87Å; Y262-V266 VanDerWaalsContact O-N 3.09Å; F263-V266 PolarHBondContact O-N 2.84Å; V266-L269 WeakPolarHBondContact O-CB 3.45Å; V266-L269 PolarHBondContact O-N 3.24Å; V266-R270 PolarHBondContact O-N 3.04Å; V266-T306 VanDerWaalsContact CG1-OG1 3.22Å; V266-T306 WeakPolarHBondContact CG1-OG1 3.38Å; V266-T306 HydrophobicContact CG2-CG2 4.48Å; V266-T306 WeakPolarHBondContact CG2-OG1 3.42Å
267	G	77.6	Confident	74.8	Confident	1 Å²	1	14.3 Å²	14.3	1%	0.01	8%	0.075	C	C	.	.	H	α-helix	trans	-63.8	-42.2	173.7	0	0	0	0	0	113.1	F263 S264 L265 R270 L271	F263-G267 PolarHBondContact O-N 3.37Å; S264-G267 CarbonylContact O-C 3.54Å; S264-G267 PolarHBondContact O-N 3.2Å; L265-G267 VanDerWaalsContact C-N 3.3Å; L265-G267 PolarHBondContact O-N 2.86Å; G267-R270 PolarHBondContact O-N 3.35Å; G267-L271 WeakPolarHBondContact O-CB 3.44Å; G267-L271 PolarHBondContact O-N 3.03Å
268	L	80.5	Confident	75.3	Confident	1 Å²	1	15.2 Å²	15.2	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-63.5	-43.4	173.5	-76.2	171.3	0	0	0	111.5	L219 L222 V226 S264 L265 R270 L271 H272 V284	L219-L268 HydrophobicContact CD2-CD2 3.76Å; L222-L268 HydrophobicContact CB-CD1 4.37Å; L222-L268 HydrophobicContact CB-CD2 3.58Å; L222-L268 HydrophobicContact CB-CG 3.8Å; L222-L268 HydrophobicContact CD1-CD2 3.85Å; L222-L268 HydrophobicContact CD1-CG 4.16Å; L222-L268 HydrophobicContact CG-CD2 4.38Å; V226-L268 HydrophobicContact CG2-CD1 3.99Å; S264-L268 WeakPolarHBondContact O-CB 3.33Å; S264-L268 VanDerWaalsContact O-CG 3.32Å; S264-L268 WeakPolarHBondContact O-CG 3.48Å; S264-L268 PolarHBondContact O-N 2.98Å; L265-L268 PolarHBondContact O-N 3.34Å; L268-R270 VanDerWaalsContact C-N 3.32Å; L268-R270 PolarHBondContact O-N 2.83Å; L268-L271 PolarHBondContact O-N 3.13Å; L268-H272 WeakPolarHBondContact O-CB 3.49Å; L268-H272 PolarHBondContact O-CD2 3.1Å; L268-H272 PolarHBondContact O-N 3.31Å; L268-V284 HydrophobicContact CB-CG1 3.86Å; L268-V284 HydrophobicContact CD1-CG1 4.09Å
269	L	79	Confident	75.7	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-53.8	-51.2	171.7	165.3	77.2	0	0	0	110.5	L265 V266 L271 S273 A281 L285 T306 V310	L265-L269 PolarHBondContact O-N 2.75Å; V266-L269 WeakPolarHBondContact O-CB 3.45Å; V266-L269 PolarHBondContact O-N 3.24Å; L269-L271 VanDerWaalsContact C-N 3.35Å; L269-L271 PolarHBondContact O-N 2.86Å; L269-S273 VanDerWaalsContact O-CB 3.27Å; L269-S273 WeakPolarHBondContact O-CB 3.43Å; L269-S273 PolarHBondContact O-N 3.34Å; L269-S273 PolarHBondContact O-OG 3.25Å; L269-A281 HydrophobicContact CD1-CB 3.85Å; L269-L285 HydrophobicContact CB-CD1 4.24Å; L269-L285 HydrophobicContact CB-CD2 4.36Å; L269-L285 HydrophobicContact CB-CG 4.3Å; L269-L285 HydrophobicContact CD1-CD1 3.55Å; L269-L285 HydrophobicContact CD1-CG 4.26Å; L269-L285 HydrophobicContact CD2-CD1 3.78Å; L269-L285 HydrophobicContact CG-CD1 3.98Å; L269-T306 HydrophobicContact CD2-CG2 4.09Å; L269-V310 HydrophobicContact CD1-CG2 4.17Å; L269-V310 HydrophobicContact CD2-CG2 3.93Å
270	R	80.2	Confident	75.9	Confident	15 Å²	15	20.6 Å²	20.6	6%	0.057	10%	0.099	C	C	.	.	H	α-helix	trans	-59.3	-47.4	-179.9	174.1	170.7	179.6	-153.4	-8.8	110.5	D179 I182 V266 G267 L268 S273 L274 Y309	D179-R270 VanDerWaalsContact CG-NH1 3.32Å; D179-R270 PolarHBondContact O-NH1 3.48Å; D179-R270 VanDerWaalsContact O-NH1 3.15Å; D179-R270 IonicContact OD1-CZ 3.27Å; D179-R270 IonicContact OD1-NH1 2.95Å; D179-R270 PolarHBondContact OD1-NH1 3.29Å; D179-R270 IonicContact OD2-NH1 3.21Å; I182-R270 HydrophobicContact CG2-CG 3.99Å; V266-R270 PolarHBondContact O-N 3.04Å; G267-R270 PolarHBondContact O-N 3.35Å; L268-R270 VanDerWaalsContact C-N 3.32Å; L268-R270 PolarHBondContact O-N 2.83Å; R270-S273 PolarHBondContact O-N 3.5Å; R270-L274 HydrophobicContact CG-CD1 3.91Å; R270-L274 HydrophobicContact CG-CG 4.49Å; R270-L274 WeakPolarHBondContact O-CB 3.36Å; R270-L274 WeakPolarHBondContact O-CG 3.42Å; R270-L274 PolarHBondContact O-N 2.84Å; R270-Y309 HydrophobicContact CB-CD2 4.05Å; R270-Y309 HydrophobicContact CB-CE2 3.9Å; R270-Y309 HydrophobicContact CG-CD2 4.21Å; R270-Y309 HydrophobicContact CG-CE1 4.15Å; R270-Y309 HydrophobicContact CG-CE2 3.57Å; R270-Y309 PolarHBondContact NE-OH 3.49Å
271	L	80.4	Confident	76.1	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-64.5	-48.1	-178.9	-174.7	57.5	0	0	0	112.2	F185 V218 L219 L222 G267 L268 L269 S273 L274 L275	F185-L271 HydrophobicContact CD1-CD1 3.87Å; F185-L271 HydrophobicContact CE1-CD1 3.57Å; V218-L271 HydrophobicContact CG1-CD2 3.77Å; L219-L271 HydrophobicContact CD2-CD2 3.54Å; L219-L271 HydrophobicContact CD2-CG 4.3Å; L219-L271 HydrophobicContact CG-CD2 3.88Å; L222-L271 HydrophobicContact CD1-CD2 4.15Å; G267-L271 WeakPolarHBondContact O-CB 3.44Å; G267-L271 PolarHBondContact O-N 3.03Å; L268-L271 PolarHBondContact O-N 3.13Å; L269-L271 VanDerWaalsContact C-N 3.35Å; L269-L271 PolarHBondContact O-N 2.86Å; L271-S273 VanDerWaalsContact C-N 3.31Å; L271-S273 PolarHBondContact O-N 3.09Å; L271-L274 WeakPolarHBondContact O-CB 3.43Å; L271-L274 PolarHBondContact O-N 2.96Å; L271-L274 VanDerWaalsContact O-N 3.11Å; L271-L275 HydrophobicContact CD1-CD1 4.29Å; L271-L275 HydrophobicContact CD1-CG 4.37Å; L271-L275 HydrophobicContact CG-CD1 4.05Å; L271-L275 VanDerWaalsContact O-CG 3.26Å; L271-L275 WeakPolarHBondContact O-CG 3.26Å; L271-L275 PolarHBondContact O-N 2.72Å
272	H	79.3	Confident	76.2	Confident	13 Å²	13	20.5 Å²	20.5	6%	0.06	10%	0.098	C	C	.	.	H	α-helix	trans	-62.5	-38	176.4	-75	-61.1	0	0	0	112.3	L268 L274 L275 G276 D277 A281	L268-H272 WeakPolarHBondContact O-CB 3.49Å; L268-H272 PolarHBondContact O-CD2 3.1Å; L268-H272 PolarHBondContact O-N 3.31Å; H272-L274 VanDerWaalsContact C-N 3.31Å; H272-L274 PolarHBondContact O-N 3.16Å; H272-L275 PolarHBondContact O-N 3.32Å; H272-G276 PolarHBondContact O-N 3.37Å; H272-D277 PolarHBondContact O-N 2.86Å; H272-A281 HydrophobicContact CB-CB 3.67Å
273	S	76.9	Confident	76.3	Confident	0 Å²	0	24 Å²	24	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-65.1	-34.7	174.1	-58	0	0	0	0	112.3	L269 R270 L271	L269-S273 VanDerWaalsContact O-CB 3.27Å; L269-S273 WeakPolarHBondContact O-CB 3.43Å; L269-S273 PolarHBondContact O-N 3.34Å; L269-S273 PolarHBondContact O-OG 3.25Å; R270-S273 PolarHBondContact O-N 3.5Å; L271-S273 VanDerWaalsContact C-N 3.31Å; L271-S273 PolarHBondContact O-N 3.09Å
274	L	75.1	Confident	76.1	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-73.1	-32.6	175.7	-71.9	169	0	0	0	112.7	I182 R270 L271 H272 G276 P409 K410 L412	I182-L274 HydrophobicContact CG2-CD1 4.37Å; R270-L274 HydrophobicContact CG-CD1 3.91Å; R270-L274 HydrophobicContact CG-CG 4.49Å; R270-L274 WeakPolarHBondContact O-CB 3.36Å; R270-L274 WeakPolarHBondContact O-CG 3.42Å; R270-L274 PolarHBondContact O-N 2.84Å; L271-L274 WeakPolarHBondContact O-CB 3.43Å; L271-L274 PolarHBondContact O-N 2.96Å; L271-L274 VanDerWaalsContact O-N 3.11Å; H272-L274 VanDerWaalsContact C-N 3.31Å; H272-L274 PolarHBondContact O-N 3.16Å; L274-G276 VanDerWaalsContact C-N 3.35Å; L274-P409 HydrophobicContact CD2-CB 3.87Å; L274-K410 VanDerWaalsContact CD2-O 3.28Å; L274-K410 WeakPolarHBondContact CD2-O 3.36Å; L274-L412 HydrophobicContact CB-CD1 4.13Å; L274-L412 HydrophobicContact CB-CG 4.23Å; L274-L412 HydrophobicContact CD1-CD1 4.1Å; L274-L412 PolarHBondContact O-N 2.92Å
275	L	71.4	Confident	75.8	Confident	25 Å²	25	24.7 Å²	24.7	13%	0.131	12%	0.119	C	C	.	.	H	α-helix	trans	-78.3	-19.1	176.5	-63.8	168.9	0	0	0	112.6	V215 L271 H272 P414	V215-L275 HydrophobicContact CG1-CD1 3.96Å; V215-L275 HydrophobicContact CG1-CD2 4.27Å; V215-L275 HydrophobicContact CG2-CD2 4.46Å; L271-L275 HydrophobicContact CD1-CD1 4.29Å; L271-L275 HydrophobicContact CD1-CG 4.37Å; L271-L275 HydrophobicContact CG-CD1 4.05Å; L271-L275 VanDerWaalsContact O-CG 3.26Å; L271-L275 WeakPolarHBondContact O-CG 3.26Å; L271-L275 PolarHBondContact O-N 2.72Å; H272-L275 PolarHBondContact O-N 3.32Å; L275-P414 HydrophobicContact CD2-CB 3.94Å; L275-P414 HydrophobicContact CD2-CG 3.71Å
276	G	70.3	Confident	75.1	Confident	21 Å²	21	26.9 Å²	26.9	22%	0.216	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.9	4.1	179.3	0	0	0	0	0	114.9	H272 L274 Y278	H272-G276 PolarHBondContact O-N 3.37Å; L274-G276 VanDerWaalsContact C-N 3.35Å; G276-Y278 VanDerWaalsContact O-CD2 3.31Å; G276-Y278 WeakPolarHBondContact O-CD2 3.49Å; G276-Y278 WeakPolarHBondContact O-CE2 3.48Å; G276-Y278 PolarHBondContact O-N 3.49Å; G276-Y278 VanDerWaalsContact O-N 3.15Å
277	D	78.8	Confident	74.2	Confident	94 Å²	94	28.1 Å²	28.1	50%	0.503	14%	0.135	S	C	.	.			trans	-88.1	71.8	178.4	-70.1	-35.7	0	0	0	111.2	H272 Y279 Q280 A281	H272-D277 PolarHBondContact O-N 2.86Å; D277-Y279 VanDerWaalsContact C-N 3.32Å; D277-Y279 PolarHBondContact O-N 2.9Å; D277-Q280 HydrophobicContact CB-CB 4.27Å; D277-Q280 PolarHBondContact O-N 3.49Å; D277-A281 WeakPolarHBondContact O-CB 3.1Å; D277-A281 PolarHBondContact O-N 3.43Å
278	Y	76.6	Confident	73.6	Confident	23 Å²	23	28.3 Å²	28.3	9%	0.09	14%	0.136	C	C	.	.	H	α-helix	trans	-64	-33.6	-175	-55.5	-63.4	0	0	0	113.6	G276 A281 I282 F312 A313 M316 F411 Q434	G276-Y278 VanDerWaalsContact O-CD2 3.31Å; G276-Y278 WeakPolarHBondContact O-CD2 3.49Å; G276-Y278 WeakPolarHBondContact O-CE2 3.48Å; G276-Y278 PolarHBondContact O-N 3.49Å; G276-Y278 VanDerWaalsContact O-N 3.15Å; Y278-A281 WeakPolarHBondContact O-CB 3.34Å; Y278-A281 PolarHBondContact O-N 2.88Å; Y278-I282 WeakPolarHBondContact O-CG1 3.18Å; Y278-I282 PolarHBondContact O-N 2.7Å; Y278-I282 VanDerWaalsContact O-N 3.15Å; Y278-F312 AromaticContact CE1-CD1 3.91Å; Y278-F312 HydrophobicContact CE1-CD1 3.91Å; Y278-F312 AromaticContact CE1-CE1 3.58Å; Y278-F312 HydrophobicContact CE1-CE1 3.58Å; Y278-F312 AromaticContact CZ-CE1 3.84Å; Y278-F312 WeakPolarHBondContact OH-CE1 3.34Å; Y278-A313 HydrophobicContact CD1-CB 4.04Å; Y278-M316 HydrophobicContact CD1-CB 4.18Å; Y278-M316 HydrophobicContact CD1-CG 4.45Å; Y278-M316 HydrophobicContact CD2-CB 3.53Å; Y278-M316 HydrophobicContact CD2-CG 4.25Å; Y278-M316 HydrophobicContact CE1-CB 4.2Å; Y278-M316 HydrophobicContact CE1-CG 4.01Å; Y278-M316 HydrophobicContact CE2-CB 3.55Å; Y278-M316 HydrophobicContact CE2-CE 3.92Å; Y278-M316 HydrophobicContact CE2-CG 3.77Å; Y278-M316 HydrophobicContact CG-CB 3.86Å; Y278-F411 WeakPolarHBondContact OH-CE1 3.26Å; Y278-Q434 PolarHBondContact OH-NE2 3.11Å; Y278-Q434 PolarHBondContact OH-OE1 3.49Å
279	Y	77.2	Confident	72.4	Confident	136 Å²	136	30.3 Å²	30.3	53%	0.533	15%	0.146	S	C	.	.	H	α-helix	trans	-64.1	-46.8	177.6	-179.3	-95.7	0	0	0	111.7	D277 A281 I282 K283 M317 L500	D277-Y279 VanDerWaalsContact C-N 3.32Å; D277-Y279 PolarHBondContact O-N 2.9Å; Y279-A281 VanDerWaalsContact C-N 3.33Å; Y279-A281 PolarHBondContact O-N 3.14Å; Y279-I282 PolarHBondContact O-N 3.37Å; Y279-K283 HydrophobicContact CE1-CD 4.36Å; Y279-K283 WeakPolarHBondContact O-CB 3.4Å; Y279-K283 PolarHBondContact O-N 3.49Å; Y279-M317 HydrophobicContact CD2-CE 3.94Å; Y279-L500 HydrophobicContact CD2-CD2 3.81Å; Y279-L500 HydrophobicContact CE2-CD2 3.59Å
280	Q	72.8	Confident	71.4	Confident	72 Å²	72	31.5 Å²	31.5	34%	0.336	15%	0.152	S	C	.	.	H	α-helix	trans	-68.1	-35.8	178.6	-167.7	67	7.9	0	0	111.3	D277 I282 K283 V284	D277-Q280 HydrophobicContact CB-CB 4.27Å; D277-Q280 PolarHBondContact O-N 3.49Å; Q280-I282 VanDerWaalsContact C-N 3.31Å; Q280-I282 PolarHBondContact O-N 2.8Å; Q280-K283 WeakPolarHBondContact O-CB 3.24Å; Q280-K283 PolarHBondContact O-N 2.83Å; Q280-V284 WeakPolarHBondContact O-CG2 3.23Å; Q280-V284 PolarHBondContact O-N 2.9Å
281	A	74.9	Confident	70.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57.5	-43.6	175.2	0	0	0	0	0	111.9	L269 H272 D277 Y278 Y279	L269-A281 HydrophobicContact CD1-CB 3.85Å; H272-A281 HydrophobicContact CB-CB 3.67Å; D277-A281 WeakPolarHBondContact O-CB 3.1Å; D277-A281 PolarHBondContact O-N 3.43Å; Y278-A281 WeakPolarHBondContact O-CB 3.34Å; Y278-A281 PolarHBondContact O-N 2.88Å; Y279-A281 VanDerWaalsContact C-N 3.33Å; Y279-A281 PolarHBondContact O-N 3.14Å
282	I	73.7	Confident	68.9	Low	2 Å²	2	41.4 Å²	41.4	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-75.9	-34.9	177.3	-57	-177.3	0	0	0	111.1	Y278 Y279 Q280 V284 L285 E286 A313 Y314 M317 A499 L500	Y278-I282 WeakPolarHBondContact O-CG1 3.18Å; Y278-I282 PolarHBondContact O-N 2.7Å; Y278-I282 VanDerWaalsContact O-N 3.15Å; Y279-I282 PolarHBondContact O-N 3.37Å; Q280-I282 VanDerWaalsContact C-N 3.31Å; Q280-I282 PolarHBondContact O-N 2.8Å; I282-V284 VanDerWaalsContact C-N 3.31Å; I282-V284 PolarHBondContact O-N 3.46Å; I282-L285 CarbonylContact O-C 3.59Å; I282-L285 WeakPolarHBondContact O-CA 3.02Å; I282-L285 PolarHBondContact O-N 2.68Å; I282-E286 PolarHBondContact O-N 3.4Å; I282-A313 HydrophobicContact CD1-CB 4.01Å; I282-A313 HydrophobicContact CG1-CB 3.96Å; I282-Y314 HydrophobicContact CD1-CD1 3.56Å; I282-Y314 HydrophobicContact CD1-CE1 3.51Å; I282-Y314 HydrophobicContact CD1-CG 4.33Å; I282-Y314 HydrophobicContact CG2-CE1 4.3Å; I282-M317 HydrophobicContact CD1-CE 4.45Å; I282-M317 HydrophobicContact CD1-SD 3.32Å; I282-M317 WeakPolarHBondContact CD1-SD 3.05Å; I282-M317 HydrophobicContact CG1-SD 4.17Å; I282-A499 HydrophobicContact CG2-CB 3.92Å; I282-L500 HydrophobicContact CB-CD1 4.31Å; I282-L500 HydrophobicContact CB-CG 4.34Å; I282-L500 HydrophobicContact CG2-CD1 4.05Å; I282-L500 HydrophobicContact CG2-CD2 4.42Å; I282-L500 HydrophobicContact CG2-CG 3.77Å
283	K	75.6	Confident	67.5	Low	93 Å²	93	50.7 Å²	50.7	40%	0.404	24%	0.24	S	C	.	.	H	α-helix	trans	-57.2	-43.2	175.9	-178.9	162.3	-173.9	-179	0	112.6	Y279 Q280 L285 E286 L500	Y279-K283 HydrophobicContact CE1-CD 4.36Å; Y279-K283 WeakPolarHBondContact O-CB 3.4Å; Y279-K283 PolarHBondContact O-N 3.49Å; Q280-K283 WeakPolarHBondContact O-CB 3.24Å; Q280-K283 PolarHBondContact O-N 2.83Å; K283-L285 PolarHBondContact O-N 2.87Å; K283-E286 WeakPolarHBondContact CG-OE1 3.22Å; K283-E286 WeakPolarHBondContact O-CB 3.35Å; K283-E286 VanDerWaalsContact O-CG 3.25Å; K283-E286 WeakPolarHBondContact O-CG 3.47Å; K283-E286 PolarHBondContact O-N 3.39Å; K283-E286 VanDerWaalsContact O-N 3.11Å; K283-L500 HydrophobicContact CB-CD1 3.98Å
284	V	69.3	Low	66.1	Low	18 Å²	18	51.4 Å²	51.4	11%	0.109	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.5	177.1	172.8	0	0	0	0	112.2	L265 L268 Q280 I282	L265-V284 HydrophobicContact CB-CG1 4.4Å; L265-V284 HydrophobicContact CD2-CG1 3.61Å; L268-V284 HydrophobicContact CB-CG1 3.86Å; L268-V284 HydrophobicContact CD1-CG1 4.09Å; Q280-V284 WeakPolarHBondContact O-CG2 3.23Å; Q280-V284 PolarHBondContact O-N 2.9Å; I282-V284 VanDerWaalsContact C-N 3.31Å; I282-V284 PolarHBondContact O-N 3.46Å
285	L	68.1	Low	64.7	Low	2 Å²	2	56 Å²	56	1%	0.01	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	5	177.6	-62.9	-179.6	0	0	0	114.1	L269 I282 K283 N287 I288 V310	L269-L285 HydrophobicContact CB-CD1 4.24Å; L269-L285 HydrophobicContact CB-CD2 4.36Å; L269-L285 HydrophobicContact CB-CG 4.3Å; L269-L285 HydrophobicContact CD1-CD1 3.55Å; L269-L285 HydrophobicContact CD1-CG 4.26Å; L269-L285 HydrophobicContact CD2-CD1 3.78Å; L269-L285 HydrophobicContact CG-CD1 3.98Å; I282-L285 CarbonylContact O-C 3.59Å; I282-L285 WeakPolarHBondContact O-CA 3.02Å; I282-L285 PolarHBondContact O-N 2.68Å; K283-L285 PolarHBondContact O-N 2.87Å; L285-N287 PolarHBondContact O-N 3.29Å; L285-I288 HydrophobicContact CD2-CD1 3.58Å; L285-I288 PolarHBondContact O-N 3.16Å; L285-V310 HydrophobicContact CD1-CG2 3.26Å
286	E	63.5	Low	63.7	Low	48 Å²	48	56.9 Å²	56.9	22%	0.224	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-33	-175.9	-79.7	172.1	-178.7	0	0	113	I282 K283 S498 L500	I282-E286 PolarHBondContact O-N 3.4Å; K283-E286 WeakPolarHBondContact CG-OE1 3.22Å; K283-E286 WeakPolarHBondContact O-CB 3.35Å; K283-E286 VanDerWaalsContact O-CG 3.25Å; K283-E286 WeakPolarHBondContact O-CG 3.47Å; K283-E286 PolarHBondContact O-N 3.39Å; K283-E286 VanDerWaalsContact O-N 3.11Å; E286-S498 WeakPolarHBondContact CG-OG 3.41Å; E286-L500 HydrophobicContact CG-CD1 3.78Å; E286-L500 WeakPolarHBondContact OE1-CD1 3.25Å
287	N	57.5	Low	62.8	Low	27 Å²	27	59 Å²	59	14%	0.144	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-1.4	-177.2	-63.7	-17.4	0	0	0	113.4	N232 L235 E236 L285	N232-N287 PolarHBondContact O-ND2 2.8Å; L235-N287 HydrophobicContact CB-CB 4.11Å; E236-N287 PolarHBondContact OE1-ND2 3.43Å; L285-N287 PolarHBondContact O-N 3.29Å
288	I	63.8	Low	61.5	Low	5 Å²	5	61.7 Å²	61.7	3%	0.026	28%	0.284	C	S	.	.			trans	-98.9	107.4	179.5	-66.3	166.8	0	0	0	109.3	L235 Y262 L265 L285 L290 Y296	L235-I288 HydrophobicContact CD1-CD1 4.45Å; L235-I288 HydrophobicContact CD1-CG1 3.68Å; Y262-I288 HydrophobicContact CD2-CD1 4.07Å; Y262-I288 HydrophobicContact CE2-CD1 3.68Å; Y262-I288 HydrophobicContact CE2-CG1 4.16Å; Y262-I288 HydrophobicContact CE2-CG2 4.33Å; L265-I288 HydrophobicContact CB-CD1 4.22Å; L265-I288 HydrophobicContact CD1-CD1 3.91Å; L285-I288 HydrophobicContact CD2-CD1 3.58Å; L285-I288 PolarHBondContact O-N 3.16Å; I288-L290 HydrophobicContact CG2-CD2 4.39Å; I288-L290 PolarHBondContact O-N 2.73Å; I288-Y296 HydrophobicContact CG2-CE2 4.38Å
289	E	56.7	Low	60.8	Low	43 Å²	43	61 Å²	61	20%	0.201	28%	0.282	C	S	.	.			trans	-68.6	96.3	170.7	-70	-171.5	153.2	0	0	111.1	T239 N291 K292	T239-E289 HydrophobicContact CG2-CG 4.26Å; T239-E289 WeakPolarHBondContact CG2-OE1 3.37Å; E289-N291 PolarHBondContact O-N 3.31Å; E289-N291 VanDerWaalsContact O-N 3.12Å; E289-K292 IonicContact OE1-NZ 2.74Å; E289-K292 PolarHBondContact OE1-NZ 3.03Å; E289-K292 WeakPolarHBondContact OE2-CD 3.43Å; E289-K292 VanDerWaalsContact OE2-CE 3.26Å; E289-K292 WeakPolarHBondContact OE2-CE 3.35Å; E289-K292 WeakPolarHBondContact OE2-CG 3.48Å; E289-K292 IonicContact OE2-NZ 3.37Å; E289-K292 PolarHBondContact OE2-NZ 3.4Å
290	L	58	Low	60.3	Low	24 Å²	24	55.5 Å²	55.5	13%	0.126	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-9.7	177	-66.7	165.6	0	0	0	114.2	I288 T306 Y307 V310	I288-L290 HydrophobicContact CG2-CD2 4.39Å; I288-L290 PolarHBondContact O-N 2.73Å; L290-T306 HydrophobicContact CD2-CG2 4.13Å; L290-Y307 HydrophobicContact CB-CE1 4.43Å; L290-Y307 PolarHBondContact O-OH 2.9Å; L290-V310 HydrophobicContact CD1-CG1 3.81Å; L290-V310 HydrophobicContact CD1-CG2 4.26Å
291	N	52.8	Low	60.1	Low	99 Å²	99	53.8 Å²	53.8	53%	0.529	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-12.5	-173.4	-77.4	-30.4	0	0	0	114.4	E289 W493	E289-N291 PolarHBondContact O-N 3.31Å; E289-N291 VanDerWaalsContact O-N 3.12Å; N291-W493 WeakPolarHBondContact ND2-CZ3 3.27Å
292	K	54	Low	59.8	Low	124 Å²	124	54 Å²	54	54%	0.539	26%	0.256	S	S	.	.	S	Bend	trans	-99.2	139	175.3	-67.4	-162.6	-165.7	123.6	0	110.6	E289 S294	E289-K292 IonicContact OE1-NZ 2.74Å; E289-K292 PolarHBondContact OE1-NZ 3.03Å; E289-K292 WeakPolarHBondContact OE2-CD 3.43Å; E289-K292 VanDerWaalsContact OE2-CE 3.26Å; E289-K292 WeakPolarHBondContact OE2-CE 3.35Å; E289-K292 WeakPolarHBondContact OE2-CG 3.48Å; E289-K292 IonicContact OE2-NZ 3.37Å; E289-K292 PolarHBondContact OE2-NZ 3.4Å; K292-S294 PolarHBondContact O-N 3.48Å
293	K	50.1	Low	59.8	Low	209 Å²	209	55.4 Å²	55.4	91%	0.909	26%	0.263	S	S	*	.			trans	-64.5	75.5	165.4	-77.3	-175.2	177	-177.5	0	108.9
294	S	47.4	Very low	59.8	Low	15 Å²	15	51 Å²	51	11%	0.105	24%	0.244	C	C	.	.			trans	-90.2	-178.4	172.7	165.8	0	0	0	0	109.3	K292 Y296 S297	K292-S294 PolarHBondContact O-N 3.48Å; S294-Y296 VanDerWaalsContact CB-CD2 3.43Å; S294-Y296 PolarHBondContact O-N 3.45Å; S294-Y296 WeakPolarHBondContact OG-CE2 3.5Å; S294-Y296 VanDerWaalsContact OG-CZ 3.3Å; S294-S297 PolarHBondContact O-N 2.97Å
295	M	46.2	Very low	60.1	Low	97 Å²	97	50.4 Å²	50.4	48%	0.478	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-43.7	-13.7	-176.1	-65.6	-70.4	-153.7	0	0	115.3	S297	M295-S297 VanDerWaalsContact C-N 3.34Å; M295-S297 PolarHBondContact O-N 3.15Å
296	Y	50.2	Low	60.7	Low	43 Å²	43	50.4 Å²	50.4	17%	0.169	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-63.9	-21.2	177	-39.7	-47.5	0	0	0	115.6	L235 Y262 I288 S294 R298	L235-Y296 VanDerWaalsContact CD2-OH 3.25Å; L235-Y296 WeakPolarHBondContact CD2-OH 3.47Å; Y262-Y296 HydrophobicContact CD1-CD1 4.45Å; Y262-Y296 HydrophobicContact CD2-CD1 4.11Å; Y262-Y296 AromaticContact CD2-CE1 3.67Å; Y262-Y296 HydrophobicContact CD2-CE1 3.67Å; Y262-Y296 AromaticContact CE1-CD1 3.82Å; Y262-Y296 HydrophobicContact CE1-CD1 3.82Å; Y262-Y296 HydrophobicContact CE1-CE1 4.37Å; Y262-Y296 AromaticContact CE2-CD1 3.4Å; Y262-Y296 HydrophobicContact CE2-CD1 3.4Å; Y262-Y296 VanDerWaalsContact CE2-CD1 3.4Å; Y262-Y296 AromaticContact CE2-CE1 3.16Å; Y262-Y296 HydrophobicContact CE2-CE1 3.16Å; Y262-Y296 HydrophobicContact CE2-CG 4.37Å; Y262-Y296 AromaticContact CE2-CZ 3.95Å; Y262-Y296 HydrophobicContact CG-CE1 4.43Å; Y262-Y296 AromaticContact CZ-CD1 3.24Å; Y262-Y296 AromaticContact CZ-CE1 3.59Å; Y262-Y296 WeakPolarHBondContact OH-CD1 3.26Å; I288-Y296 HydrophobicContact CG2-CE2 4.38Å; S294-Y296 VanDerWaalsContact CB-CD2 3.43Å; S294-Y296 PolarHBondContact O-N 3.45Å; S294-Y296 WeakPolarHBondContact OG-CE2 3.5Å; S294-Y296 VanDerWaalsContact OG-CZ 3.3Å; Y296-R298 PolarHBondContact O-N 3.07Å; Y296-R298 VanDerWaalsContact O-N 3.08Å
297	S	51.2	Low	61.5	Low	64 Å²	64	49.6 Å²	49.6	45%	0.448	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-70.5	-1.3	-179.1	-172.5	0	0	0	0	114.2	S294 M295	S294-S297 PolarHBondContact O-N 2.97Å; M295-S297 VanDerWaalsContact C-N 3.34Å; M295-S297 PolarHBondContact O-N 3.15Å
298	R	52.8	Low	62.7	Low	151 Å²	151	48.5 Å²	48.5	57%	0.57	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-79.4	-29.8	-176.9	-68	-175.7	179.8	-165.4	-0.5	113.4	Y296	Y296-R298 PolarHBondContact O-N 3.07Å; Y296-R298 VanDerWaalsContact O-N 3.08Å
299	V	61.9	Low	63.6	Low	8 Å²	8	48.9 Å²	48.9	5%	0.048	23%	0.231	C	C	.	.			trans	-122.8	99.3	177.8	-174.6	0	0	0	0	109.5	N171 Q172 W175 F263 E301 C302 Q303	N171-V299 HydrophobicContact CB-CG2 4.05Å; Q172-V299 HydrophobicContact CG-CG1 4.49Å; Q172-V299 HydrophobicContact CG-CG2 4.1Å; W175-V299 HydrophobicContact CG-CG1 4.45Å; F263-V299 HydrophobicContact CZ-CG2 4.38Å; V299-E301 HydrophobicContact CG1-CB 4.17Å; V299-E301 PolarHBondContact O-N 2.82Å; V299-C302 HydrophobicContact CB-CB 4.3Å; V299-C302 HydrophobicContact CG1-CB 4.2Å; V299-C302 PolarHBondContact O-N 2.8Å; V299-Q303 PolarHBondContact O-N 2.75Å
300	P	66.3	Low	64.7	Low	21 Å²	21	47 Å²	47	14%	0.136	22%	0.222	C	C	.	.	H	α-helix	trans	-61.7	-27.7	-178.2	-23.1	32.5	0	0	0	114.1	Q303 I304 Y333 F341	P300-Q303 WeakPolarHBondContact O-CB 3.17Å; P300-Q303 PolarHBondContact O-N 3.13Å; P300-I304 WeakPolarHBondContact O-CD1 3.17Å; P300-I304 VanDerWaalsContact O-CG1 3.22Å; P300-I304 WeakPolarHBondContact O-CG1 3.45Å; P300-I304 PolarHBondContact O-N 3.42Å; P300-Y333 HydrophobicContact CB-CE1 4.15Å; P300-F341 HydrophobicContact CB-CE1 3.59Å; P300-F341 HydrophobicContact CB-CZ 3.4Å; P300-F341 VanDerWaalsContact CB-CZ 3.4Å; P300-F341 HydrophobicContact CG-CE1 4.1Å; P300-F341 HydrophobicContact CG-CZ 4.12Å
301	E	67.3	Low	65.8	Low	36 Å²	36	45.8 Å²	45.8	17%	0.168	22%	0.216	C	C	.	.	H	α-helix	trans	-65.5	-46.8	179.5	-67	174.1	-173	0	0	112.6	V299 Q303 I304 T305 K347 I351	V299-E301 HydrophobicContact CG1-CB 4.17Å; V299-E301 PolarHBondContact O-N 2.82Å; E301-Q303 VanDerWaalsContact C-N 3.27Å; E301-Q303 PolarHBondContact O-N 3.31Å; E301-I304 PolarHBondContact O-N 3.45Å; E301-T305 WeakPolarHBondContact O-CB 3.12Å; E301-T305 PolarHBondContact O-N 3.12Å; E301-T305 PolarHBondContact O-OG1 2.6Å; E301-K347 WeakPolarHBondContact OE1-CD 3.47Å; E301-K347 WeakPolarHBondContact OE1-CE 3.22Å; E301-K347 IonicContact OE1-NZ 2.85Å; E301-K347 PolarHBondContact OE1-NZ 3.47Å; E301-K347 IonicContact OE2-NZ 3.84Å; E301-I351 HydrophobicContact CG-CD1 4.2Å
302	C	70.5	Confident	67.2	Low	4 Å²	4	41.1 Å²	41.1	3%	0.027	19%	0.191	C	C	.	.	H	α-helix	trans	-61.1	-40.2	175	174.6	0	0	0	0	110.8	W175 F263 V299 T305 T306	W175-C302 HydrophobicContact CD2-CB 3.75Å; W175-C302 HydrophobicContact CE3-CB 3.8Å; W175-C302 HydrophobicContact CG-CB 4.34Å; W175-C302 HydrophobicContact CH2-CB 4.21Å; W175-C302 HydrophobicContact CZ2-CB 4.18Å; W175-C302 HydrophobicContact CZ3-CB 4.03Å; F263-C302 HydrophobicContact CD1-CB 4.49Å; F263-C302 HydrophobicContact CE1-CB 4.17Å; V299-C302 HydrophobicContact CB-CB 4.3Å; V299-C302 HydrophobicContact CG1-CB 4.2Å; V299-C302 PolarHBondContact O-N 2.8Å; C302-T305 PolarHBondContact O-N 2.69Å; C302-T306 WeakPolarHBondContact O-CB 3.36Å; C302-T306 PolarHBondContact O-N 3.21Å; C302-T306 PolarHBondContact O-OG1 3.21Å
303	Q	71.9	Confident	68.5	Low	32 Å²	32	35.2 Å²	35.2	15%	0.15	17%	0.165	C	C	.	.	H	α-helix	trans	-60.6	-55.6	177.6	-166.5	178.3	-13.1	0	0	110.4	V299 P300 E301 T305 T306 Y307 I330 Y333	V299-Q303 PolarHBondContact O-N 2.75Å; P300-Q303 WeakPolarHBondContact O-CB 3.17Å; P300-Q303 PolarHBondContact O-N 3.13Å; E301-Q303 VanDerWaalsContact C-N 3.27Å; E301-Q303 PolarHBondContact O-N 3.31Å; Q303-T305 VanDerWaalsContact C-N 3.29Å; Q303-T305 PolarHBondContact O-N 2.72Å; Q303-T306 PolarHBondContact O-N 2.87Å; Q303-T306 VanDerWaalsContact O-N 3.16Å; Q303-Y307 HydrophobicContact CG-CD2 3.66Å; Q303-Y307 HydrophobicContact CG-CE2 3.38Å; Q303-Y307 WeakPolarHBondContact O-CD2 3.24Å; Q303-Y307 PolarHBondContact O-N 3.44Å; Q303-I330 HydrophobicContact CG-CD1 4.49Å; Q303-Y333 PolarHBondContact OE1-OH 2.84Å
304	I	75.8	Confident	69.9	Low	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-55.6	-45.3	-179.8	-65.7	161.7	0	0	0	111.5	P300 E301 Y307 Y308 I330 I334 F341 I351 M358	P300-I304 WeakPolarHBondContact O-CD1 3.17Å; P300-I304 VanDerWaalsContact O-CG1 3.22Å; P300-I304 WeakPolarHBondContact O-CG1 3.45Å; P300-I304 PolarHBondContact O-N 3.42Å; E301-I304 PolarHBondContact O-N 3.45Å; I304-Y307 PolarHBondContact O-N 3.41Å; I304-Y308 WeakPolarHBondContact O-CB 3.19Å; I304-Y308 PolarHBondContact O-N 3.46Å; I304-I330 HydrophobicContact CB-CD1 4.39Å; I304-I330 HydrophobicContact CG1-CD1 3.87Å; I304-I330 HydrophobicContact CG1-CG1 4.47Å; I304-I334 HydrophobicContact CD1-CD1 4.39Å; I304-I334 HydrophobicContact CD1-CG1 4.06Å; I304-I334 HydrophobicContact CG1-CD1 4.13Å; I304-I334 HydrophobicContact CG1-CG1 4Å; I304-I334 HydrophobicContact CG2-CD1 4.18Å; I304-F341 HydrophobicContact CD1-CZ 4.14Å; I304-I351 HydrophobicContact CD1-CD1 4.3Å; I304-I351 HydrophobicContact CD1-CG1 4.3Å; I304-I351 HydrophobicContact CD1-CG2 3.76Å; I304-M358 HydrophobicContact CG2-CE 3.8Å
305	T	77.3	Confident	71.4	Confident	7 Å²	7	25 Å²	25	4%	0.043	12%	0.119	C	C	.	.	H	α-helix	trans	-64.3	-43.2	179.9	-56.3	0	0	0	0	111.9	W175 E301 C302 Q303 Y308 Y309	W175-T305 HydrophobicContact CH2-CG2 4.14Å; W175-T305 HydrophobicContact CZ2-CG2 4.1Å; E301-T305 WeakPolarHBondContact O-CB 3.12Å; E301-T305 PolarHBondContact O-N 3.12Å; E301-T305 PolarHBondContact O-OG1 2.6Å; C302-T305 PolarHBondContact O-N 2.69Å; Q303-T305 VanDerWaalsContact C-N 3.29Å; Q303-T305 PolarHBondContact O-N 2.72Å; T305-Y308 PolarHBondContact O-N 3.43Å; T305-Y309 HydrophobicContact CG2-CD2 3.73Å; T305-Y309 HydrophobicContact CG2-CE2 3.52Å; T305-Y309 WeakPolarHBondContact O-CD2 3.38Å; T305-Y309 PolarHBondContact O-N 2.82Å; T305-Y309 VanDerWaalsContact O-N 3.11Å
306	T	79.6	Confident	72.8	Confident	2 Å²	2	22 Å²	22	1%	0.012	10%	0.104	C	C	.	.	H	α-helix	trans	-62.1	-50.8	178	-54.1	0	0	0	0	111.1	V266 L269 L290 C302 Q303 Y308 Y309 V310	V266-T306 VanDerWaalsContact CG1-OG1 3.22Å; V266-T306 WeakPolarHBondContact CG1-OG1 3.38Å; V266-T306 HydrophobicContact CG2-CG2 4.48Å; V266-T306 WeakPolarHBondContact CG2-OG1 3.42Å; L269-T306 HydrophobicContact CD2-CG2 4.09Å; L290-T306 HydrophobicContact CD2-CG2 4.13Å; C302-T306 WeakPolarHBondContact O-CB 3.36Å; C302-T306 PolarHBondContact O-N 3.21Å; C302-T306 PolarHBondContact O-OG1 3.21Å; Q303-T306 PolarHBondContact O-N 2.87Å; Q303-T306 VanDerWaalsContact O-N 3.16Å; T306-Y308 VanDerWaalsContact C-N 3.29Å; T306-Y308 PolarHBondContact O-N 3.32Å; T306-Y309 PolarHBondContact O-N 3.09Å; T306-V310 HydrophobicContact CG2-CG2 4.19Å; T306-V310 WeakPolarHBondContact O-CB 3.18Å; T306-V310 VanDerWaalsContact O-CG2 3.24Å; T306-V310 WeakPolarHBondContact O-CG2 2.96Å; T306-V310 PolarHBondContact O-N 2.79Å
307	Y	80.4	Confident	73.8	Confident	30 Å²	30	22.5 Å²	22.5	12%	0.118	11%	0.108	C	C	.	.	H	α-helix	trans	-63.9	-34.1	179.8	-77.1	-82.1	0	0	0	112.3	L290 Q303 I304 G311 V326 I330	L290-Y307 HydrophobicContact CB-CE1 4.43Å; L290-Y307 PolarHBondContact O-OH 2.9Å; Q303-Y307 HydrophobicContact CG-CD2 3.66Å; Q303-Y307 HydrophobicContact CG-CE2 3.38Å; Q303-Y307 WeakPolarHBondContact O-CD2 3.24Å; Q303-Y307 PolarHBondContact O-N 3.44Å; I304-Y307 PolarHBondContact O-N 3.41Å; Y307-G311 PolarHBondContact O-N 3.38Å; Y307-V326 HydrophobicContact CD1-CG1 3.68Å; Y307-V326 HydrophobicContact CG-CG1 4.47Å; Y307-I330 HydrophobicContact CD1-CB 4.44Å; Y307-I330 HydrophobicContact CD2-CB 4.34Å; Y307-I330 HydrophobicContact CD2-CD1 3.8Å; Y307-I330 HydrophobicContact CD2-CG1 4.33Å; Y307-I330 HydrophobicContact CG-CB 3.93Å; Y307-I330 HydrophobicContact CG-CD1 4.22Å; Y307-I330 HydrophobicContact CG-CG1 4.25Å
308	Y	82.9	Confident	74.8	Confident	4 Å²	4	24.7 Å²	24.7	2%	0.016	11%	0.107	C	C	.	.	H	α-helix	trans	-62	-53.2	174.7	171.8	-108	0	0	0	111.8	I304 T305 T306 G311 F312 Q357 M358 L361 A407 P409	I304-Y308 WeakPolarHBondContact O-CB 3.19Å; I304-Y308 PolarHBondContact O-N 3.46Å; T305-Y308 PolarHBondContact O-N 3.43Å; T306-Y308 VanDerWaalsContact C-N 3.29Å; T306-Y308 PolarHBondContact O-N 3.32Å; Y308-G311 PolarHBondContact O-N 3.01Å; Y308-F312 VanDerWaalsContact O-CB 3.3Å; Y308-F312 WeakPolarHBondContact O-CB 3.41Å; Y308-F312 PolarHBondContact O-N 2.77Å; Y308-Q357 HydrophobicContact CE2-CB 4.18Å; Y308-M358 HydrophobicContact CD2-CG 3.69Å; Y308-L361 HydrophobicContact CD2-CD1 4.3Å; Y308-L361 HydrophobicContact CE2-CD1 3.78Å; Y308-A407 PolarHBondContact OH-O 3.45Å; Y308-P409 HydrophobicContact CE1-CG 3.88Å; Y308-P409 WeakPolarHBondContact OH-CD 3.48Å
309	Y	81.7	Confident	75.9	Confident	14 Å²	14	17.9 Å²	17.9	6%	0.055	8%	0.081	C	C	.	.	H	α-helix	trans	-69.3	-37	-179.3	-74.1	-68.2	0	0	0	112.8	R270 T305 T306 F312 A313 P409	R270-Y309 HydrophobicContact CB-CD2 4.05Å; R270-Y309 HydrophobicContact CB-CE2 3.9Å; R270-Y309 HydrophobicContact CG-CD2 4.21Å; R270-Y309 HydrophobicContact CG-CE1 4.15Å; R270-Y309 HydrophobicContact CG-CE2 3.57Å; R270-Y309 PolarHBondContact NE-OH 3.49Å; T305-Y309 HydrophobicContact CG2-CD2 3.73Å; T305-Y309 HydrophobicContact CG2-CE2 3.52Å; T305-Y309 WeakPolarHBondContact O-CD2 3.38Å; T305-Y309 PolarHBondContact O-N 2.82Å; T305-Y309 VanDerWaalsContact O-N 3.11Å; T306-Y309 PolarHBondContact O-N 3.09Å; Y309-F312 PolarHBondContact O-N 3.23Å; Y309-A313 WeakPolarHBondContact O-CB 3.23Å; Y309-A313 PolarHBondContact O-N 3.01Å; Y309-P409 HydrophobicContact CD1-CG 4.11Å; Y309-P409 HydrophobicContact CE1-CB 3.86Å; Y309-P409 HydrophobicContact CE1-CG 3.72Å
310	V	80.3	Confident	76.5	Confident	2 Å²	2	18 Å²	18	1%	0.012	8%	0.081	C	C	.	.	H	α-helix	trans	-63.1	-47.9	173.2	170.2	0	0	0	0	111.2	L269 L285 L290 T306 F312 A313 Y314 V326	L269-V310 HydrophobicContact CD1-CG2 4.17Å; L269-V310 HydrophobicContact CD2-CG2 3.93Å; L285-V310 HydrophobicContact CD1-CG2 3.26Å; L290-V310 HydrophobicContact CD1-CG1 3.81Å; L290-V310 HydrophobicContact CD1-CG2 4.26Å; T306-V310 HydrophobicContact CG2-CG2 4.19Å; T306-V310 WeakPolarHBondContact O-CB 3.18Å; T306-V310 VanDerWaalsContact O-CG2 3.24Å; T306-V310 WeakPolarHBondContact O-CG2 2.96Å; T306-V310 PolarHBondContact O-N 2.79Å; V310-F312 VanDerWaalsContact C-N 3.27Å; V310-F312 PolarHBondContact O-N 2.68Å; V310-A313 PolarHBondContact O-N 3.49Å; V310-Y314 HydrophobicContact CG1-CD2 3.57Å; V310-Y314 HydrophobicContact CG1-CE2 3.22Å; V310-Y314 VanDerWaalsContact O-CD2 3.3Å; V310-Y314 WeakPolarHBondContact O-CD2 3.49Å; V310-Y314 PolarHBondContact O-N 2.93Å; V310-V326 HydrophobicContact CB-CG1 4.45Å; V310-V326 HydrophobicContact CG1-CG1 4.12Å; V310-V326 HydrophobicContact CG1-CG2 4.4Å
311	G	80.5	Confident	76.8	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-62.2	-38.6	178.4	0	0	0	0	0	111.7	Y307 Y308 L315	Y307-G311 PolarHBondContact O-N 3.38Å; Y308-G311 PolarHBondContact O-N 3.01Å; G311-L315 WeakPolarHBondContact O-CB 3.4Å; G311-L315 PolarHBondContact O-N 3.17Å
312	F	82.2	Confident	77.1	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-65.4	-46.1	174.3	-174	-99.9	0	0	0	112.3	Y278 Y308 Y309 V310 Y314 L315 M316 L361 C408 P409 F411	Y278-F312 AromaticContact CE1-CD1 3.91Å; Y278-F312 HydrophobicContact CE1-CD1 3.91Å; Y278-F312 AromaticContact CE1-CE1 3.58Å; Y278-F312 HydrophobicContact CE1-CE1 3.58Å; Y278-F312 AromaticContact CZ-CE1 3.84Å; Y278-F312 WeakPolarHBondContact OH-CE1 3.34Å; Y308-F312 VanDerWaalsContact O-CB 3.3Å; Y308-F312 WeakPolarHBondContact O-CB 3.41Å; Y308-F312 PolarHBondContact O-N 2.77Å; Y309-F312 PolarHBondContact O-N 3.23Å; V310-F312 VanDerWaalsContact C-N 3.27Å; V310-F312 PolarHBondContact O-N 2.68Å; F312-Y314 VanDerWaalsContact C-N 3.35Å; F312-Y314 PolarHBondContact O-N 3.49Å; F312-L315 WeakPolarHBondContact O-CB 3.45Å; F312-L315 PolarHBondContact O-N 3.08Å; F312-L315 VanDerWaalsContact O-N 3.16Å; F312-M316 HydrophobicContact CD1-CG 4.31Å; F312-M316 HydrophobicContact CE1-CG 3.72Å; F312-M316 HydrophobicContact CE2-CG 4.27Å; F312-M316 HydrophobicContact CE2-SD 4.44Å; F312-M316 HydrophobicContact CZ-CG 3.64Å; F312-M316 HydrophobicContact CZ-SD 3.93Å; F312-M316 WeakPolarHBondContact O-CG 3.39Å; F312-M316 PolarHBondContact O-N 3.48Å; F312-L361 HydrophobicContact CB-CD1 4.46Å; F312-L361 HydrophobicContact CD2-CD1 3.93Å; F312-L361 HydrophobicContact CD2-CD2 4.15Å; F312-L361 HydrophobicContact CE2-CD2 4.4Å; F312-C408 HydrophobicContact CE2-CB 4.46Å; F312-P409 HydrophobicContact CD1-CG 3.98Å; F312-P409 HydrophobicContact CE1-CG 4.23Å; F312-P409 HydrophobicContact CG-CG 4.21Å; F312-F411 AromaticContact CE1-CE1 3.74Å; F312-F411 HydrophobicContact CE1-CE1 3.74Å; F312-F411 AromaticContact CE1-CZ 3.76Å; F312-F411 HydrophobicContact CE1-CZ 3.76Å; F312-F411 HydrophobicContact CZ-CE1 4.01Å; F312-F411 AromaticContact CZ-CZ 3.51Å; F312-F411 HydrophobicContact CZ-CZ 3.51Å
313	A	82.3	Confident	77.6	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-60.9	-42.1	176.5	0	0	0	0	0	111.9	Y278 I282 Y309 V310 L315 M316 M317	Y278-A313 HydrophobicContact CD1-CB 4.04Å; I282-A313 HydrophobicContact CD1-CB 4.01Å; I282-A313 HydrophobicContact CG1-CB 3.96Å; Y309-A313 WeakPolarHBondContact O-CB 3.23Å; Y309-A313 PolarHBondContact O-N 3.01Å; V310-A313 PolarHBondContact O-N 3.49Å; A313-L315 VanDerWaalsContact C-N 3.34Å; A313-L315 PolarHBondContact O-N 3.49Å; A313-M316 PolarHBondContact O-N 3.16Å; A313-M317 WeakPolarHBondContact O-CB 3.31Å; A313-M317 WeakPolarHBondContact O-CG 3.33Å; A313-M317 PolarHBondContact O-N 3.29Å
314	Y	80.3	Confident	78	Confident	9 Å²	9	14.9 Å²	14.9	4%	0.035	6%	0.064	C	C	.	.	H	α-helix	trans	-63.8	-36.9	174.3	-75.8	-46.6	0	0	0	113.1	I282 V310 F312 M317 R318 R319 D322 V326 A499	I282-Y314 HydrophobicContact CD1-CD1 3.56Å; I282-Y314 HydrophobicContact CD1-CE1 3.51Å; I282-Y314 HydrophobicContact CD1-CG 4.33Å; I282-Y314 HydrophobicContact CG2-CE1 4.3Å; V310-Y314 HydrophobicContact CG1-CD2 3.57Å; V310-Y314 HydrophobicContact CG1-CE2 3.22Å; V310-Y314 VanDerWaalsContact O-CD2 3.3Å; V310-Y314 WeakPolarHBondContact O-CD2 3.49Å; V310-Y314 PolarHBondContact O-N 2.93Å; F312-Y314 VanDerWaalsContact C-N 3.35Å; F312-Y314 PolarHBondContact O-N 3.49Å; Y314-M317 PolarHBondContact O-N 3.41Å; Y314-R318 PolarHBondContact O-N 2.98Å; Y314-R319 HydrophobicContact CD1-CB 4.1Å; Y314-R319 PolarHBondContact O-N 3.14Å; Y314-D322 HydrophobicContact CD2-CB 4.39Å; Y314-D322 HydrophobicContact CG-CB 4.44Å; Y314-V326 HydrophobicContact CD2-CG2 4.14Å; Y314-V326 HydrophobicContact CE2-CG2 4.02Å; Y314-A499 VanDerWaalsContact OH-CB 3.3Å; Y314-A499 WeakPolarHBondContact OH-CB 3.46Å; Y314-A499 PolarHBondContact OH-O 3.28Å
315	L	77.9	Confident	78.2	Confident	2 Å²	2	19.4 Å²	19.4	1%	0.01	8%	0.082	C	C	.	.	H	α-helix	trans	-63	-44.4	175.5	-169.8	152.6	0	0	0	110.8	G311 F312 A313 M317 R318 Y320 L361 I364 A365 F438	G311-L315 WeakPolarHBondContact O-CB 3.4Å; G311-L315 PolarHBondContact O-N 3.17Å; F312-L315 WeakPolarHBondContact O-CB 3.45Å; F312-L315 PolarHBondContact O-N 3.08Å; F312-L315 VanDerWaalsContact O-N 3.16Å; A313-L315 VanDerWaalsContact C-N 3.34Å; A313-L315 PolarHBondContact O-N 3.49Å; L315-M317 VanDerWaalsContact C-N 3.35Å; L315-R318 PolarHBondContact O-N 3.33Å; L315-Y320 HydrophobicContact CG-CD1 4.46Å; L315-Y320 HydrophobicContact CG-CE1 4.27Å; L315-L361 HydrophobicContact CD1-CB 4.31Å; L315-L361 HydrophobicContact CD1-CD2 4.3Å; L315-I364 HydrophobicContact CD1-CG2 4.45Å; L315-A365 HydrophobicContact CD1-CB 4.42Å; L315-F438 HydrophobicContact CD2-CD2 4.33Å; L315-F438 HydrophobicContact CD2-CE2 3.82Å
316	M	75.3	Confident	78.3	Confident	32 Å²	32	19.7 Å²	19.7	16%	0.158	8%	0.083	C	C	.	.	H	α-helix	trans	-71.8	-26.9	178.3	-64.4	-58.7	-67.3	0	0	113.2	Y278 F312 A313 R318 F404	Y278-M316 HydrophobicContact CD1-CB 4.18Å; Y278-M316 HydrophobicContact CD1-CG 4.45Å; Y278-M316 HydrophobicContact CD2-CB 3.53Å; Y278-M316 HydrophobicContact CD2-CG 4.25Å; Y278-M316 HydrophobicContact CE1-CB 4.2Å; Y278-M316 HydrophobicContact CE1-CG 4.01Å; Y278-M316 HydrophobicContact CE2-CB 3.55Å; Y278-M316 HydrophobicContact CE2-CE 3.92Å; Y278-M316 HydrophobicContact CE2-CG 3.77Å; Y278-M316 HydrophobicContact CG-CB 3.86Å; F312-M316 HydrophobicContact CD1-CG 4.31Å; F312-M316 HydrophobicContact CE1-CG 3.72Å; F312-M316 HydrophobicContact CE2-CG 4.27Å; F312-M316 HydrophobicContact CE2-SD 4.44Å; F312-M316 HydrophobicContact CZ-CG 3.64Å; F312-M316 HydrophobicContact CZ-SD 3.93Å; F312-M316 WeakPolarHBondContact O-CG 3.39Å; F312-M316 PolarHBondContact O-N 3.48Å; A313-M316 PolarHBondContact O-N 3.16Å; M316-R318 VanDerWaalsContact C-N 3.26Å; M316-R318 PolarHBondContact O-N 3.25Å; M316-F404 HydrophobicContact SD-CE2 4.04Å; M316-F404 HydrophobicContact SD-CZ 4.23Å
317	M	72.4	Confident	78.3	Confident	55 Å²	55	19.6 Å²	19.6	27%	0.271	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	10	173.2	-69.9	-176.2	66.3	0	0	114	Y279 I282 A313 Y314 L315 R319 L500	Y279-M317 HydrophobicContact CD2-CE 3.94Å; I282-M317 HydrophobicContact CD1-CE 4.45Å; I282-M317 HydrophobicContact CD1-SD 3.32Å; I282-M317 WeakPolarHBondContact CD1-SD 3.05Å; I282-M317 HydrophobicContact CG1-SD 4.17Å; A313-M317 WeakPolarHBondContact O-CB 3.31Å; A313-M317 WeakPolarHBondContact O-CG 3.33Å; A313-M317 PolarHBondContact O-N 3.29Å; Y314-M317 PolarHBondContact O-N 3.41Å; L315-M317 VanDerWaalsContact C-N 3.35Å; M317-R319 PolarHBondContact O-N 3.42Å; M317-L500 HydrophobicContact CE-CD2 4.08Å
318	R	71.3	Confident	78.3	Confident	110 Å²	110	18.9 Å²	18.9	42%	0.415	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	10	179.7	-45.7	-173.4	163.5	-178.7	-13.2	115.3	Y314 L315 M316 Y320 E441 N490	Y314-R318 PolarHBondContact O-N 2.98Å; L315-R318 PolarHBondContact O-N 3.33Å; M316-R318 VanDerWaalsContact C-N 3.26Å; M316-R318 PolarHBondContact O-N 3.25Å; R318-Y320 VanDerWaalsContact C-N 3.25Å; R318-Y320 HydrophobicContact CB-CE2 4.28Å; R318-Y320 WeakPolarHBondContact O-CD2 3.26Å; R318-Y320 PolarHBondContact O-N 3.08Å; R318-E441 WeakPolarHBondContact CD-OE1 3.5Å; R318-E441 WeakPolarHBondContact CG-OE1 3.25Å; R318-E441 IonicContact CZ-OE1 3.32Å; R318-E441 IonicContact CZ-OE2 3.41Å; R318-E441 VanDerWaalsContact CZ-OE2 3.32Å; R318-E441 IonicContact NE-OE1 2.81Å; R318-E441 PolarHBondContact NE-OE1 2.96Å; R318-E441 IonicContact NE-OE2 3.25Å; R318-E441 PolarHBondContact NE-OE2 3.34Å; R318-E441 IonicContact NH2-OE1 3.01Å; R318-E441 IonicContact NH2-OE2 2.73Å; R318-E441 PolarHBondContact NH2-OE2 3.39Å; R318-N490 PolarHBondContact O-ND2 2.81Å; R318-N490 PolarHBondContact O-OD1 3.47Å
319	R	75.6	Confident	78.1	Confident	8 Å²	8	22.1 Å²	22.1	3%	0.03	10%	0.1	C	C	.	.			trans	-87	60.7	177.8	-67.6	179.8	64.1	-174.1	-2.4	111	Y314 M317 Q321 D322 A323 L491 A499	Y314-R319 HydrophobicContact CD1-CB 4.1Å; Y314-R319 PolarHBondContact O-N 3.14Å; M317-R319 PolarHBondContact O-N 3.42Å; R319-Q321 VanDerWaalsContact C-N 3.27Å; R319-Q321 PolarHBondContact O-N 2.63Å; R319-D322 IonicContact CZ-OD2 3.45Å; R319-D322 IonicContact NE-OD2 2.81Å; R319-D322 PolarHBondContact NE-OD2 3.28Å; R319-D322 IonicContact NH2-OD2 3.75Å; R319-D322 PolarHBondContact NH2-OD2 3.26Å; R319-D322 PolarHBondContact O-N 3.36Å; R319-A323 PolarHBondContact O-N 2.94Å; R319-L491 PolarHBondContact NE-O 2.84Å; R319-A499 PolarHBondContact NH1-O 2.84Å; R319-A499 PolarHBondContact NH2-O 3.4Å
320	Y	74.6	Confident	77.9	Confident	10 Å²	10	21.5 Å²	21.5	4%	0.039	10%	0.098	C	C	.	.	H	α-helix	trans	-58.3	-35.5	-174	-57.3	-64.1	0	0	0	113.9	L315 R318 A323 I324 M368 E441	L315-Y320 HydrophobicContact CG-CD1 4.46Å; L315-Y320 HydrophobicContact CG-CE1 4.27Å; R318-Y320 VanDerWaalsContact C-N 3.25Å; R318-Y320 HydrophobicContact CB-CE2 4.28Å; R318-Y320 WeakPolarHBondContact O-CD2 3.26Å; R318-Y320 PolarHBondContact O-N 3.08Å; Y320-A323 PolarHBondContact O-N 3.32Å; Y320-I324 WeakPolarHBondContact O-CB 3.5Å; Y320-I324 WeakPolarHBondContact O-CD1 3.47Å; Y320-I324 WeakPolarHBondContact O-CG1 3.33Å; Y320-I324 PolarHBondContact O-N 3.44Å; Y320-M368 HydrophobicContact CE1-CE 4.24Å; Y320-M368 HydrophobicContact CE1-SD 3.92Å; Y320-M368 HydrophobicContact CE2-CE 4.49Å; Y320-M368 VanDerWaalsContact OH-CE 3.23Å; Y320-M368 WeakPolarHBondContact OH-CE 3.31Å; Y320-E441 VanDerWaalsContact OH-CD 3.24Å; Y320-E441 PolarHBondContact OH-OE1 3.44Å
321	Q	73.1	Confident	77.7	Confident	14 Å²	14	21.8 Å²	21.8	7%	0.065	10%	0.099	C	C	.	.	H	α-helix	trans	-65.4	-41.3	179.8	174.1	160.2	-16.1	0	0	112.4	R319 R325 Y369 M371 V492	R319-Q321 VanDerWaalsContact C-N 3.27Å; R319-Q321 PolarHBondContact O-N 2.63Å; Q321-R325 WeakPolarHBondContact O-CG 3.32Å; Q321-R325 PolarHBondContact O-N 3.48Å; Q321-Y369 HydrophobicContact CB-CE1 4.38Å; Q321-M371 HydrophobicContact CB-SD 3.99Å; Q321-M371 HydrophobicContact CG-CE 3.83Å; Q321-M371 HydrophobicContact CG-SD 3.72Å; Q321-V492 HydrophobicContact CB-CG2 4.17Å; Q321-V492 HydrophobicContact CG-CG1 4.05Å; Q321-V492 HydrophobicContact CG-CG2 4.15Å; Q321-V492 VanDerWaalsContact NE2-CG1 3.29Å; Q321-V492 VanDerWaalsContact OE1-CG2 3.31Å
322	D	74.2	Confident	77.5	Confident	9 Å²	9	23.3 Å²	23.3	5%	0.048	11%	0.107	C	C	.	.	H	α-helix	trans	-74.4	-38	177.8	-64.6	-32.7	0	0	0	110.8	Y314 R319 I324 R325 V326 W493	Y314-D322 HydrophobicContact CD2-CB 4.39Å; Y314-D322 HydrophobicContact CG-CB 4.44Å; R319-D322 IonicContact CZ-OD2 3.45Å; R319-D322 IonicContact NE-OD2 2.81Å; R319-D322 PolarHBondContact NE-OD2 3.28Å; R319-D322 IonicContact NH2-OD2 3.75Å; R319-D322 PolarHBondContact NH2-OD2 3.26Å; R319-D322 PolarHBondContact O-N 3.36Å; D322-I324 PolarHBondContact O-N 2.88Å; D322-R325 PolarHBondContact O-N 3.39Å; D322-R325 IonicContact OD1-CZ 3.01Å; D322-R325 IonicContact OD1-NH1 3.98Å; D322-R325 PolarHBondContact OD1-NH1 3.38Å; D322-V326 WeakPolarHBondContact O-CB 3.48Å; D322-V326 VanDerWaalsContact O-CG2 3.25Å; D322-V326 WeakPolarHBondContact O-CG2 3.48Å; D322-V326 PolarHBondContact O-N 3.35Å; D322-W493 PolarHBondContact OD1-N 3.31Å; D322-W493 WeakPolarHBondContact OD2-CB 3.08Å; D322-W493 PolarHBondContact OD2-N 2.96Å
323	A	80.1	Confident	77.1	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-56.2	-46.7	171.2	0	0	0	0	0	112.1	R319 Y320 R325 V326 F327	R319-A323 PolarHBondContact O-N 2.94Å; Y320-A323 PolarHBondContact O-N 3.32Å; A323-R325 PolarHBondContact O-N 3.37Å; A323-V326 PolarHBondContact O-N 3.33Å; A323-F327 HydrophobicContact CB-CD2 4.38Å; A323-F327 HydrophobicContact CB-CE2 4.19Å; A323-F327 WeakPolarHBondContact O-CB 3.45Å; A323-F327 WeakPolarHBondContact O-CD2 3.4Å; A323-F327 WeakPolarHBondContact O-CG 3.2Å; A323-F327 PolarHBondContact O-N 3.46Å
324	I	80.2	Confident	76.7	Confident	5 Å²	5	25.6 Å²	25.6	3%	0.026	12%	0.117	C	C	.	.	H	α-helix	trans	-61.2	-42.3	178.3	-70	163.3	0	0	0	111.3	Y320 D322 A328 L362 A365 L366 Y369 M371 I373	Y320-I324 WeakPolarHBondContact O-CB 3.5Å; Y320-I324 WeakPolarHBondContact O-CD1 3.47Å; Y320-I324 WeakPolarHBondContact O-CG1 3.33Å; Y320-I324 PolarHBondContact O-N 3.44Å; D322-I324 PolarHBondContact O-N 2.88Å; I324-A328 VanDerWaalsContact O-CB 3.25Å; I324-A328 WeakPolarHBondContact O-CB 3.02Å; I324-A328 PolarHBondContact O-N 2.86Å; I324-L362 HydrophobicContact CB-CD1 4.33Å; I324-L362 HydrophobicContact CG1-CD1 4.12Å; I324-L362 HydrophobicContact CG2-CD1 4.1Å; I324-A365 HydrophobicContact CD1-CB 4.29Å; I324-A365 HydrophobicContact CG1-CB 3.78Å; I324-L366 HydrophobicContact CD1-CD2 4.45Å; I324-Y369 HydrophobicContact CD1-CD1 4.22Å; I324-M371 HydrophobicContact CD1-CB 4.36Å; I324-M371 HydrophobicContact CD1-CG 4.16Å; I324-M371 HydrophobicContact CD1-SD 4Å; I324-I373 HydrophobicContact CG2-CG2 3.68Å
325	R	80	Confident	76.3	Confident	95 Å²	95	29.2 Å²	29.2	36%	0.358	13%	0.134	S	C	.	.	H	α-helix	trans	-63.8	-46.4	177.5	-70.6	168	178.2	167.8	-11.8	111.8	Q321 D322 A323 A328 N329 W493	Q321-R325 WeakPolarHBondContact O-CG 3.32Å; Q321-R325 PolarHBondContact O-N 3.48Å; D322-R325 PolarHBondContact O-N 3.39Å; D322-R325 IonicContact OD1-CZ 3.01Å; D322-R325 IonicContact OD1-NH1 3.98Å; D322-R325 PolarHBondContact OD1-NH1 3.38Å; A323-R325 PolarHBondContact O-N 3.37Å; R325-A328 PolarHBondContact O-N 3.34Å; R325-N329 WeakPolarHBondContact O-CB 3.4Å; R325-N329 VanDerWaalsContact O-CG 3.22Å; R325-N329 PolarHBondContact O-N 2.97Å; R325-N329 PolarHBondContact O-ND2 3.25Å; R325-W493 PolarHBondContact NH1-O 3.48Å
326	V	78.9	Confident	76	Confident	13 Å²	13	38.7 Å²	38.7	8%	0.079	17%	0.169	C	C	.	.	H	α-helix	trans	-60.9	-48.1	178.3	168.7	0	0	0	0	110.2	Y307 V310 Y314 D322 A323 N329 I330	Y307-V326 HydrophobicContact CD1-CG1 3.68Å; Y307-V326 HydrophobicContact CG-CG1 4.47Å; V310-V326 HydrophobicContact CB-CG1 4.45Å; V310-V326 HydrophobicContact CG1-CG1 4.12Å; V310-V326 HydrophobicContact CG1-CG2 4.4Å; Y314-V326 HydrophobicContact CD2-CG2 4.14Å; Y314-V326 HydrophobicContact CE2-CG2 4.02Å; D322-V326 WeakPolarHBondContact O-CB 3.48Å; D322-V326 VanDerWaalsContact O-CG2 3.25Å; D322-V326 WeakPolarHBondContact O-CG2 3.48Å; D322-V326 PolarHBondContact O-N 3.35Å; A323-V326 PolarHBondContact O-N 3.33Å; V326-N329 PolarHBondContact O-N 3.08Å; V326-I330 WeakPolarHBondContact O-CG2 3.42Å; V326-I330 PolarHBondContact O-N 2.83Å; V326-I330 VanDerWaalsContact O-N 3.17Å
327	F	81	Confident	75.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.8	-42.7	176.2	-71.2	-48	0	0	0	112.5	A323 N329 I330 L331 M358 L361 L362	A323-F327 HydrophobicContact CB-CD2 4.38Å; A323-F327 HydrophobicContact CB-CE2 4.19Å; A323-F327 WeakPolarHBondContact O-CB 3.45Å; A323-F327 WeakPolarHBondContact O-CD2 3.4Å; A323-F327 WeakPolarHBondContact O-CG 3.2Å; A323-F327 PolarHBondContact O-N 3.46Å; F327-N329 PolarHBondContact O-N 2.88Å; F327-I330 VanDerWaalsContact O-CG2 3.24Å; F327-I330 WeakPolarHBondContact O-CG2 2.94Å; F327-I330 PolarHBondContact O-N 3.49Å; F327-L331 WeakPolarHBondContact O-CB 3.46Å; F327-L331 WeakPolarHBondContact O-CG 3.46Å; F327-L331 PolarHBondContact O-N 3.05Å; F327-M358 HydrophobicContact CD1-CB 4.27Å; F327-M358 HydrophobicContact CD1-CG 4.07Å; F327-M358 HydrophobicContact CD1-SD 4.45Å; F327-M358 HydrophobicContact CE1-CG 4.07Å; F327-L361 HydrophobicContact CE1-CB 4.45Å; F327-L361 HydrophobicContact CE1-CD1 4.17Å; F327-L361 HydrophobicContact CE2-CB 3.91Å; F327-L361 HydrophobicContact CZ-CB 3.78Å; F327-L361 HydrophobicContact CZ-CD1 3.7Å; F327-L361 HydrophobicContact CZ-CG 4.39Å; F327-L362 HydrophobicContact CB-CB 4.37Å; F327-L362 HydrophobicContact CB-CD1 4.12Å
328	A	79.7	Confident	75	Confident	14 Å²	14	42.3 Å²	42.3	12%	0.116	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-42.7	177.7	0	0	0	0	0	112	I324 R325 I330 L331 L332 I377	I324-A328 VanDerWaalsContact O-CB 3.25Å; I324-A328 WeakPolarHBondContact O-CB 3.02Å; I324-A328 PolarHBondContact O-N 2.86Å; R325-A328 PolarHBondContact O-N 3.34Å; A328-I330 PolarHBondContact O-N 3.33Å; A328-L331 PolarHBondContact O-N 3.15Å; A328-L332 WeakPolarHBondContact O-CG 3.45Å; A328-L332 PolarHBondContact O-N 2.89Å; A328-L332 VanDerWaalsContact O-N 3.08Å; A328-I377 HydrophobicContact CB-CD1 3.94Å; A328-I377 WeakPolarHBondContact O-CD1 3.44Å
329	N	79.3	Confident	74.3	Confident	73 Å²	73	43.5 Å²	43.5	39%	0.39	20%	0.195	S	C	.	.	H	α-helix	trans	-62.5	-43.9	178.9	-73.3	-15.3	0	0	0	112.2	R325 V326 F327 Y333	R325-N329 WeakPolarHBondContact O-CB 3.4Å; R325-N329 VanDerWaalsContact O-CG 3.22Å; R325-N329 PolarHBondContact O-N 2.97Å; R325-N329 PolarHBondContact O-ND2 3.25Å; V326-N329 PolarHBondContact O-N 3.08Å; F327-N329 PolarHBondContact O-N 2.88Å; N329-Y333 PolarHBondContact O-N 3.46Å; N329-Y333 VanDerWaalsContact O-N 3.12Å
330	I	76.7	Confident	73.2	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-72.6	-37.6	-180	-171.1	59.4	0	0	0	112.6	Q303 I304 Y307 V326 F327 A328 L332 Y333 I334 M358	Q303-I330 HydrophobicContact CG-CD1 4.49Å; I304-I330 HydrophobicContact CB-CD1 4.39Å; I304-I330 HydrophobicContact CG1-CD1 3.87Å; I304-I330 HydrophobicContact CG1-CG1 4.47Å; Y307-I330 HydrophobicContact CD1-CB 4.44Å; Y307-I330 HydrophobicContact CD2-CB 4.34Å; Y307-I330 HydrophobicContact CD2-CD1 3.8Å; Y307-I330 HydrophobicContact CD2-CG1 4.33Å; Y307-I330 HydrophobicContact CG-CB 3.93Å; Y307-I330 HydrophobicContact CG-CD1 4.22Å; Y307-I330 HydrophobicContact CG-CG1 4.25Å; V326-I330 WeakPolarHBondContact O-CG2 3.42Å; V326-I330 PolarHBondContact O-N 2.83Å; V326-I330 VanDerWaalsContact O-N 3.17Å; F327-I330 VanDerWaalsContact O-CG2 3.24Å; F327-I330 WeakPolarHBondContact O-CG2 2.94Å; F327-I330 PolarHBondContact O-N 3.49Å; A328-I330 PolarHBondContact O-N 3.33Å; I330-L332 VanDerWaalsContact C-N 3.34Å; I330-L332 PolarHBondContact O-N 2.93Å; I330-Y333 HydrophobicContact CD1-CD1 3.93Å; I330-Y333 HydrophobicContact CD1-CG 4.5Å; I330-Y333 WeakPolarHBondContact O-CB 3.44Å; I330-Y333 PolarHBondContact O-N 3.49Å; I330-Y333 VanDerWaalsContact O-N 3.12Å; I330-I334 HydrophobicContact CD1-CG1 4.45Å; I330-I334 HydrophobicContact CG1-CD1 4.08Å; I330-I334 HydrophobicContact CG1-CG1 4.4Å; I330-I334 WeakPolarHBondContact O-CG1 3.47Å; I330-I334 PolarHBondContact O-N 3.31Å; I330-M358 HydrophobicContact CG1-CE 4.5Å; I330-M358 HydrophobicContact CG1-SD 4.17Å; I330-M358 HydrophobicContact CG2-SD 3.56Å; I330-M358 VanDerWaalsContact CG2-SD 3.56Å
331	L	75.2	Confident	72.1	Confident	7 Å²	7	50.7 Å²	50.7	4%	0.037	23%	0.231	C	C	.	.	H	α-helix	trans	-63.3	-40.8	176.7	-70.2	-178.1	0	0	0	111.6	F327 A328 Y333 I334 Q335 N355 M358 H359 L362 I377	F327-L331 WeakPolarHBondContact O-CB 3.46Å; F327-L331 WeakPolarHBondContact O-CG 3.46Å; F327-L331 PolarHBondContact O-N 3.05Å; A328-L331 PolarHBondContact O-N 3.15Å; L331-Y333 VanDerWaalsContact C-N 3.33Å; L331-Y333 PolarHBondContact O-N 2.96Å; L331-I334 PolarHBondContact O-N 2.99Å; L331-Q335 WeakPolarHBondContact O-CB 3.39Å; L331-Q335 PolarHBondContact O-N 3.25Å; L331-N355 WeakPolarHBondContact CD2-OD1 3.45Å; L331-M358 HydrophobicContact CD2-CB 4.14Å; L331-H359 WeakPolarHBondContact CD2-CE1 3.37Å; L331-L362 HydrophobicContact CD1-CD2 3.55Å; L331-I377 HydrophobicContact CB-CD1 4.14Å; L331-I377 HydrophobicContact CB-CG1 4.29Å; L331-I377 HydrophobicContact CD1-CG2 3.94Å
332	L	77.3	Confident	71	Confident	33 Å²	33	56 Å²	56	17%	0.173	26%	0.256	C	S	.	.	H	α-helix	trans	-62.6	-39.6	172	-71.8	173.9	0	0	0	112.1	A328 I330 Q335 R336 I377	A328-L332 WeakPolarHBondContact O-CG 3.45Å; A328-L332 PolarHBondContact O-N 2.89Å; A328-L332 VanDerWaalsContact O-N 3.08Å; I330-L332 VanDerWaalsContact C-N 3.34Å; I330-L332 PolarHBondContact O-N 2.93Å; L332-Q335 PolarHBondContact O-N 3.04Å; L332-R336 VanDerWaalsContact O-CG 3.31Å; L332-R336 WeakPolarHBondContact O-CG 3.18Å; L332-R336 PolarHBondContact O-N 3.41Å; L332-R336 VanDerWaalsContact O-N 3.1Å; L332-I377 HydrophobicContact CD1-CD1 4.37Å; L332-I377 HydrophobicContact CD2-CD1 3.97Å; L332-I377 HydrophobicContact CD2-CG1 4.18Å; L332-I377 HydrophobicContact CG-CD1 3.69Å; L332-I377 HydrophobicContact CG-CG1 4.4Å
333	Y	74.2	Confident	69.8	Low	43 Å²	43	67.2 Å²	67.2	17%	0.169	30%	0.298	C	S	.	.	H	α-helix	trans	-64.9	-44.1	177.4	177.6	-99	0	0	0	112.1	P300 Q303 N329 I330 L331 R336 T337	P300-Y333 HydrophobicContact CB-CE1 4.15Å; Q303-Y333 PolarHBondContact OE1-OH 2.84Å; N329-Y333 PolarHBondContact O-N 3.46Å; N329-Y333 VanDerWaalsContact O-N 3.12Å; I330-Y333 HydrophobicContact CD1-CD1 3.93Å; I330-Y333 HydrophobicContact CD1-CG 4.5Å; I330-Y333 WeakPolarHBondContact O-CB 3.44Å; I330-Y333 PolarHBondContact O-N 3.49Å; I330-Y333 VanDerWaalsContact O-N 3.12Å; L331-Y333 VanDerWaalsContact C-N 3.33Å; L331-Y333 PolarHBondContact O-N 2.96Å; Y333-R336 PolarHBondContact O-N 3.48Å; Y333-T337 WeakPolarHBondContact O-CB 3.39Å; Y333-T337 PolarHBondContact O-N 2.82Å; Y333-T337 PolarHBondContact O-OG1 3.45Å
334	I	74.3	Confident	68.4	Low	5 Å²	5	69.2 Å²	69.2	3%	0.026	31%	0.311	C	S	.	.	H	α-helix	trans	-63.9	-42.6	177	-67.4	169.1	0	0	0	110.7	I304 I330 L331 R336 T337 R338 N355 M358	I304-I334 HydrophobicContact CD1-CD1 4.39Å; I304-I334 HydrophobicContact CD1-CG1 4.06Å; I304-I334 HydrophobicContact CG1-CD1 4.13Å; I304-I334 HydrophobicContact CG1-CG1 4Å; I304-I334 HydrophobicContact CG2-CD1 4.18Å; I330-I334 HydrophobicContact CD1-CG1 4.45Å; I330-I334 HydrophobicContact CG1-CD1 4.08Å; I330-I334 HydrophobicContact CG1-CG1 4.4Å; I330-I334 WeakPolarHBondContact O-CG1 3.47Å; I330-I334 PolarHBondContact O-N 3.31Å; L331-I334 PolarHBondContact O-N 2.99Å; I334-R336 VanDerWaalsContact C-N 3.3Å; I334-R336 PolarHBondContact O-N 3.49Å; I334-T337 PolarHBondContact O-N 3.44Å; I334-R338 PolarHBondContact O-N 3.19Å; I334-N355 HydrophobicContact CD1-CB 4.31Å; I334-N355 WeakPolarHBondContact CG2-ND2 3.44Å; I334-M358 HydrophobicContact CD1-CE 3.64Å
335	Q	71.8	Confident	67.1	Low	84 Å²	84	73.9 Å²	73.9	39%	0.393	34%	0.34	S	S	.	.	H	α-helix	trans	-61.3	-39.4	178.1	-170.5	176.6	5	0	0	112.1	L331 L332	L331-Q335 WeakPolarHBondContact O-CB 3.39Å; L331-Q335 PolarHBondContact O-N 3.25Å; L332-Q335 PolarHBondContact O-N 3.04Å
336	R	71.5	Confident	65.9	Low	202 Å²	202	76.6 Å²	76.6	76%	0.762	35%	0.352	S	S	*	.	H	α-helix	trans	-71.2	-31.9	176.5	-71.1	174.6	-173.4	169.5	3.8	113.1	L332 Y333 I334	L332-R336 VanDerWaalsContact O-CG 3.31Å; L332-R336 WeakPolarHBondContact O-CG 3.18Å; L332-R336 PolarHBondContact O-N 3.41Å; L332-R336 VanDerWaalsContact O-N 3.1Å; Y333-R336 PolarHBondContact O-N 3.48Å; I334-R336 VanDerWaalsContact C-N 3.3Å; I334-R336 PolarHBondContact O-N 3.49Å
337	T	64.3	Low	65	Low	22 Å²	22	77.5 Å²	77.5	14%	0.135	36%	0.355	C	S	.	.	H	α-helix	trans	-98.1	-2.8	-171.3	-44.1	0	0	0	0	112.6	Y333 I334 N339 M340 F341	Y333-T337 WeakPolarHBondContact O-CB 3.39Å; Y333-T337 PolarHBondContact O-N 2.82Å; Y333-T337 PolarHBondContact O-OG1 3.45Å; I334-T337 PolarHBondContact O-N 3.44Å; T337-N339 PolarHBondContact O-N 3.21Å; T337-M340 HydrophobicContact CG2-CB 4.1Å; T337-M340 HydrophobicContact CG2-SD 4.28Å; T337-M340 WeakPolarHBondContact O-CB 3.31Å; T337-M340 PolarHBondContact O-N 3.48Å; T337-F341 HydrophobicContact CG2-CD2 4.09Å; T337-F341 HydrophobicContact CG2-CE2 3.36Å; T337-F341 HydrophobicContact CG2-CZ 3.66Å; T337-F341 WeakPolarHBondContact O-CD2 3.42Å; T337-F341 WeakPolarHBondContact O-CE2 3.4Å
338	R	62.5	Low	64.1	Low	140 Å²	140	79.8 Å²	79.8	53%	0.528	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-35.2	-177.4	-165.6	176.2	179.7	-173.8	-2.2	115.1	I334 Y348	I334-R338 PolarHBondContact O-N 3.19Å; R338-Y348 HydrophobicContact CG-CE2 4.44Å; R338-Y348 PolarHBondContact NE-OH 3.38Å
339	N	56.7	Low	63.4	Low	135 Å²	135	85.1 Å²	85.1	72%	0.722	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-22.5	-179.5	-67.1	-14.8	0	0	0	113.6	T337	T337-N339 PolarHBondContact O-N 3.21Å
340	M	51.8	Low	62.8	Low	143 Å²	143	86.1 Å²	86.1	70%	0.704	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-27.4	179.7	-170.3	179.8	-89.8	0	0	111.9	T337	T337-M340 HydrophobicContact CG2-CB 4.1Å; T337-M340 HydrophobicContact CG2-SD 4.28Å; T337-M340 WeakPolarHBondContact O-CB 3.31Å; T337-M340 PolarHBondContact O-N 3.48Å
341	F	52.3	Low	62.5	Low	27 Å²	27	86.3 Å²	86.3	12%	0.118	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-83.2	-10.4	-176.3	-63	-68.5	0	0	0	115.5	P300 I304 T337 R343 S344 Y348 I351	P300-F341 HydrophobicContact CB-CE1 3.59Å; P300-F341 HydrophobicContact CB-CZ 3.4Å; P300-F341 VanDerWaalsContact CB-CZ 3.4Å; P300-F341 HydrophobicContact CG-CE1 4.1Å; P300-F341 HydrophobicContact CG-CZ 4.12Å; I304-F341 HydrophobicContact CD1-CZ 4.14Å; T337-F341 HydrophobicContact CG2-CD2 4.09Å; T337-F341 HydrophobicContact CG2-CE2 3.36Å; T337-F341 HydrophobicContact CG2-CZ 3.66Å; T337-F341 WeakPolarHBondContact O-CD2 3.42Å; T337-F341 WeakPolarHBondContact O-CE2 3.4Å; F341-R343 PolarHBondContact O-N 3.14Å; F341-R343 VanDerWaalsContact O-N 3.09Å; F341-S344 PolarHBondContact O-N 2.95Å; F341-Y348 HydrophobicContact CB-CD2 3.78Å; F341-Y348 HydrophobicContact CB-CE2 4.42Å; F341-I351 HydrophobicContact CD1-CD1 4.01Å; F341-I351 HydrophobicContact CE1-CD1 4.01Å
342	Q	49.4	Very low	62.4	Low	126 Å²	126	87.9 Å²	87.9	59%	0.589	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-67.2	-9.4	-178.2	-71.7	-177.5	-7.1	0	0	113.9
343	R	49.3	Very low	62.5	Low	244 Å²	244	92.1 Å²	92.1	92%	0.921	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-78.5	-17.7	179.8	-76.5	-176.2	168.5	-168.7	-3.2	114.4	F341	F341-R343 PolarHBondContact O-N 3.14Å; F341-R343 VanDerWaalsContact O-N 3.09Å
344	S	51.1	Low	62.4	Low	41 Å²	41	91.2 Å²	91.2	29%	0.287	41%	0.413	S	S	.	.			trans	-130.6	100.4	178.5	-165.5	0	0	0	0	111.3	F341 Y346 K347 Y348	F341-S344 PolarHBondContact O-N 2.95Å; S344-Y346 PolarHBondContact O-N 3.21Å; S344-K347 PolarHBondContact O-N 3.4Å; S344-Y348 WeakPolarHBondContact O-CB 3.28Å; S344-Y348 PolarHBondContact O-N 2.79Å; S344-Y348 VanDerWaalsContact O-N 3.15Å
345	T	51.4	Low	62.7	Low	104 Å²	104	92.2 Å²	92.2	64%	0.638	42%	0.419	S	S	*	.	H	α-helix	trans	-61.5	-40.6	-169.3	-45.6	0	0	0	0	113.6	E349	T345-E349 PolarHBondContact O-N 2.98Å
346	Y	55.7	Low	63	Low	151 Å²	151	92 Å²	92	59%	0.592	42%	0.417	S	S	*	.	H	α-helix	trans	-69.4	-42.5	-177.6	-178.8	-101	0	0	0	112.7	S344 Y348 E349 M350	S344-Y346 PolarHBondContact O-N 3.21Å; Y346-Y348 VanDerWaalsContact C-N 3.35Å; Y346-E349 PolarHBondContact O-N 3.21Å; Y346-M350 PolarHBondContact O-N 3.16Å
347	K	58.9	Low	63.4	Low	33 Å²	33	83.6 Å²	83.6	14%	0.143	39%	0.387	C	S	.	.	H	α-helix	trans	-68.6	-35.7	179.2	-69.5	172.4	157.4	-140	0	111.4	D176 E301 S344 M350 I351	D176-K347 IonicContact OD2-NZ 3.56Å; E301-K347 WeakPolarHBondContact OE1-CD 3.47Å; E301-K347 WeakPolarHBondContact OE1-CE 3.22Å; E301-K347 IonicContact OE1-NZ 2.85Å; E301-K347 PolarHBondContact OE1-NZ 3.47Å; E301-K347 IonicContact OE2-NZ 3.84Å; S344-K347 PolarHBondContact O-N 3.4Å; K347-M350 PolarHBondContact O-N 3.02Å; K347-I351 WeakPolarHBondContact O-CB 3.41Å; K347-I351 WeakPolarHBondContact O-CD1 3.46Å; K347-I351 VanDerWaalsContact O-CG1 3.25Å; K347-I351 WeakPolarHBondContact O-CG1 3.34Å; K347-I351 PolarHBondContact O-N 2.97Å; K347-I351 VanDerWaalsContact O-N 3.11Å
348	Y	63.3	Low	64.2	Low	47 Å²	47	82.6 Å²	82.6	18%	0.184	38%	0.381	C	S	.	.	H	α-helix	trans	-64.1	-39	176.4	-177.6	-111.1	0	0	0	113.3	R338 F341 S344 Y346 N352	R338-Y348 HydrophobicContact CG-CE2 4.44Å; R338-Y348 PolarHBondContact NE-OH 3.38Å; F341-Y348 HydrophobicContact CB-CD2 3.78Å; F341-Y348 HydrophobicContact CB-CE2 4.42Å; S344-Y348 WeakPolarHBondContact O-CB 3.28Å; S344-Y348 PolarHBondContact O-N 2.79Å; S344-Y348 VanDerWaalsContact O-N 3.15Å; Y346-Y348 VanDerWaalsContact C-N 3.35Å; Y348-N352 WeakPolarHBondContact CD1-ND2 3.39Å; Y348-N352 WeakPolarHBondContact CE1-ND2 3.26Å; Y348-N352 WeakPolarHBondContact O-CB 3.49Å; Y348-N352 VanDerWaalsContact O-CG 3.24Å; Y348-N352 PolarHBondContact O-N 2.86Å; Y348-N352 PolarHBondContact O-ND2 2.78Å; Y348-N352 VanDerWaalsContact O-ND2 3.08Å
349	E	64.8	Low	65.1	Low	126 Å²	126	76.2 Å²	76.2	59%	0.589	36%	0.357	S	S	*	.	H	α-helix	trans	-66.4	-42.7	178	-74	-178.1	-179.4	0	0	112.5	T345 Y346 N352 K353	T345-E349 PolarHBondContact O-N 2.98Å; Y346-E349 PolarHBondContact O-N 3.21Å; E349-N352 PolarHBondContact O-N 3.29Å; E349-K353 PolarHBondContact O-N 3.25Å
350	M	66.7	Low	66.2	Low	94 Å²	94	69.8 Å²	69.8	46%	0.463	32%	0.323	S	S	.	.	H	α-helix	trans	-65.2	-42.7	177.5	-166.1	171.4	81.7	0	0	111.8	Y346 K347 K353 Q354	Y346-M350 PolarHBondContact O-N 3.16Å; K347-M350 PolarHBondContact O-N 3.02Å; M350-K353 PolarHBondContact O-N 3.19Å; M350-Q354 PolarHBondContact O-N 3.48Å
351	I	69.5	Low	67.6	Low	5 Å²	5	63 Å²	63	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-63.3	-42.3	175.3	-69.9	167	0	0	0	111.1	E301 I304 F341 K347 K353 Q354 N355	E301-I351 HydrophobicContact CG-CD1 4.2Å; I304-I351 HydrophobicContact CD1-CD1 4.3Å; I304-I351 HydrophobicContact CD1-CG1 4.3Å; I304-I351 HydrophobicContact CD1-CG2 3.76Å; F341-I351 HydrophobicContact CD1-CD1 4.01Å; F341-I351 HydrophobicContact CE1-CD1 4.01Å; K347-I351 WeakPolarHBondContact O-CB 3.41Å; K347-I351 WeakPolarHBondContact O-CD1 3.46Å; K347-I351 VanDerWaalsContact O-CG1 3.25Å; K347-I351 WeakPolarHBondContact O-CG1 3.34Å; K347-I351 PolarHBondContact O-N 2.97Å; K347-I351 VanDerWaalsContact O-N 3.11Å; I351-K353 VanDerWaalsContact C-N 3.32Å; I351-K353 PolarHBondContact O-N 2.88Å; I351-Q354 PolarHBondContact O-N 2.89Å; I351-N355 VanDerWaalsContact O-CB 3.27Å; I351-N355 WeakPolarHBondContact O-CB 3.07Å; I351-N355 PolarHBondContact O-N 3.14Å
352	N	73.8	Confident	68.9	Low	40 Å²	40	61.7 Å²	61.7	21%	0.214	28%	0.283	C	S	.	.	H	α-helix	trans	-64.9	-37.9	177.2	-77.8	-34.6	0	0	0	112.1	Y348 E349 N355 E356	Y348-N352 WeakPolarHBondContact CD1-ND2 3.39Å; Y348-N352 WeakPolarHBondContact CE1-ND2 3.26Å; Y348-N352 WeakPolarHBondContact O-CB 3.49Å; Y348-N352 VanDerWaalsContact O-CG 3.24Å; Y348-N352 PolarHBondContact O-N 2.86Å; Y348-N352 PolarHBondContact O-ND2 2.78Å; Y348-N352 VanDerWaalsContact O-ND2 3.08Å; E349-N352 PolarHBondContact O-N 3.29Å; N352-N355 VanDerWaalsContact O-CB 3.32Å; N352-N355 WeakPolarHBondContact O-CB 3.29Å; N352-N355 PolarHBondContact O-N 3.46Å; N352-E356 WeakPolarHBondContact O-CG 3.09Å; N352-E356 PolarHBondContact O-N 3.22Å
353	K	78.4	Confident	70.4	Confident	122 Å²	122	55.7 Å²	55.7	53%	0.53	26%	0.255	S	S	.	.	H	α-helix	trans	-62.8	-47	174.4	-172.9	176	-177.5	174.5	0	111.3	E349 M350 I351 N355 E356 Q357	E349-K353 PolarHBondContact O-N 3.25Å; M350-K353 PolarHBondContact O-N 3.19Å; I351-K353 VanDerWaalsContact C-N 3.32Å; I351-K353 PolarHBondContact O-N 2.88Å; K353-N355 VanDerWaalsContact C-N 3.26Å; K353-N355 PolarHBondContact O-N 3.34Å; K353-E356 PolarHBondContact O-N 3.25Å; K353-Q357 WeakPolarHBondContact O-CG 3.49Å; K353-Q357 PolarHBondContact O-N 2.85Å
354	Q	72.9	Confident	71.7	Confident	24 Å²	24	44 Å²	44	11%	0.112	21%	0.211	C	C	.	.	H	α-helix	trans	-60.1	-39.1	173.9	-73.5	179.9	-18.6	0	0	111.5	M350 I351 E356 Q357 M358	M350-Q354 PolarHBondContact O-N 3.48Å; I351-Q354 PolarHBondContact O-N 2.89Å; Q354-E356 PolarHBondContact O-N 3.33Å; Q354-Q357 WeakPolarHBondContact O-CB 3.33Å; Q354-Q357 PolarHBondContact O-N 3.37Å; Q354-M358 HydrophobicContact CB-CE 4.31Å; Q354-M358 WeakPolarHBondContact O-CE 3.3Å; Q354-M358 WeakPolarHBondContact O-CG 3.46Å; Q354-M358 PolarHBondContact O-N 3.17Å
355	N	79.7	Confident	73	Confident	27 Å²	27	42.1 Å²	42.1	14%	0.144	20%	0.198	C	C	.	.	H	α-helix	trans	-59.7	-44.8	175.3	-170.7	8	0	0	0	111.7	L331 I334 I351 N352 K353 M358 H359	L331-N355 WeakPolarHBondContact CD2-OD1 3.45Å; I334-N355 HydrophobicContact CD1-CB 4.31Å; I334-N355 WeakPolarHBondContact CG2-ND2 3.44Å; I351-N355 VanDerWaalsContact O-CB 3.27Å; I351-N355 WeakPolarHBondContact O-CB 3.07Å; I351-N355 PolarHBondContact O-N 3.14Å; N352-N355 VanDerWaalsContact O-CB 3.32Å; N352-N355 WeakPolarHBondContact O-CB 3.29Å; N352-N355 PolarHBondContact O-N 3.46Å; K353-N355 VanDerWaalsContact C-N 3.26Å; K353-N355 PolarHBondContact O-N 3.34Å; N355-M358 PolarHBondContact O-N 3.04Å; N355-H359 PolarHBondContact O-N 3.3Å; N355-H359 PolarHBondContact O-ND1 3.42Å; N355-H359 PolarHBondContact OD1-CE1 2.7Å; N355-H359 PolarHBondContact OD1-ND1 3.23Å; N355-H359 VanDerWaalsContact OD1-ND1 3.09Å
356	E	79.9	Confident	74.1	Confident	78 Å²	78	37.8 Å²	37.8	36%	0.364	17%	0.171	S	C	.	.	H	α-helix	trans	-66.1	-39.4	174.9	-70.4	-177.6	166.2	0	0	112.4	N352 K353 Q354 M358 H359 G360 K384 Y385 F406	N352-E356 WeakPolarHBondContact O-CG 3.09Å; N352-E356 PolarHBondContact O-N 3.22Å; K353-E356 PolarHBondContact O-N 3.25Å; Q354-E356 PolarHBondContact O-N 3.33Å; E356-M358 VanDerWaalsContact C-N 3.34Å; E356-M358 PolarHBondContact O-N 3.2Å; E356-H359 PolarHBondContact O-N 3.16Å; E356-G360 PolarHBondContact O-N 3.45Å; E356-K384 IonicContact OE1-NZ 3.09Å; E356-Y385 PolarHBondContact O-OH 3.27Å; E356-F406 HydrophobicContact CB-CE1 4.26Å; E356-F406 HydrophobicContact CB-CZ 4.35Å
357	Q	79.9	Confident	74.8	Confident	27 Å²	27	31.4 Å²	31.4	13%	0.126	15%	0.147	C	C	.	.	H	α-helix	trans	-61.1	-43.2	173.1	-68.6	177.7	-46.9	0	0	111.4	Y308 K353 Q354 H359 G360 L361 F406 A407	Y308-Q357 HydrophobicContact CE2-CB 4.18Å; K353-Q357 WeakPolarHBondContact O-CG 3.49Å; K353-Q357 PolarHBondContact O-N 2.85Å; Q354-Q357 WeakPolarHBondContact O-CB 3.33Å; Q354-Q357 PolarHBondContact O-N 3.37Å; Q357-H359 PolarHBondContact O-N 3.43Å; Q357-G360 WeakPolarHBondContact O-CA 3.46Å; Q357-G360 PolarHBondContact O-N 3.44Å; Q357-G360 VanDerWaalsContact O-N 3.13Å; Q357-L361 WeakPolarHBondContact O-CG 3.39Å; Q357-L361 PolarHBondContact O-N 2.79Å; Q357-F406 HydrophobicContact CG-CD1 4.19Å; Q357-F406 HydrophobicContact CG-CE1 3.89Å; Q357-F406 HydrophobicContact CG-CZ 4.39Å; Q357-F406 WeakPolarHBondContact CG-O 3.34Å; Q357-F406 PolarHBondContact NE2-O 3.38Å; Q357-A407 HydrophobicContact CB-CB 4.38Å
358	M	80.2	Confident	75.3	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.5	-40.7	175.8	-76.7	-175.4	-82.4	0	0	112.5	I304 Y308 F327 I330 L331 I334 Q354 N355 E356 G360 L361 L362	I304-M358 HydrophobicContact CG2-CE 3.8Å; Y308-M358 HydrophobicContact CD2-CG 3.69Å; F327-M358 HydrophobicContact CD1-CB 4.27Å; F327-M358 HydrophobicContact CD1-CG 4.07Å; F327-M358 HydrophobicContact CD1-SD 4.45Å; F327-M358 HydrophobicContact CE1-CG 4.07Å; I330-M358 HydrophobicContact CG1-CE 4.5Å; I330-M358 HydrophobicContact CG1-SD 4.17Å; I330-M358 HydrophobicContact CG2-SD 3.56Å; I330-M358 VanDerWaalsContact CG2-SD 3.56Å; L331-M358 HydrophobicContact CD2-CB 4.14Å; I334-M358 HydrophobicContact CD1-CE 3.64Å; Q354-M358 HydrophobicContact CB-CE 4.31Å; Q354-M358 WeakPolarHBondContact O-CE 3.3Å; Q354-M358 WeakPolarHBondContact O-CG 3.46Å; Q354-M358 PolarHBondContact O-N 3.17Å; N355-M358 PolarHBondContact O-N 3.04Å; E356-M358 VanDerWaalsContact C-N 3.34Å; E356-M358 PolarHBondContact O-N 3.2Å; M358-G360 VanDerWaalsContact C-N 3.31Å; M358-G360 PolarHBondContact O-N 3.26Å; M358-L361 PolarHBondContact O-N 2.94Å; M358-L362 VanDerWaalsContact O-CB 3.26Å; M358-L362 WeakPolarHBondContact O-CB 3.39Å; M358-L362 PolarHBondContact O-N 3.37Å
359	H	80.6	Confident	75.5	Confident	6 Å²	6	28.8 Å²	28.8	3%	0.028	14%	0.137	C	C	.	.	H	α-helix	trans	-62.7	-39	172.5	-76.5	86.6	0	0	0	111.8	L331 N355 E356 Q357 L362 A363 L381 Y385	L331-H359 WeakPolarHBondContact CD2-CE1 3.37Å; N355-H359 PolarHBondContact O-N 3.3Å; N355-H359 PolarHBondContact O-ND1 3.42Å; N355-H359 PolarHBondContact OD1-CE1 2.7Å; N355-H359 PolarHBondContact OD1-ND1 3.23Å; N355-H359 VanDerWaalsContact OD1-ND1 3.09Å; E356-H359 PolarHBondContact O-N 3.16Å; Q357-H359 PolarHBondContact O-N 3.43Å; H359-L362 PolarHBondContact O-N 3.12Å; H359-A363 WeakPolarHBondContact O-CB 3.45Å; H359-A363 PolarHBondContact O-N 3.1Å; H359-L381 HydrophobicContact CB-CD1 4.35Å; H359-L381 WeakPolarHBondContact O-CD1 3.22Å; H359-Y385 HydrophobicContact CB-CD2 4.21Å; H359-Y385 HydrophobicContact CB-CE2 3.65Å
360	G	80.3	Confident	75.5	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.7	-46.3	173.5	0	0	0	0	0	113	E356 Q357 M358 A363 I364	E356-G360 PolarHBondContact O-N 3.45Å; Q357-G360 WeakPolarHBondContact O-CA 3.46Å; Q357-G360 PolarHBondContact O-N 3.44Å; Q357-G360 VanDerWaalsContact O-N 3.13Å; M358-G360 VanDerWaalsContact C-N 3.31Å; M358-G360 PolarHBondContact O-N 3.26Å; G360-A363 WeakPolarHBondContact O-CB 3.41Å; G360-A363 PolarHBondContact O-N 3.2Å; G360-I364 PolarHBondContact O-N 2.88Å; G360-I364 VanDerWaalsContact O-N 3.16Å
361	L	80.9	Confident	75.5	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-65.6	-39.1	176	-65.6	175.3	0	0	0	111.9	Y308 F312 L315 F327 Q357 M358 A363 I364 A365 A407	Y308-L361 HydrophobicContact CD2-CD1 4.3Å; Y308-L361 HydrophobicContact CE2-CD1 3.78Å; F312-L361 HydrophobicContact CB-CD1 4.46Å; F312-L361 HydrophobicContact CD2-CD1 3.93Å; F312-L361 HydrophobicContact CD2-CD2 4.15Å; F312-L361 HydrophobicContact CE2-CD2 4.4Å; L315-L361 HydrophobicContact CD1-CB 4.31Å; L315-L361 HydrophobicContact CD1-CD2 4.3Å; F327-L361 HydrophobicContact CE1-CB 4.45Å; F327-L361 HydrophobicContact CE1-CD1 4.17Å; F327-L361 HydrophobicContact CE2-CB 3.91Å; F327-L361 HydrophobicContact CZ-CB 3.78Å; F327-L361 HydrophobicContact CZ-CD1 3.7Å; F327-L361 HydrophobicContact CZ-CG 4.39Å; Q357-L361 WeakPolarHBondContact O-CG 3.39Å; Q357-L361 PolarHBondContact O-N 2.79Å; M358-L361 PolarHBondContact O-N 2.94Å; L361-A363 VanDerWaalsContact C-N 3.34Å; L361-I364 PolarHBondContact O-N 3.08Å; L361-A365 WeakPolarHBondContact O-CB 3.4Å; L361-A365 PolarHBondContact O-N 3.28Å; L361-A407 HydrophobicContact CD2-CB 3.55Å; L361-A407 HydrophobicContact CG-CB 3.7Å
362	L	81.3	Confident	75.2	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.2	-38.9	176.1	-179.4	61.2	0	0	0	111.4	I324 F327 L331 M358 H359 I364 A365 L366 I377	I324-L362 HydrophobicContact CB-CD1 4.33Å; I324-L362 HydrophobicContact CG1-CD1 4.12Å; I324-L362 HydrophobicContact CG2-CD1 4.1Å; F327-L362 HydrophobicContact CB-CB 4.37Å; F327-L362 HydrophobicContact CB-CD1 4.12Å; L331-L362 HydrophobicContact CD1-CD2 3.55Å; M358-L362 VanDerWaalsContact O-CB 3.26Å; M358-L362 WeakPolarHBondContact O-CB 3.39Å; M358-L362 PolarHBondContact O-N 3.37Å; H359-L362 PolarHBondContact O-N 3.12Å; L362-I364 VanDerWaalsContact C-N 3.34Å; L362-I364 PolarHBondContact O-N 2.65Å; L362-A365 PolarHBondContact O-N 3.05Å; L362-L366 HydrophobicContact CD1-CD1 3.83Å; L362-L366 HydrophobicContact CD1-CG 4.17Å; L362-L366 HydrophobicContact CD2-CD1 4.38Å; L362-L366 HydrophobicContact CG-CD1 3.71Å; L362-L366 HydrophobicContact CG-CG 4.49Å; L362-L366 WeakPolarHBondContact O-CB 3.49Å; L362-L366 WeakPolarHBondContact O-CD1 3.35Å; L362-L366 WeakPolarHBondContact O-CG 3.05Å; L362-L366 PolarHBondContact O-N 3.32Å; L362-I377 HydrophobicContact CD2-CG2 3.67Å
363	A	78.9	Confident	75	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.1	-45.6	174	0	0	0	0	0	111.5	H359 G360 L361 L366 T367 L381 M389 M392 L403	H359-A363 WeakPolarHBondContact O-CB 3.45Å; H359-A363 PolarHBondContact O-N 3.1Å; G360-A363 WeakPolarHBondContact O-CB 3.41Å; G360-A363 PolarHBondContact O-N 3.2Å; L361-A363 VanDerWaalsContact C-N 3.34Å; A363-L366 PolarHBondContact O-N 3.46Å; A363-T367 WeakPolarHBondContact O-CG2 3.41Å; A363-T367 PolarHBondContact O-N 3.08Å; A363-T367 PolarHBondContact O-OG1 3.39Å; A363-L381 HydrophobicContact CB-CD1 4.01Å; A363-M389 HydrophobicContact CB-CG 4.03Å; A363-M389 HydrophobicContact CB-SD 4.27Å; A363-M392 HydrophobicContact CB-CE 4.22Å; A363-L403 HydrophobicContact CB-CD2 4.36Å
364	I	78.2	Confident	74.5	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61	-49.7	174.8	-69.7	169.2	0	0	0	110.5	L315 G360 L361 L362 L366 T367 M368 M392 F400 L403 F438	L315-I364 HydrophobicContact CD1-CG2 4.45Å; G360-I364 PolarHBondContact O-N 2.88Å; G360-I364 VanDerWaalsContact O-N 3.16Å; L361-I364 PolarHBondContact O-N 3.08Å; L362-I364 VanDerWaalsContact C-N 3.34Å; L362-I364 PolarHBondContact O-N 2.65Å; I364-L366 VanDerWaalsContact C-N 3.28Å; I364-L366 PolarHBondContact O-N 3.42Å; I364-T367 PolarHBondContact O-N 3.25Å; I364-T367 PolarHBondContact O-OG1 3.22Å; I364-M368 HydrophobicContact CG2-CG 4.45Å; I364-M368 HydrophobicContact CG2-SD 3.88Å; I364-M368 VanDerWaalsContact O-CG 3.3Å; I364-M368 WeakPolarHBondContact O-CG 3.46Å; I364-M368 PolarHBondContact O-N 3.38Å; I364-M392 HydrophobicContact CG1-SD 4.27Å; I364-F400 HydrophobicContact CG1-CD1 4.37Å; I364-F400 HydrophobicContact CG2-CD1 4.42Å; I364-F400 HydrophobicContact CG2-CE1 4.37Å; I364-L403 HydrophobicContact CD1-CB 3.77Å; I364-L403 HydrophobicContact CG1-CB 4.23Å; I364-L403 HydrophobicContact CG1-CD2 4.16Å; I364-F438 HydrophobicContact CG2-CE2 4.25Å; I364-F438 HydrophobicContact CG2-CZ 3.63Å
365	A	77.8	Confident	74.3	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-37.4	-178	0	0	0	0	0	111.9	L315 I324 L361 L362 Y369	L315-A365 HydrophobicContact CD1-CB 4.42Å; I324-A365 HydrophobicContact CD1-CB 4.29Å; I324-A365 HydrophobicContact CG1-CB 3.78Å; L361-A365 WeakPolarHBondContact O-CB 3.4Å; L361-A365 PolarHBondContact O-N 3.28Å; L362-A365 PolarHBondContact O-N 3.05Å; A365-Y369 WeakPolarHBondContact O-CA 3.39Å; A365-Y369 PolarHBondContact O-N 3.39Å
366	L	74.9	Confident	74.1	Confident	14 Å²	14	38.8 Å²	38.8	7%	0.073	19%	0.187	C	C	.	.	H	α-helix	trans	-73.1	-33.8	177.2	-81	159.9	0	0	0	113.6	I324 L362 A363 I364 Y369 P370 M371 I373 L381 M389	I324-L366 HydrophobicContact CD1-CD2 4.45Å; L362-L366 HydrophobicContact CD1-CD1 3.83Å; L362-L366 HydrophobicContact CD1-CG 4.17Å; L362-L366 HydrophobicContact CD2-CD1 4.38Å; L362-L366 HydrophobicContact CG-CD1 3.71Å; L362-L366 HydrophobicContact CG-CG 4.49Å; L362-L366 WeakPolarHBondContact O-CB 3.49Å; L362-L366 WeakPolarHBondContact O-CD1 3.35Å; L362-L366 WeakPolarHBondContact O-CG 3.05Å; L362-L366 PolarHBondContact O-N 3.32Å; A363-L366 PolarHBondContact O-N 3.46Å; I364-L366 VanDerWaalsContact C-N 3.28Å; I364-L366 PolarHBondContact O-N 3.42Å; L366-Y369 CarbonylContact O-C 3.57Å; L366-P370 WeakPolarHBondContact O-CA 3.38Å; L366-M371 WeakPolarHBondContact CD2-O 3.44Å; L366-I373 HydrophobicContact CD1-CD1 3.75Å; L366-I373 HydrophobicContact CD1-CG1 4.37Å; L366-I373 HydrophobicContact CD1-CG2 4.37Å; L366-I373 HydrophobicContact CD2-CG1 4.42Å; L366-I373 HydrophobicContact CD2-CG2 3.94Å; L366-L381 HydrophobicContact CD1-CD2 3.33Å; L366-M389 HydrophobicContact CB-CE 4.07Å
367	T	69.6	Low	73.9	Confident	16 Å²	16	35.1 Å²	35.1	10%	0.098	17%	0.169	C	C	.	.	H	α-helix	trans	-69.8	-39.2	174.1	58.9	0	0	0	0	110.8	A363 I364 M389 M392	A363-T367 WeakPolarHBondContact O-CG2 3.41Å; A363-T367 PolarHBondContact O-N 3.08Å; A363-T367 PolarHBondContact O-OG1 3.39Å; I364-T367 PolarHBondContact O-N 3.25Å; I364-T367 PolarHBondContact O-OG1 3.22Å; T367-M389 HydrophobicContact CG2-CB 4.11Å; T367-M389 HydrophobicContact CG2-CE 4.11Å; T367-M389 HydrophobicContact CG2-CG 4.04Å; T367-M392 HydrophobicContact CG2-CB 3.92Å; T367-M392 HydrophobicContact CG2-CE 4.1Å; T367-M392 HydrophobicContact CG2-SD 4.33Å
368	M	69.4	Low	73.7	Confident	10 Å²	10	37.7 Å²	37.7	5%	0.049	18%	0.181	C	C	.	.	H	α-helix	trans	-72.7	-36.7	176.3	-65.2	-176	84.9	0	0	112.6	Y320 I364 F400 F438 E441 V442 Q445	Y320-M368 HydrophobicContact CE1-CE 4.24Å; Y320-M368 HydrophobicContact CE1-SD 3.92Å; Y320-M368 HydrophobicContact CE2-CE 4.49Å; Y320-M368 VanDerWaalsContact OH-CE 3.23Å; Y320-M368 WeakPolarHBondContact OH-CE 3.31Å; I364-M368 HydrophobicContact CG2-CG 4.45Å; I364-M368 HydrophobicContact CG2-SD 3.88Å; I364-M368 VanDerWaalsContact O-CG 3.3Å; I364-M368 WeakPolarHBondContact O-CG 3.46Å; I364-M368 PolarHBondContact O-N 3.38Å; M368-F400 HydrophobicContact CG-CE1 4.49Å; M368-F438 HydrophobicContact SD-CE2 4.2Å; M368-F438 HydrophobicContact SD-CZ 4.31Å; M368-E441 HydrophobicContact CE-CG 4.16Å; M368-V442 HydrophobicContact CE-CG2 3.99Å; M368-V442 HydrophobicContact SD-CG2 4.24Å; M368-Q445 HydrophobicContact CB-CG 4.15Å; M368-Q445 HydrophobicContact CE-CB 3.97Å; M368-Q445 HydrophobicContact CE-CG 4.04Å; M368-Q445 HydrophobicContact CG-CG 4.38Å; M368-Q445 PolarHBondContact O-NE2 2.92Å
369	Y	67.7	Low	73.6	Confident	15 Å²	15	41 Å²	41	6%	0.059	20%	0.202	C	C	.	.	S	Bend	trans	-135.9	91	-178.6	-164.8	-109.2	0	0	0	112.3	Q321 I324 A365 L366 M371 A507	Q321-Y369 HydrophobicContact CB-CE1 4.38Å; I324-Y369 HydrophobicContact CD1-CD1 4.22Å; A365-Y369 WeakPolarHBondContact O-CA 3.39Å; A365-Y369 PolarHBondContact O-N 3.39Å; L366-Y369 CarbonylContact O-C 3.57Å; Y369-M371 HydrophobicContact CD1-CG 3.36Å; Y369-M371 HydrophobicContact CD1-SD 3.66Å; Y369-M371 HydrophobicContact CE1-CE 4.49Å; Y369-M371 HydrophobicContact CE1-CG 3.15Å; Y369-M371 HydrophobicContact CE1-SD 3.44Å; Y369-M371 WeakPolarHBondContact CE1-SD 3.06Å; Y369-M371 PolarHBondContact O-N 3.01Å; Y369-A507 HydrophobicContact CE1-CB 3.94Å; Y369-A507 HydrophobicContact CE2-CB 3.88Å; Y369-A507 VanDerWaalsContact OH-CA 3.28Å; Y369-A507 WeakPolarHBondContact OH-CA 3.2Å; Y369-A507 WeakPolarHBondContact OH-CB 3.21Å; Y369-A507 PolarHBondContact OH-O 3.46Å
370	P	65.7	Low	73.4	Confident	66 Å²	66	43.7 Å²	43.7	43%	0.429	21%	0.214	S	C	.	.			trans	-62.2	105.6	178.4	-24.6	31.3	0	0	0	112.5	L366	L366-P370 WeakPolarHBondContact O-CA 3.38Å
371	M	67	Low	73.3	Confident	53 Å²	53	43.9 Å²	43.9	26%	0.261	22%	0.215	S	C	.	.			trans	-119.2	154.4	170.9	-70	-169.8	77.7	0	0	111.3	Q321 I324 L366 Y369 I373	Q321-M371 HydrophobicContact CB-SD 3.99Å; Q321-M371 HydrophobicContact CG-CE 3.83Å; Q321-M371 HydrophobicContact CG-SD 3.72Å; I324-M371 HydrophobicContact CD1-CB 4.36Å; I324-M371 HydrophobicContact CD1-CG 4.16Å; I324-M371 HydrophobicContact CD1-SD 4Å; L366-M371 WeakPolarHBondContact CD2-O 3.44Å; Y369-M371 HydrophobicContact CD1-CG 3.36Å; Y369-M371 HydrophobicContact CD1-SD 3.66Å; Y369-M371 HydrophobicContact CE1-CE 4.49Å; Y369-M371 HydrophobicContact CE1-CG 3.15Å; Y369-M371 HydrophobicContact CE1-SD 3.44Å; Y369-M371 WeakPolarHBondContact CE1-SD 3.06Å; Y369-M371 PolarHBondContact O-N 3.01Å; M371-I373 PolarHBondContact O-N 3.42Å
372	R	61.4	Low	73	Confident	221 Å²	221	52.4 Å²	52.4	83%	0.834	25%	0.247	S	C	*	.	P	Polyproline II helix	trans	-74.5	117.9	166.7	-67	-172.2	-179.7	-166.8	-3	108.9
373	I	70.1	Confident	73	Confident	26 Å²	26	59.8 Å²	59.8	13%	0.133	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-102.7	169.4	170	50.3	156.8	0	0	0	110	I324 L366 M371 I377 H378 L381	I324-I373 HydrophobicContact CG2-CG2 3.68Å; L366-I373 HydrophobicContact CD1-CD1 3.75Å; L366-I373 HydrophobicContact CD1-CG1 4.37Å; L366-I373 HydrophobicContact CD1-CG2 4.37Å; L366-I373 HydrophobicContact CD2-CG1 4.42Å; L366-I373 HydrophobicContact CD2-CG2 3.94Å; M371-I373 PolarHBondContact O-N 3.42Å; I373-I377 HydrophobicContact CD1-CB 4.43Å; I373-I377 HydrophobicContact CD1-CG2 4.07Å; I373-H378 HydrophobicContact CD1-CB 3.65Å; I373-H378 HydrophobicContact CG1-CB 3.91Å; I373-L381 HydrophobicContact CD1-CD2 4.4Å
374	D	68.6	Low	72.9	Confident	83 Å²	83	65.6 Å²	65.6	44%	0.444	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-57.9	139.2	174.3	-163.5	-72.4	0	0	0	111	S376 I377 H378	D374-S376 PolarHBondContact O-N 3.37Å; D374-S376 WeakPolarHBondContact OD1-CB 3.3Å; D374-S376 PolarHBondContact OD1-N 3.41Å; D374-S376 VanDerWaalsContact OD1-N 3.1Å; D374-S376 PolarHBondContact OD1-OG 2.88Å; D374-I377 HydrophobicContact CB-CD1 4.39Å; D374-I377 PolarHBondContact O-N 3.01Å; D374-H378 WeakPolarHBondContact O-CB 3.5Å; D374-H378 PolarHBondContact O-N 2.87Å
375	E	69.3	Low	72.8	Confident	162 Å²	162	66.6 Å²	66.6	76%	0.757	31%	0.311	S	S	*	.	H	α-helix	trans	-60.7	-32.2	-176.3	-81.3	-152.2	147.5	0	0	112.9	H378 T379	E375-H378 PolarHBondContact O-N 3.48Å; E375-T379 WeakPolarHBondContact O-CB 3.35Å; E375-T379 PolarHBondContact O-N 3.12Å; E375-T379 PolarHBondContact O-OG1 3.46Å
376	S	73.6	Confident	72.7	Confident	38 Å²	38	67.6 Å²	67.6	27%	0.266	32%	0.321	S	S	.	.	H	α-helix	trans	-63.5	-48.3	179.8	57.2	0	0	0	0	112	D374 Q380	D374-S376 PolarHBondContact O-N 3.37Å; D374-S376 WeakPolarHBondContact OD1-CB 3.3Å; D374-S376 PolarHBondContact OD1-N 3.41Å; D374-S376 VanDerWaalsContact OD1-N 3.1Å; D374-S376 PolarHBondContact OD1-OG 2.88Å; S376-Q380 PolarHBondContact O-N 3.21Å
377	I	75.9	Confident	72.9	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-69	-41.1	176.3	-63.6	164.7	0	0	0	110.1	A328 L331 L332 L362 I373 D374 T379 Q380 L381	A328-I377 HydrophobicContact CB-CD1 3.94Å; A328-I377 WeakPolarHBondContact O-CD1 3.44Å; L331-I377 HydrophobicContact CB-CD1 4.14Å; L331-I377 HydrophobicContact CB-CG1 4.29Å; L331-I377 HydrophobicContact CD1-CG2 3.94Å; L332-I377 HydrophobicContact CD1-CD1 4.37Å; L332-I377 HydrophobicContact CD2-CD1 3.97Å; L332-I377 HydrophobicContact CD2-CG1 4.18Å; L332-I377 HydrophobicContact CG-CD1 3.69Å; L332-I377 HydrophobicContact CG-CG1 4.4Å; L362-I377 HydrophobicContact CD2-CG2 3.67Å; I373-I377 HydrophobicContact CD1-CB 4.43Å; I373-I377 HydrophobicContact CD1-CG2 4.07Å; D374-I377 HydrophobicContact CB-CD1 4.39Å; D374-I377 PolarHBondContact O-N 3.01Å; I377-T379 VanDerWaalsContact C-N 3.28Å; I377-T379 PolarHBondContact O-N 3.41Å; I377-Q380 PolarHBondContact O-N 2.99Å; I377-L381 VanDerWaalsContact O-CB 3.26Å; I377-L381 WeakPolarHBondContact O-CB 3.43Å; I377-L381 PolarHBondContact O-N 2.93Å
378	H	76.1	Confident	73.2	Confident	81 Å²	81	76.6 Å²	76.6	38%	0.375	37%	0.365	S	S	.	.	H	α-helix	trans	-61.3	-38.5	-179.5	-169.8	-87.1	0	0	0	112.1	I373 D374 E375 R382	I373-H378 HydrophobicContact CD1-CB 3.65Å; I373-H378 HydrophobicContact CG1-CB 3.91Å; D374-H378 WeakPolarHBondContact O-CB 3.5Å; D374-H378 PolarHBondContact O-N 2.87Å; E375-H378 PolarHBondContact O-N 3.48Å; H378-R382 VanDerWaalsContact O-CB 3.25Å; H378-R382 WeakPolarHBondContact O-CB 3.32Å; H378-R382 PolarHBondContact O-N 2.93Å
379	T	78.7	Confident	73.5	Confident	70 Å²	70	77.5 Å²	77.5	43%	0.429	37%	0.369	S	S	.	.	H	α-helix	trans	-66.1	-49.1	177.7	-54.6	0	0	0	0	110.9	E375 I377 L381 R382 E383	E375-T379 WeakPolarHBondContact O-CB 3.35Å; E375-T379 PolarHBondContact O-N 3.12Å; E375-T379 PolarHBondContact O-OG1 3.46Å; I377-T379 VanDerWaalsContact C-N 3.28Å; I377-T379 PolarHBondContact O-N 3.41Å; T379-L381 VanDerWaalsContact C-N 3.32Å; T379-L381 PolarHBondContact O-N 2.86Å; T379-R382 PolarHBondContact O-N 2.73Å; T379-E383 WeakPolarHBondContact O-CG 3.27Å; T379-E383 PolarHBondContact O-N 2.89Å
380	Q	76.7	Confident	73.8	Confident	63 Å²	63	81.2 Å²	81.2	29%	0.294	39%	0.39	S	S	.	.	H	α-helix	trans	-62.5	-39.2	177.6	-69.4	178	8.2	0	0	112.7	S376 I377 E383 K384	S376-Q380 PolarHBondContact O-N 3.21Å; I377-Q380 PolarHBondContact O-N 2.99Å; Q380-E383 PolarHBondContact O-N 2.83Å; Q380-K384 PolarHBondContact O-N 3.02Å
381	L	77.7	Confident	74.4	Confident	3 Å²	3	83.7 Å²	83.7	2%	0.016	39%	0.391	C	S	.	.	H	α-helix	trans	-65.7	-42.9	177.2	-170	70.1	0	0	0	111.3	H359 A363 L366 I373 I377 T379 K384 Y385 G386 M389	H359-L381 HydrophobicContact CB-CD1 4.35Å; H359-L381 WeakPolarHBondContact O-CD1 3.22Å; A363-L381 HydrophobicContact CB-CD1 4.01Å; L366-L381 HydrophobicContact CD1-CD2 3.33Å; I373-L381 HydrophobicContact CD1-CD2 4.4Å; I377-L381 VanDerWaalsContact O-CB 3.26Å; I377-L381 WeakPolarHBondContact O-CB 3.43Å; I377-L381 PolarHBondContact O-N 2.93Å; T379-L381 VanDerWaalsContact C-N 3.32Å; T379-L381 PolarHBondContact O-N 2.86Å; L381-K384 PolarHBondContact O-N 3.35Å; L381-Y385 HydrophobicContact CD1-CD2 4.12Å; L381-Y385 CarbonylContact O-C 3.58Å; L381-Y385 WeakPolarHBondContact O-CA 3.12Å; L381-Y385 PolarHBondContact O-N 2.86Å; L381-G386 PolarHBondContact O-N 3.09Å; L381-M389 HydrophobicContact CD2-CE 4.18Å; L381-M389 HydrophobicContact CD2-SD 3.81Å; L381-M389 HydrophobicContact CG-SD 3.9Å
382	R	75.5	Confident	74.6	Confident	180 Å²	180	81.5 Å²	81.5	68%	0.679	38%	0.38	S	S	*	.	H	α-helix	trans	-66.2	-38.9	178	-174.8	178.7	-109.9	-145.4	-3.6	111.7	H378 T379 G386	H378-R382 VanDerWaalsContact O-CB 3.25Å; H378-R382 WeakPolarHBondContact O-CB 3.32Å; H378-R382 PolarHBondContact O-N 2.93Å; T379-R382 PolarHBondContact O-N 2.73Å; R382-G386 WeakPolarHBondContact O-CA 3.28Å; R382-G386 PolarHBondContact O-N 2.8Å
383	E	80.7	Confident	75	Confident	154 Å²	154	76.7 Å²	76.7	72%	0.72	37%	0.366	S	S	*	.	H	α-helix	trans	-65.8	-43.1	176.7	-74.9	176.3	178.1	0	0	112.6	T379 Q380	T379-E383 WeakPolarHBondContact O-CG 3.27Å; T379-E383 PolarHBondContact O-N 2.89Å; Q380-E383 PolarHBondContact O-N 2.83Å
384	K	77.4	Confident	74.9	Confident	122 Å²	122	83.5 Å²	83.5	53%	0.53	40%	0.395	S	S	.	.	H	α-helix	trans	-88.3	-36.3	-175.6	-71.5	-168.8	173.6	-164.9	0	114.7	E356 Q380 L381	E356-K384 IonicContact OE1-NZ 3.09Å; Q380-K384 PolarHBondContact O-N 3.02Å; L381-K384 PolarHBondContact O-N 3.35Å
385	Y	75.1	Confident	74.9	Confident	22 Å²	22	81.5 Å²	81.5	9%	0.086	39%	0.394	C	S	.	.	H	α-helix	trans	-125.6	6.7	-170.4	-65	-85.9	0	0	0	113.3	E356 H359 L381 D387 K388 M389 L403	E356-Y385 PolarHBondContact O-OH 3.27Å; H359-Y385 HydrophobicContact CB-CD2 4.21Å; H359-Y385 HydrophobicContact CB-CE2 3.65Å; L381-Y385 HydrophobicContact CD1-CD2 4.12Å; L381-Y385 CarbonylContact O-C 3.58Å; L381-Y385 WeakPolarHBondContact O-CA 3.12Å; L381-Y385 PolarHBondContact O-N 2.86Å; Y385-D387 PolarHBondContact O-N 3.34Å; Y385-K388 HydrophobicContact CD1-CD 3.95Å; Y385-K388 HydrophobicContact CE1-CD 4.5Å; Y385-K388 PolarHBondContact O-N 2.94Å; Y385-K388 VanDerWaalsContact O-N 3.13Å; Y385-M389 WeakPolarHBondContact O-CG 3.15Å; Y385-M389 PolarHBondContact O-N 3.24Å; Y385-L403 HydrophobicContact CD1-CD2 4.38Å
386	G	75.9	Confident	75.1	Confident	20 Å²	20	76 Å²	76	21%	0.206	37%	0.37	C	S	.	.	H	α-helix	trans	-54.5	-45.4	-177.7	0	0	0	0	0	114	L381 R382 M389 L390	L381-G386 PolarHBondContact O-N 3.09Å; R382-G386 WeakPolarHBondContact O-CA 3.28Å; R382-G386 PolarHBondContact O-N 2.8Å; G386-M389 PolarHBondContact O-N 3.32Å; G386-L390 PolarHBondContact O-N 3.19Å
387	D	79.3	Confident	75	Confident	137 Å²	137	77.1 Å²	77.1	73%	0.733	37%	0.373	S	S	*	.	H	α-helix	trans	-66.2	-40.1	178.7	-66.9	-24.4	0	0	0	112.1	Y385 L390 R391	Y385-D387 PolarHBondContact O-N 3.34Å; D387-L390 PolarHBondContact O-N 2.77Å; D387-R391 WeakPolarHBondContact O-CG 3.28Å; D387-R391 PolarHBondContact O-N 3.49Å
388	K	76.3	Confident	75	Confident	82 Å²	82	82.8 Å²	82.8	36%	0.357	40%	0.399	S	S	.	.	H	α-helix	trans	-67.3	-39.8	177	-67.6	178.4	168.1	-168	0	110.9	Y385 R391 M392 V399 L403	Y385-K388 HydrophobicContact CD1-CD 3.95Å; Y385-K388 HydrophobicContact CE1-CD 4.5Å; Y385-K388 PolarHBondContact O-N 2.94Å; Y385-K388 VanDerWaalsContact O-N 3.13Å; K388-R391 PolarHBondContact O-N 3Å; K388-M392 HydrophobicContact CB-CE 4.23Å; K388-M392 WeakPolarHBondContact O-CB 3.43Å; K388-M392 WeakPolarHBondContact O-CE 3.38Å; K388-M392 VanDerWaalsContact O-CG 3.27Å; K388-M392 WeakPolarHBondContact O-CG 3.49Å; K388-M392 PolarHBondContact O-N 3.31Å; K388-V399 HydrophobicContact CB-CG1 4Å; K388-V399 HydrophobicContact CG-CG1 4.34Å; K388-L403 HydrophobicContact CD-CD1 3.73Å
389	M	74.1	Confident	74.9	Confident	29 Å²	29	79 Å²	79	14%	0.143	38%	0.382	C	S	.	.	H	α-helix	trans	-62.7	-40.3	173.7	-70.7	-178.9	75.4	0	0	112.3	A363 L366 T367 L381 Y385 G386 M392 Q393	A363-M389 HydrophobicContact CB-CG 4.03Å; A363-M389 HydrophobicContact CB-SD 4.27Å; L366-M389 HydrophobicContact CB-CE 4.07Å; T367-M389 HydrophobicContact CG2-CB 4.11Å; T367-M389 HydrophobicContact CG2-CE 4.11Å; T367-M389 HydrophobicContact CG2-CG 4.04Å; L381-M389 HydrophobicContact CD2-CE 4.18Å; L381-M389 HydrophobicContact CD2-SD 3.81Å; L381-M389 HydrophobicContact CG-SD 3.9Å; Y385-M389 WeakPolarHBondContact O-CG 3.15Å; Y385-M389 PolarHBondContact O-N 3.24Å; G386-M389 PolarHBondContact O-N 3.32Å; M389-M392 HydrophobicContact CB-CE 4.49Å; M389-M392 HydrophobicContact CG-CE 4.03Å; M389-M392 PolarHBondContact O-N 2.94Å; M389-Q393 WeakPolarHBondContact O-CG 3.48Å; M389-Q393 PolarHBondContact O-N 2.88Å
390	L	75.8	Confident	74.5	Confident	94 Å²	94	76.3 Å²	76.3	49%	0.492	36%	0.364	S	S	.	.	H	α-helix	trans	-66.5	-39.3	176.7	-169.2	70.6	0	0	0	111.9	G386 D387 Q393 K394	G386-L390 PolarHBondContact O-N 3.19Å; D387-L390 PolarHBondContact O-N 2.77Å; L390-Q393 PolarHBondContact O-N 3.23Å; L390-K394 WeakPolarHBondContact O-CG 3.31Å; L390-K394 PolarHBondContact O-N 3.32Å
391	R	76.8	Confident	74.4	Confident	118 Å²	118	77 Å²	77	45%	0.445	37%	0.367	S	S	.	.	H	α-helix	trans	-66.9	-39.2	173.3	-72	178.6	63.5	-177.8	-2.8	112.4	D387 K388 Q393 K394 G395 D396 V399	D387-R391 WeakPolarHBondContact O-CG 3.28Å; D387-R391 PolarHBondContact O-N 3.49Å; K388-R391 PolarHBondContact O-N 3Å; R391-Q393 VanDerWaalsContact C-N 3.34Å; R391-Q393 PolarHBondContact O-N 2.81Å; R391-K394 WeakPolarHBondContact O-CB 3.44Å; R391-K394 PolarHBondContact O-N 3.21Å; R391-K394 VanDerWaalsContact O-N 3.12Å; R391-G395 PolarHBondContact O-N 3.46Å; R391-D396 HydrophobicContact CB-CB 4.48Å; R391-D396 IonicContact CZ-OD2 3.73Å; R391-D396 IonicContact NE-OD2 2.72Å; R391-D396 PolarHBondContact NE-OD2 2.9Å; R391-D396 IonicContact NH2-OD2 3.62Å; R391-D396 PolarHBondContact NH2-OD2 2.85Å; R391-D396 WeakPolarHBondContact O-CB 3.45Å; R391-D396 PolarHBondContact O-N 3.07Å; R391-V399 HydrophobicContact CB-CG2 4.09Å
392	M	71.6	Confident	74.5	Confident	7 Å²	7	81.2 Å²	81.2	3%	0.034	39%	0.387	C	S	.	.	H	α-helix	trans	-63.1	-39.1	173.9	-76.6	-173.6	-80.2	0	0	111.9	A363 I364 T367 K388 M389 K394 G395 V399 F400 L403	A363-M392 HydrophobicContact CB-CE 4.22Å; I364-M392 HydrophobicContact CG1-SD 4.27Å; T367-M392 HydrophobicContact CG2-CB 3.92Å; T367-M392 HydrophobicContact CG2-CE 4.1Å; T367-M392 HydrophobicContact CG2-SD 4.33Å; K388-M392 HydrophobicContact CB-CE 4.23Å; K388-M392 WeakPolarHBondContact O-CB 3.43Å; K388-M392 WeakPolarHBondContact O-CE 3.38Å; K388-M392 VanDerWaalsContact O-CG 3.27Å; K388-M392 WeakPolarHBondContact O-CG 3.49Å; K388-M392 PolarHBondContact O-N 3.31Å; M389-M392 HydrophobicContact CB-CE 4.49Å; M389-M392 HydrophobicContact CG-CE 4.03Å; M389-M392 PolarHBondContact O-N 2.94Å; M392-K394 PolarHBondContact O-N 3.39Å; M392-G395 PolarHBondContact O-N 2.96Å; M392-V399 HydrophobicContact CG-CB 4.18Å; M392-V399 HydrophobicContact CG-CG1 3.73Å; M392-V399 HydrophobicContact SD-CG1 4.34Å; M392-F400 HydrophobicContact CB-CD2 4.47Å; M392-F400 HydrophobicContact CB-CE1 4.41Å; M392-F400 HydrophobicContact CB-CE2 3.69Å; M392-F400 HydrophobicContact CB-CZ 3.66Å; M392-F400 HydrophobicContact CG-CD1 4.41Å; M392-F400 HydrophobicContact CG-CD2 3.95Å; M392-F400 HydrophobicContact CG-CE1 4.13Å; M392-F400 HydrophobicContact CG-CE2 3.65Å; M392-F400 HydrophobicContact CG-CG 4.33Å; M392-F400 HydrophobicContact CG-CZ 3.76Å; M392-F400 HydrophobicContact SD-CD1 3.94Å; M392-F400 HydrophobicContact SD-CE1 3.74Å; M392-F400 HydrophobicContact SD-CE2 4.35Å; M392-F400 HydrophobicContact SD-CG 4.34Å; M392-F400 HydrophobicContact SD-CZ 3.97Å; M392-L403 HydrophobicContact CE-CD2 3.65Å; M392-L403 HydrophobicContact SD-CD2 4.17Å
393	Q	69.6	Low	74.3	Confident	119 Å²	119	72.9 Å²	72.9	56%	0.556	36%	0.356	S	S	*	.	H	α-helix	trans	-64.4	-28.3	173.4	-76.6	178.6	-8.7	0	0	113.1	M389 L390 R391 G395	M389-Q393 WeakPolarHBondContact O-CG 3.48Å; M389-Q393 PolarHBondContact O-N 2.88Å; L390-Q393 PolarHBondContact O-N 3.23Å; R391-Q393 VanDerWaalsContact C-N 3.34Å; R391-Q393 PolarHBondContact O-N 2.81Å; Q393-G395 PolarHBondContact O-N 2.9Å
394	K	69.1	Low	73.9	Confident	169 Å²	169	65.6 Å²	65.6	74%	0.735	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-3.5	173.6	-69.8	178.7	178.9	-175.8	0	113.5	L390 R391 M392	L390-K394 WeakPolarHBondContact O-CG 3.31Å; L390-K394 PolarHBondContact O-N 3.32Å; R391-K394 WeakPolarHBondContact O-CB 3.44Å; R391-K394 PolarHBondContact O-N 3.21Å; R391-K394 VanDerWaalsContact O-N 3.12Å; M392-K394 PolarHBondContact O-N 3.39Å
395	G	67.2	Low	73.8	Confident	41 Å²	41	63 Å²	63	42%	0.423	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.8	20.7	177	0	0	0	0	0	115	R391 M392 Q393 L397	R391-G395 PolarHBondContact O-N 3.46Å; M392-G395 PolarHBondContact O-N 2.96Å; Q393-G395 PolarHBondContact O-N 2.9Å; G395-L397 PolarHBondContact O-N 3.43Å; G395-L397 VanDerWaalsContact O-N 3.14Å
396	D	74.6	Confident	73.7	Confident	48 Å²	48	66.1 Å²	66.1	26%	0.257	33%	0.333	S	S	.	.			trans	-74	100.6	177.3	-170.6	-5.4	0	0	0	111.1	R391 Q398 V399 F400	R391-D396 HydrophobicContact CB-CB 4.48Å; R391-D396 IonicContact CZ-OD2 3.73Å; R391-D396 IonicContact NE-OD2 2.72Å; R391-D396 PolarHBondContact NE-OD2 2.9Å; R391-D396 IonicContact NH2-OD2 3.62Å; R391-D396 PolarHBondContact NH2-OD2 2.85Å; R391-D396 WeakPolarHBondContact O-CB 3.45Å; R391-D396 PolarHBondContact O-N 3.07Å; D396-Q398 PolarHBondContact O-N 3.21Å; D396-Q398 WeakPolarHBondContact OD1-CB 3.41Å; D396-Q398 PolarHBondContact OD1-N 3.18Å; D396-V399 HydrophobicContact CB-CG2 4.26Å; D396-V399 PolarHBondContact O-N 2.97Å; D396-F400 WeakPolarHBondContact O-CD2 3.47Å
397	L	70.8	Confident	73.3	Confident	61 Å²	61	65.1 Å²	65.1	32%	0.319	32%	0.323	S	S	.	.	H	α-helix	trans	-64.5	-27.7	-176.8	-165	67.6	0	0	0	112.5	G395 V399 F400 E401 A439 V442	G395-L397 PolarHBondContact O-N 3.43Å; G395-L397 VanDerWaalsContact O-N 3.14Å; L397-V399 VanDerWaalsContact C-N 3.31Å; L397-V399 PolarHBondContact O-N 3.24Å; L397-F400 WeakPolarHBondContact O-CB 3.44Å; L397-F400 PolarHBondContact O-N 3.32Å; L397-F400 VanDerWaalsContact O-N 3.11Å; L397-E401 PolarHBondContact O-N 3.35Å; L397-E401 VanDerWaalsContact O-N 3.08Å; L397-A439 HydrophobicContact CD1-CB 4.47Å; L397-V442 HydrophobicContact CD1-CB 4.23Å; L397-V442 HydrophobicContact CD1-CG1 3.83Å
398	Q	75.7	Confident	72.6	Confident	119 Å²	119	59.1 Å²	59.1	56%	0.556	29%	0.292	S	S	*	.	H	α-helix	trans	-66.7	-35.2	-177.9	-166.2	166.8	19.5	0	0	111.9	D396 F400 E401 E402	D396-Q398 PolarHBondContact O-N 3.21Å; D396-Q398 WeakPolarHBondContact OD1-CB 3.41Å; D396-Q398 PolarHBondContact OD1-N 3.18Å; Q398-F400 VanDerWaalsContact C-N 3.3Å; Q398-F400 PolarHBondContact O-N 3.13Å; Q398-E401 PolarHBondContact O-N 3.43Å; Q398-E402 WeakPolarHBondContact O-CG 3.48Å; Q398-E402 PolarHBondContact O-N 2.78Å
399	V	74.2	Confident	72.1	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-68	-32.7	175.3	-179.5	0	0	0	0	111.1	K388 R391 M392 D396 L397 L403	K388-V399 HydrophobicContact CB-CG1 4Å; K388-V399 HydrophobicContact CG-CG1 4.34Å; R391-V399 HydrophobicContact CB-CG2 4.09Å; M392-V399 HydrophobicContact CG-CB 4.18Å; M392-V399 HydrophobicContact CG-CG1 3.73Å; M392-V399 HydrophobicContact SD-CG1 4.34Å; D396-V399 HydrophobicContact CB-CG2 4.26Å; D396-V399 PolarHBondContact O-N 2.97Å; L397-V399 VanDerWaalsContact C-N 3.31Å; L397-V399 PolarHBondContact O-N 3.24Å; V399-L403 HydrophobicContact CG1-CD1 3.89Å; V399-L403 WeakPolarHBondContact O-CB 3.32Å; V399-L403 VanDerWaalsContact O-CD1 3.25Å; V399-L403 WeakPolarHBondContact O-CD1 3.31Å; V399-L403 PolarHBondContact O-N 3.19Å
400	F	71.1	Confident	71.6	Confident	13 Å²	13	60.6 Å²	60.6	6%	0.057	30%	0.298	C	S	.	.	H	α-helix	trans	-67.1	-42.8	173	-76.2	-84.2	0	0	0	111.4	I364 M368 M392 D396 L397 Q398 L403 F404 F438 V442	I364-F400 HydrophobicContact CG1-CD1 4.37Å; I364-F400 HydrophobicContact CG2-CD1 4.42Å; I364-F400 HydrophobicContact CG2-CE1 4.37Å; M368-F400 HydrophobicContact CG-CE1 4.49Å; M392-F400 HydrophobicContact CB-CD2 4.47Å; M392-F400 HydrophobicContact CB-CE1 4.41Å; M392-F400 HydrophobicContact CB-CE2 3.69Å; M392-F400 HydrophobicContact CB-CZ 3.66Å; M392-F400 HydrophobicContact CG-CD1 4.41Å; M392-F400 HydrophobicContact CG-CD2 3.95Å; M392-F400 HydrophobicContact CG-CE1 4.13Å; M392-F400 HydrophobicContact CG-CE2 3.65Å; M392-F400 HydrophobicContact CG-CG 4.33Å; M392-F400 HydrophobicContact CG-CZ 3.76Å; M392-F400 HydrophobicContact SD-CD1 3.94Å; M392-F400 HydrophobicContact SD-CE1 3.74Å; M392-F400 HydrophobicContact SD-CE2 4.35Å; M392-F400 HydrophobicContact SD-CG 4.34Å; M392-F400 HydrophobicContact SD-CZ 3.97Å; D396-F400 WeakPolarHBondContact O-CD2 3.47Å; L397-F400 WeakPolarHBondContact O-CB 3.44Å; L397-F400 PolarHBondContact O-N 3.32Å; L397-F400 VanDerWaalsContact O-N 3.11Å; Q398-F400 VanDerWaalsContact C-N 3.3Å; Q398-F400 PolarHBondContact O-N 3.13Å; F400-L403 PolarHBondContact O-N 3.08Å; F400-F404 WeakPolarHBondContact O-CB 3.33Å; F400-F404 PolarHBondContact O-N 2.72Å; F400-F438 HydrophobicContact CB-CE1 4.43Å; F400-F438 HydrophobicContact CD1-CE1 4.37Å; F400-F438 HydrophobicContact CD1-CZ 4.44Å; F400-V442 HydrophobicContact CB-CG1 4.38Å; F400-V442 HydrophobicContact CD1-CG1 3.88Å; F400-V442 HydrophobicContact CD1-CG2 3.95Å; F400-V442 HydrophobicContact CD2-CG1 3.61Å; F400-V442 HydrophobicContact CE1-CG1 3.95Å; F400-V442 HydrophobicContact CE1-CG2 4.26Å; F400-V442 HydrophobicContact CE2-CG1 3.68Å; F400-V442 HydrophobicContact CG-CG1 3.7Å; F400-V442 HydrophobicContact CG-CG2 4.34Å; F400-V442 HydrophobicContact CZ-CG1 3.85Å
401	E	74.3	Confident	70.9	Confident	77 Å²	77	56.8 Å²	56.8	36%	0.36	28%	0.278	S	S	.	.	H	α-helix	trans	-64.4	-41.4	177	-67.3	-176.1	173.6	0	0	112.4	L397 Q398 F404 S405 L435	L397-E401 PolarHBondContact O-N 3.35Å; L397-E401 VanDerWaalsContact O-N 3.08Å; Q398-E401 PolarHBondContact O-N 3.43Å; E401-F404 PolarHBondContact O-N 3.5Å; E401-S405 VanDerWaalsContact O-CB 3.24Å; E401-S405 WeakPolarHBondContact O-CB 3.14Å; E401-S405 PolarHBondContact O-N 2.94Å; E401-S405 PolarHBondContact O-OG 3.28Å; E401-S405 VanDerWaalsContact O-OG 3.1Å; E401-L435 HydrophobicContact CB-CD1 4.34Å; E401-L435 HydrophobicContact CG-CD1 4.23Å; E401-L435 HydrophobicContact CG-CD2 4.23Å; E401-L435 HydrophobicContact CG-CG 4.49Å
402	E	78.6	Confident	70	Confident	93 Å²	93	51.4 Å²	51.4	44%	0.435	26%	0.258	S	S	.	.	H	α-helix	trans	-63.4	-45.8	175.6	-74.7	177.6	-171.8	0	0	112	Q398 S405 F406	Q398-E402 WeakPolarHBondContact O-CG 3.48Å; Q398-E402 PolarHBondContact O-N 2.78Å; E402-S405 PolarHBondContact O-OG 2.77Å; E402-F406 WeakPolarHBondContact O-CB 3.47Å; E402-F406 PolarHBondContact O-N 3.19Å
403	L	72.2	Confident	69	Low	4 Å²	4	52.2 Å²	52.2	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-70	-38.9	179	-93	71.3	0	0	0	111.3	A363 I364 Y385 K388 M392 V399 F400 F406 A407	A363-L403 HydrophobicContact CB-CD2 4.36Å; I364-L403 HydrophobicContact CD1-CB 3.77Å; I364-L403 HydrophobicContact CG1-CB 4.23Å; I364-L403 HydrophobicContact CG1-CD2 4.16Å; Y385-L403 HydrophobicContact CD1-CD2 4.38Å; K388-L403 HydrophobicContact CD-CD1 3.73Å; M392-L403 HydrophobicContact CE-CD2 3.65Å; M392-L403 HydrophobicContact SD-CD2 4.17Å; V399-L403 HydrophobicContact CG1-CD1 3.89Å; V399-L403 WeakPolarHBondContact O-CB 3.32Å; V399-L403 VanDerWaalsContact O-CD1 3.25Å; V399-L403 WeakPolarHBondContact O-CD1 3.31Å; V399-L403 PolarHBondContact O-N 3.19Å; F400-L403 PolarHBondContact O-N 3.08Å; L403-F406 PolarHBondContact O-N 3Å; L403-A407 WeakPolarHBondContact O-CB 3.29Å; L403-A407 PolarHBondContact O-N 3.32Å
404	F	73.1	Confident	68.1	Low	1 Å²	1	50 Å²	50	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-65.1	-44.3	176.7	-169.1	-97.5	0	0	0	110.7	M316 F400 E401 F406 A407 C408 F431 L435 F438	M316-F404 HydrophobicContact SD-CE2 4.04Å; M316-F404 HydrophobicContact SD-CZ 4.23Å; F400-F404 WeakPolarHBondContact O-CB 3.33Å; F400-F404 PolarHBondContact O-N 2.72Å; E401-F404 PolarHBondContact O-N 3.5Å; F404-F406 VanDerWaalsContact C-N 3.31Å; F404-F406 PolarHBondContact O-N 2.99Å; F404-A407 PolarHBondContact O-N 2.96Å; F404-C408 WeakPolarHBondContact CD1-SG 3.33Å; F404-C408 WeakPolarHBondContact CD2-SG 3.37Å; F404-C408 WeakPolarHBondContact CE1-SG 3.4Å; F404-C408 WeakPolarHBondContact CE2-SG 3.31Å; F404-C408 WeakPolarHBondContact CG-SG 3.17Å; F404-C408 WeakPolarHBondContact CZ-SG 3.47Å; F404-C408 WeakPolarHBondContact O-CB 3.38Å; F404-C408 PolarHBondContact O-N 3.13Å; F404-C408 PolarHBondContact O-SG 3.1Å; F404-F431 HydrophobicContact CD1-CE2 4.21Å; F404-F431 HydrophobicContact CD1-CZ 4.41Å; F404-F431 HydrophobicContact CE1-CE2 4.36Å; F404-L435 HydrophobicContact CD1-CB 4.3Å; F404-L435 HydrophobicContact CD1-CD1 4.23Å; F404-L435 HydrophobicContact CD1-CG 4.38Å; F404-L435 HydrophobicContact CE1-CB 4.12Å; F404-F438 HydrophobicContact CB-CD1 4.33Å; F404-F438 HydrophobicContact CB-CE1 4.24Å; F404-F438 HydrophobicContact CD2-CB 4.45Å; F404-F438 AromaticContact CD2-CD1 3.47Å; F404-F438 HydrophobicContact CD2-CD1 3.47Å; F404-F438 VanDerWaalsContact CD2-CD1 3.47Å; F404-F438 HydrophobicContact CD2-CD2 4.14Å; F404-F438 AromaticContact CD2-CE1 3.65Å; F404-F438 HydrophobicContact CD2-CE1 3.65Å; F404-F438 HydrophobicContact CD2-CE2 4.32Å; F404-F438 AromaticContact CD2-CG 3.74Å; F404-F438 HydrophobicContact CD2-CG 3.74Å; F404-F438 HydrophobicContact CD2-CZ 4.1Å; F404-F438 HydrophobicContact CE2-CB 3.93Å; F404-F438 AromaticContact CE2-CD1 3.8Å; F404-F438 HydrophobicContact CE2-CD1 3.8Å; F404-F438 AromaticContact CE2-CD2 3.84Å; F404-F438 HydrophobicContact CE2-CD2 3.84Å; F404-F438 HydrophobicContact CE2-CE1 4.3Å; F404-F438 HydrophobicContact CE2-CE2 4.36Å; F404-F438 AromaticContact CE2-CG 3.55Å; F404-F438 HydrophobicContact CE2-CG 3.55Å; F404-F438 AromaticContact CG-CD1 3.89Å; F404-F438 HydrophobicContact CG-CD1 3.89Å; F404-F438 HydrophobicContact CG-CE1 4.16Å; F404-F438 HydrophobicContact CG-CG 4.46Å; F404-F438 HydrophobicContact CZ-CB 4Å; F404-F438 HydrophobicContact CZ-CD1 4.46Å; F404-F438 HydrophobicContact CZ-CG 4.13Å
405	S	74.1	Confident	67.3	Low	69 Å²	69	46 Å²	46	48%	0.483	25%	0.249	S	C	.	.	H	α-helix	trans	-63.2	-35	176	69.1	0	0	0	0	113.3	E401 E402	E401-S405 VanDerWaalsContact O-CB 3.24Å; E401-S405 WeakPolarHBondContact O-CB 3.14Å; E401-S405 PolarHBondContact O-N 2.94Å; E401-S405 PolarHBondContact O-OG 3.28Å; E401-S405 VanDerWaalsContact O-OG 3.1Å; E402-S405 PolarHBondContact O-OG 2.77Å
406	F	74.5	Confident	66.5	Low	86 Å²	86	47 Å²	47	38%	0.377	25%	0.247	S	C	.	.	H	α-helix	trans	-73.7	-39.3	175.7	-179.9	-101.6	0	0	0	112.4	E356 Q357 E402 L403 F404	E356-F406 HydrophobicContact CB-CE1 4.26Å; E356-F406 HydrophobicContact CB-CZ 4.35Å; Q357-F406 HydrophobicContact CG-CD1 4.19Å; Q357-F406 HydrophobicContact CG-CE1 3.89Å; Q357-F406 HydrophobicContact CG-CZ 4.39Å; Q357-F406 WeakPolarHBondContact CG-O 3.34Å; Q357-F406 PolarHBondContact NE2-O 3.38Å; E402-F406 WeakPolarHBondContact O-CB 3.47Å; E402-F406 PolarHBondContact O-N 3.19Å; L403-F406 PolarHBondContact O-N 3Å; F404-F406 VanDerWaalsContact C-N 3.31Å; F404-F406 PolarHBondContact O-N 2.99Å
407	A	66.4	Low	65.5	Low	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-99.6	-14.1	-166.2	0	0	0	0	0	114.7	Y308 Q357 L361 L403 F404	Y308-A407 PolarHBondContact OH-O 3.45Å; Q357-A407 HydrophobicContact CB-CB 4.38Å; L361-A407 HydrophobicContact CD2-CB 3.55Å; L361-A407 HydrophobicContact CG-CB 3.7Å; L403-A407 WeakPolarHBondContact O-CB 3.29Å; L403-A407 PolarHBondContact O-N 3.32Å; F404-A407 PolarHBondContact O-N 2.96Å
408	C	65	Low	64.6	Low	10 Å²	10	46.9 Å²	46.9	7%	0.068	25%	0.247	C	C	.	.	S	Bend	trans	-72.8	143.2	175.8	-75.5	0	0	0	0	112.6	F312 F404 F411	F312-C408 HydrophobicContact CE2-CB 4.46Å; F404-C408 WeakPolarHBondContact CD1-SG 3.33Å; F404-C408 WeakPolarHBondContact CD2-SG 3.37Å; F404-C408 WeakPolarHBondContact CE1-SG 3.4Å; F404-C408 WeakPolarHBondContact CE2-SG 3.31Å; F404-C408 WeakPolarHBondContact CG-SG 3.17Å; F404-C408 WeakPolarHBondContact CZ-SG 3.47Å; F404-C408 WeakPolarHBondContact O-CB 3.38Å; F404-C408 PolarHBondContact O-N 3.13Å; F404-C408 PolarHBondContact O-SG 3.1Å; C408-F411 HydrophobicContact CB-CE2 3.66Å; C408-F411 HydrophobicContact CB-CZ 3.81Å
409	P	65.3	Low	63.5	Low	8 Å²	8	42.7 Å²	42.7	5%	0.052	23%	0.227	C	C	.	.			trans	-56.5	148.2	161	-19.2	31	0	0	0	110.3	L274 Y308 Y309 F312 F411	L274-P409 HydrophobicContact CD2-CB 3.87Å; Y308-P409 HydrophobicContact CE1-CG 3.88Å; Y308-P409 WeakPolarHBondContact OH-CD 3.48Å; Y309-P409 HydrophobicContact CD1-CG 4.11Å; Y309-P409 HydrophobicContact CE1-CB 3.86Å; Y309-P409 HydrophobicContact CE1-CG 3.72Å; F312-P409 HydrophobicContact CD1-CG 3.98Å; F312-P409 HydrophobicContact CE1-CG 4.23Å; F312-P409 HydrophobicContact CG-CG 4.21Å; P409-F411 PolarHBondContact O-N 2.96Å
410	K	64.9	Low	62.4	Low	134 Å²	134	48.2 Å²	48.2	58%	0.583	26%	0.256	S	S	*	.			trans	-71.4	95.9	175.4	-58	175.5	-179.9	174.7	0	109.1	Q186 Q190 L274	Q186-K410 PolarHBondContact NE2-O 3.48Å; Q190-K410 VanDerWaalsContact NE2-CB 3.3Å; Q190-K410 VanDerWaalsContact NE2-CD 3.29Å; L274-K410 VanDerWaalsContact CD2-O 3.28Å; L274-K410 WeakPolarHBondContact CD2-O 3.36Å
411	F	60.4	Low	61.4	Low	14 Å²	14	53.8 Å²	53.8	6%	0.061	29%	0.287	C	S	.	.			trans	-54.9	146.3	-179.1	-58.6	-62.7	0	0	0	112.7	Y278 F312 C408 P409 P430 F431 Q434	Y278-F411 WeakPolarHBondContact OH-CE1 3.26Å; F312-F411 AromaticContact CE1-CE1 3.74Å; F312-F411 HydrophobicContact CE1-CE1 3.74Å; F312-F411 AromaticContact CE1-CZ 3.76Å; F312-F411 HydrophobicContact CE1-CZ 3.76Å; F312-F411 HydrophobicContact CZ-CE1 4.01Å; F312-F411 AromaticContact CZ-CZ 3.51Å; F312-F411 HydrophobicContact CZ-CZ 3.51Å; C408-F411 HydrophobicContact CB-CE2 3.66Å; C408-F411 HydrophobicContact CB-CZ 3.81Å; P409-F411 PolarHBondContact O-N 2.96Å; F411-P430 HydrophobicContact CB-CB 4.36Å; F411-F431 HydrophobicContact CD2-CB 4.42Å; F411-F431 AromaticContact CD2-CD2 3.98Å; F411-F431 HydrophobicContact CD2-CD2 3.98Å; F411-F431 HydrophobicContact CE2-CD2 4.15Å; F411-Q434 VanDerWaalsContact CD2-OE1 3.3Å
412	L	57.5	Low	60.3	Low	6 Å²	6	54.1 Å²	54.1	3%	0.031	29%	0.294	C	S	.	.			trans	-110.2	134.2	179.3	-67.2	180	0	0	0	109.3	F185 Q186 Q190 L274 P414	F185-L412 HydrophobicContact CD1-CD1 3.96Å; F185-L412 HydrophobicContact CE1-CD1 3.67Å; Q186-L412 HydrophobicContact CB-CD1 4.15Å; Q186-L412 HydrophobicContact CG-CD1 4.17Å; Q186-L412 HydrophobicContact CG-CD2 3.93Å; Q186-L412 HydrophobicContact CG-CG 4.32Å; Q190-L412 HydrophobicContact CG-CD2 4.2Å; L274-L412 HydrophobicContact CB-CD1 4.13Å; L274-L412 HydrophobicContact CB-CG 4.23Å; L274-L412 HydrophobicContact CD1-CD1 4.1Å; L274-L412 PolarHBondContact O-N 2.92Å; L412-P414 WeakPolarHBondContact O-CD 3.47Å
413	S	49.9	Very low	58.9	Low	24 Å²	24	56.5 Å²	56.5	17%	0.168	30%	0.304	C	S	.	.			trans	-77.6	124.9	164.4	-174.2	0	0	0	0	108.2	V415	S413-V415 PolarHBondContact O-N 3.1Å; S413-V415 PolarHBondContact OG-N 3.3Å
414	P	51.6	Low	58	Low	72 Å²	72	60.9 Å²	60.9	47%	0.468	33%	0.333	S	S	.	.	S	Bend	trans	-67.6	-15.7	174.2	-13.1	25.5	0	0	0	113.1	V215 L275 L412	V215-P414 HydrophobicContact CG2-CB 4.47Å; L275-P414 HydrophobicContact CD2-CB 3.94Å; L275-P414 HydrophobicContact CD2-CG 3.71Å; L412-P414 WeakPolarHBondContact O-CD 3.47Å
415	V	50.9	Low	57	Low	84 Å²	84	64.6 Å²	64.6	51%	0.509	35%	0.353	S	S	.	.	S	Bend	trans	-100.6	138.4	-169.1	-172.4	0	0	0	0	111.1	S413 P417	S413-V415 PolarHBondContact O-N 3.1Å; S413-V415 PolarHBondContact OG-N 3.3Å; V415-P417 WeakPolarHBondContact O-CD 3.2Å
416	V	51.7	Low	56.1	Low	63 Å²	63	64 Å²	64	38%	0.382	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-59.2	122.5	169.8	-171.5	0	0	0	0	108.2	R192 N418 Y419	R192-V416 VanDerWaalsContact NH2-CB 3.26Å; V416-N418 PolarHBondContact O-N 3.07Å; V416-Y419 HydrophobicContact CG1-CE2 3.78Å
417	P	53.7	Low	55.2	Low	7 Å²	7	62.7 Å²	62.7	5%	0.045	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-55.1	129.3	172	-20.5	30.3	0	0	0	109.1	V415 Y419 Y426	V415-P417 WeakPolarHBondContact O-CD 3.2Å; P417-Y419 WeakPolarHBondContact O-CD2 3.25Å; P417-Y419 PolarHBondContact O-N 2.95Å; P417-Y419 VanDerWaalsContact O-N 3.1Å; P417-Y426 HydrophobicContact CB-CD1 3.67Å; P417-Y426 HydrophobicContact CB-CE1 3.82Å; P417-Y426 HydrophobicContact CB-CG 4.39Å; P417-Y426 HydrophobicContact CG-CD1 3.72Å; P417-Y426 HydrophobicContact CG-CE1 3.84Å
418	N	51.2	Low	54.9	Low	99 Å²	99	68 Å²	68	53%	0.529	36%	0.359	S	S	.	.			trans	-67.1	112	173	-172.9	-8.3	0	0	0	108.2	V416 D420 N421	V416-N418 PolarHBondContact O-N 3.07Å; N418-D420 PolarHBondContact O-N 3.44Å; N418-D420 PolarHBondContact OD1-N 3.02Å; N418-N421 PolarHBondContact O-N 3.3Å
419	Y	52.9	Low	54.8	Low	32 Å²	32	71.3 Å²	71.3	13%	0.125	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-13.3	-175.5	-63.9	-75.5	0	0	0	113.5	T195 I203 V416 P417 V422	T195-Y419 HydrophobicContact CG2-CD1 4.43Å; T195-Y419 HydrophobicContact CG2-CE1 4.37Å; I203-Y419 HydrophobicContact CG2-CD1 3.6Å; I203-Y419 HydrophobicContact CG2-CE1 4.19Å; I203-Y419 HydrophobicContact CG2-CG 4.02Å; V416-Y419 HydrophobicContact CG1-CE2 3.78Å; P417-Y419 WeakPolarHBondContact O-CD2 3.25Å; P417-Y419 PolarHBondContact O-N 2.95Å; P417-Y419 VanDerWaalsContact O-N 3.1Å; Y419-V422 WeakPolarHBondContact O-CG2 3.43Å
420	D	50.8	Low	54.7	Low	116 Å²	116	71.9 Å²	71.9	62%	0.62	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-20.5	-178.5	-60.9	-27	0	0	0	113	R207 N418	R207-D420 IonicContact NH2-OD1 2.73Å; R207-D420 PolarHBondContact NH2-OD1 2.68Å; N418-D420 PolarHBondContact O-N 3.44Å; N418-D420 PolarHBondContact OD1-N 3.02Å
421	N	49.5	Very low	54.8	Low	131 Å²	131	68.2 Å²	68.2	70%	0.701	36%	0.361	S	S	*	.	S	Bend	trans	-123.4	79.5	174.5	-83.8	-24.5	0	0	0	109.6	N418 H423	N418-N421 PolarHBondContact O-N 3.3Å; N421-H423 PolarHBondContact O-N 3.21Å
422	V	51.2	Low	55.1	Low	84 Å²	84	72.3 Å²	72.3	51%	0.509	38%	0.38	S	S	.	.			trans	-69.8	78.3	-179.2	-167.5	0	0	0	0	110.2	Y419 P424	Y419-V422 WeakPolarHBondContact O-CG2 3.43Å; V422-P424 VanDerWaalsContact O-CD 3.31Å; V422-P424 WeakPolarHBondContact O-CD 3.49Å
423	H	50.7	Low	55.8	Low	142 Å²	142	77.4 Å²	77.4	66%	0.657	40%	0.404	S	S	*	.			trans	-72.5	121.2	166.2	-116.7	-61.8	0	0	0	108.3	N421 N425 Y426	N421-H423 PolarHBondContact O-N 3.21Å; H423-N425 PolarHBondContact O-N 2.95Å; H423-Y426 PolarHBondContact O-N 2.75Å
424	P	52	Low	56.8	Low	96 Å²	96	77.5 Å²	77.5	62%	0.623	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-9.6	-175.3	-24.5	33.6	0	0	0	115.2	V422	V422-P424 VanDerWaalsContact O-CD 3.31Å; V422-P424 WeakPolarHBondContact O-CD 3.49Å
425	N	51.9	Low	57.8	Low	80 Å²	80	75.5 Å²	75.5	43%	0.428	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	11.1	-173.3	-79.1	-28.5	0	0	0	114.6	H423 H427 K428 E429	H423-N425 PolarHBondContact O-N 2.95Å; N425-H427 PolarHBondContact O-N 2.92Å; N425-H427 VanDerWaalsContact O-N 3.16Å; N425-K428 WeakPolarHBondContact O-CA 3.22Å; N425-K428 WeakPolarHBondContact O-CB 3.3Å; N425-K428 PolarHBondContact O-N 3.36Å; N425-E429 PolarHBondContact O-N 2.91Å
426	Y	55.8	Low	59.1	Low	56 Å²	56	77.6 Å²	77.6	22%	0.22	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-57.5	-33.2	-179.2	-161.3	-100.5	0	0	0	113.3	P417 H423 K428 E429 P430	P417-Y426 HydrophobicContact CB-CD1 3.67Å; P417-Y426 HydrophobicContact CB-CE1 3.82Å; P417-Y426 HydrophobicContact CB-CG 4.39Å; P417-Y426 HydrophobicContact CG-CD1 3.72Å; P417-Y426 HydrophobicContact CG-CE1 3.84Å; H423-Y426 PolarHBondContact O-N 2.75Å; Y426-K428 PolarHBondContact O-N 3.06Å; Y426-E429 WeakPolarHBondContact CD2-OE2 3.38Å; Y426-E429 WeakPolarHBondContact CE2-OE2 3.4Å; Y426-E429 PolarHBondContact O-N 3.03Å; Y426-P430 WeakPolarHBondContact O-CD 3.2Å
427	H	56.1	Low	60.3	Low	58 Å²	58	78.5 Å²	78.5	27%	0.269	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-64.3	-26.3	172.8	-176.5	-63.2	0	0	0	113.4	Q190 C193 N425	Q190-H427 PolarHBondContact O-CD2 3.3Å; C193-H427 HydrophobicContact CB-CB 3.82Å; N425-H427 PolarHBondContact O-N 2.92Å; N425-H427 VanDerWaalsContact O-N 3.16Å
428	K	60.4	Low	61.2	Low	113 Å²	113	78.5 Å²	78.5	49%	0.491	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-91.5	-14.8	-179.1	-65.7	-176.9	-179.8	174.3	0	112.5	N425 Y426 F431 Q432	N425-K428 WeakPolarHBondContact O-CA 3.22Å; N425-K428 WeakPolarHBondContact O-CB 3.3Å; N425-K428 PolarHBondContact O-N 3.36Å; Y426-K428 PolarHBondContact O-N 3.06Å; K428-F431 PolarHBondContact O-N 3.27Å; K428-Q432 HydrophobicContact CB-CG 4.47Å; K428-Q432 WeakPolarHBondContact O-CB 2.9Å; K428-Q432 VanDerWaalsContact O-CG 3.29Å; K428-Q432 WeakPolarHBondContact O-CG 2.93Å; K428-Q432 PolarHBondContact O-N 3.42Å
429	E	62.8	Low	62.3	Low	79 Å²	79	74.6 Å²	74.6	37%	0.369	38%	0.375	S	S	.	.	H	α-helix	trans	-61.7	-46	-174.3	-164.6	-176.3	171.1	0	0	113.3	N425 Y426 F431 Q432 Q433	N425-E429 PolarHBondContact O-N 2.91Å; Y426-E429 WeakPolarHBondContact CD2-OE2 3.38Å; Y426-E429 WeakPolarHBondContact CE2-OE2 3.4Å; Y426-E429 PolarHBondContact O-N 3.03Å; E429-F431 VanDerWaalsContact C-N 3.32Å; E429-F431 PolarHBondContact O-N 3.08Å; E429-Q432 PolarHBondContact O-N 2.98Å; E429-Q433 WeakPolarHBondContact O-CB 3.2Å; E429-Q433 VanDerWaalsContact O-CG 3.31Å; E429-Q433 WeakPolarHBondContact O-CG 3.37Å; E429-Q433 PolarHBondContact O-N 2.93Å
430	P	63.8	Low	63.4	Low	19 Å²	19	77.7 Å²	77.7	12%	0.123	39%	0.391	C	S	.	.	H	α-helix	trans	-63.9	-38.9	176.5	-20.2	32.3	0	0	0	112.3	F411 Y426 Q434	F411-P430 HydrophobicContact CB-CB 4.36Å; Y426-P430 WeakPolarHBondContact O-CD 3.2Å; P430-Q434 WeakPolarHBondContact O-CG 3.47Å; P430-Q434 PolarHBondContact O-N 3.37Å; P430-Q434 VanDerWaalsContact O-N 3.12Å
431	F	65.9	Low	64.4	Low	58 Å²	58	72.8 Å²	72.8	25%	0.254	36%	0.364	S	S	.	.	H	α-helix	trans	-65.8	-42.2	176	175.8	-97	0	0	0	111.6	F404 F411 K428 E429 Q434 L435	F404-F431 HydrophobicContact CD1-CE2 4.21Å; F404-F431 HydrophobicContact CD1-CZ 4.41Å; F404-F431 HydrophobicContact CE1-CE2 4.36Å; F411-F431 HydrophobicContact CD2-CB 4.42Å; F411-F431 AromaticContact CD2-CD2 3.98Å; F411-F431 HydrophobicContact CD2-CD2 3.98Å; F411-F431 HydrophobicContact CE2-CD2 4.15Å; K428-F431 PolarHBondContact O-N 3.27Å; E429-F431 VanDerWaalsContact C-N 3.32Å; E429-F431 PolarHBondContact O-N 3.08Å; F431-Q434 PolarHBondContact O-N 2.94Å; F431-L435 HydrophobicContact CE1-CD1 3.68Å; F431-L435 HydrophobicContact CZ-CD1 3.73Å; F431-L435 WeakPolarHBondContact O-CB 3.41Å; F431-L435 PolarHBondContact O-N 3.43Å
432	Q	67.4	Low	65.6	Low	99 Å²	99	66.8 Å²	66.8	46%	0.463	33%	0.332	S	S	.	.	H	α-helix	trans	-67.8	-38.6	178.1	-77.4	176.4	-9.5	0	0	112.3	K428 E429 L435 K436	K428-Q432 HydrophobicContact CB-CG 4.47Å; K428-Q432 WeakPolarHBondContact O-CB 2.9Å; K428-Q432 VanDerWaalsContact O-CG 3.29Å; K428-Q432 WeakPolarHBondContact O-CG 2.93Å; K428-Q432 PolarHBondContact O-N 3.42Å; E429-Q432 PolarHBondContact O-N 2.98Å; Q432-L435 PolarHBondContact O-N 3.47Å; Q432-K436 VanDerWaalsContact O-CB 3.24Å; Q432-K436 WeakPolarHBondContact O-CB 3.29Å; Q432-K436 PolarHBondContact O-N 3.44Å
433	Q	71.2	Confident	66.6	Low	113 Å²	113	68.8 Å²	68.8	53%	0.528	34%	0.336	S	S	.	.	H	α-helix	trans	-62.4	-47.1	175.5	-74.4	176.3	-0.3	0	0	111	E429 K436 V437	E429-Q433 WeakPolarHBondContact O-CB 3.2Å; E429-Q433 VanDerWaalsContact O-CG 3.31Å; E429-Q433 WeakPolarHBondContact O-CG 3.37Å; E429-Q433 PolarHBondContact O-N 2.93Å; Q433-K436 PolarHBondContact O-N 3.39Å; Q433-V437 WeakPolarHBondContact O-CG2 3.47Å; Q433-V437 PolarHBondContact O-N 3.32Å
434	Q	71.4	Confident	67.6	Low	26 Å²	26	66.3 Å²	66.3	12%	0.121	33%	0.325	C	S	.	.	H	α-helix	trans	-70.1	-38.3	178.4	-66.8	-171.1	9.7	0	0	112.8	Y278 F411 P430 F431 K436 V437 F438	Y278-Q434 PolarHBondContact OH-NE2 3.11Å; Y278-Q434 PolarHBondContact OH-OE1 3.49Å; F411-Q434 VanDerWaalsContact CD2-OE1 3.3Å; P430-Q434 WeakPolarHBondContact O-CG 3.47Å; P430-Q434 PolarHBondContact O-N 3.37Å; P430-Q434 VanDerWaalsContact O-N 3.12Å; F431-Q434 PolarHBondContact O-N 2.94Å; Q434-K436 VanDerWaalsContact C-N 3.29Å; Q434-K436 PolarHBondContact O-N 3.34Å; Q434-V437 PolarHBondContact O-N 3.35Å; Q434-F438 WeakPolarHBondContact O-CB 3.44Å; Q434-F438 PolarHBondContact O-N 2.82Å
435	L	72.9	Confident	68.4	Low	30 Å²	30	62.5 Å²	62.5	16%	0.157	30%	0.299	C	S	.	.	H	α-helix	trans	-62.3	-38.1	173.3	-176.9	145.8	0	0	0	111.1	E401 F404 F431 Q432 F438 A439	E401-L435 HydrophobicContact CB-CD1 4.34Å; E401-L435 HydrophobicContact CG-CD1 4.23Å; E401-L435 HydrophobicContact CG-CD2 4.23Å; E401-L435 HydrophobicContact CG-CG 4.49Å; F404-L435 HydrophobicContact CD1-CB 4.3Å; F404-L435 HydrophobicContact CD1-CD1 4.23Å; F404-L435 HydrophobicContact CD1-CG 4.38Å; F404-L435 HydrophobicContact CE1-CB 4.12Å; F431-L435 HydrophobicContact CE1-CD1 3.68Å; F431-L435 HydrophobicContact CZ-CD1 3.73Å; F431-L435 WeakPolarHBondContact O-CB 3.41Å; F431-L435 PolarHBondContact O-N 3.43Å; Q432-L435 PolarHBondContact O-N 3.47Å; L435-F438 PolarHBondContact O-N 3.07Å; L435-A439 WeakPolarHBondContact O-CB 3.43Å; L435-A439 PolarHBondContact O-N 3.45Å
436	K	76.9	Confident	69.2	Low	129 Å²	129	60.3 Å²	60.3	56%	0.561	29%	0.292	S	S	*	.	H	α-helix	trans	-64.7	-47.3	176.1	-173.1	-179.5	177.8	-174.2	0	111.6	Q432 Q433 Q434 F438 A439 E440	Q432-K436 VanDerWaalsContact O-CB 3.24Å; Q432-K436 WeakPolarHBondContact O-CB 3.29Å; Q432-K436 PolarHBondContact O-N 3.44Å; Q433-K436 PolarHBondContact O-N 3.39Å; Q434-K436 VanDerWaalsContact C-N 3.29Å; Q434-K436 PolarHBondContact O-N 3.34Å; K436-F438 VanDerWaalsContact C-N 3.28Å; K436-F438 PolarHBondContact O-N 3.23Å; K436-A439 PolarHBondContact O-N 3.15Å; K436-E440 VanDerWaalsContact CE-OE1 3.23Å; K436-E440 WeakPolarHBondContact CE-OE1 3.29Å; K436-E440 WeakPolarHBondContact O-CB 3.21Å; K436-E440 WeakPolarHBondContact O-CG 3.34Å; K436-E440 PolarHBondContact O-N 3.08Å
437	V	78	Confident	69.8	Low	81 Å²	81	61.8 Å²	61.8	49%	0.491	30%	0.301	S	S	.	.	H	α-helix	trans	-59.1	-42.8	175.7	173.2	0	0	0	0	110.7	Q433 Q434 E441	Q433-V437 WeakPolarHBondContact O-CG2 3.47Å; Q433-V437 PolarHBondContact O-N 3.32Å; Q434-V437 PolarHBondContact O-N 3.35Å; V437-E441 PolarHBondContact O-N 2.9Å
438	F	73.1	Confident	70.5	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.035	29%	0.288	C	S	.	.	H	α-helix	trans	-67.6	-42.6	177.6	-177.7	-104	0	0	0	112.5	L315 I364 M368 F400 F404 Q434 L435 K436 E441 V442	L315-F438 HydrophobicContact CD2-CD2 4.33Å; L315-F438 HydrophobicContact CD2-CE2 3.82Å; I364-F438 HydrophobicContact CG2-CE2 4.25Å; I364-F438 HydrophobicContact CG2-CZ 3.63Å; M368-F438 HydrophobicContact SD-CE2 4.2Å; M368-F438 HydrophobicContact SD-CZ 4.31Å; F400-F438 HydrophobicContact CB-CE1 4.43Å; F400-F438 HydrophobicContact CD1-CE1 4.37Å; F400-F438 HydrophobicContact CD1-CZ 4.44Å; F404-F438 HydrophobicContact CB-CD1 4.33Å; F404-F438 HydrophobicContact CB-CE1 4.24Å; F404-F438 HydrophobicContact CD2-CB 4.45Å; F404-F438 AromaticContact CD2-CD1 3.47Å; F404-F438 HydrophobicContact CD2-CD1 3.47Å; F404-F438 VanDerWaalsContact CD2-CD1 3.47Å; F404-F438 HydrophobicContact CD2-CD2 4.14Å; F404-F438 AromaticContact CD2-CE1 3.65Å; F404-F438 HydrophobicContact CD2-CE1 3.65Å; F404-F438 HydrophobicContact CD2-CE2 4.32Å; F404-F438 AromaticContact CD2-CG 3.74Å; F404-F438 HydrophobicContact CD2-CG 3.74Å; F404-F438 HydrophobicContact CD2-CZ 4.1Å; F404-F438 HydrophobicContact CE2-CB 3.93Å; F404-F438 AromaticContact CE2-CD1 3.8Å; F404-F438 HydrophobicContact CE2-CD1 3.8Å; F404-F438 AromaticContact CE2-CD2 3.84Å; F404-F438 HydrophobicContact CE2-CD2 3.84Å; F404-F438 HydrophobicContact CE2-CE1 4.3Å; F404-F438 HydrophobicContact CE2-CE2 4.36Å; F404-F438 AromaticContact CE2-CG 3.55Å; F404-F438 HydrophobicContact CE2-CG 3.55Å; F404-F438 AromaticContact CG-CD1 3.89Å; F404-F438 HydrophobicContact CG-CD1 3.89Å; F404-F438 HydrophobicContact CG-CE1 4.16Å; F404-F438 HydrophobicContact CG-CG 4.46Å; F404-F438 HydrophobicContact CZ-CB 4Å; F404-F438 HydrophobicContact CZ-CD1 4.46Å; F404-F438 HydrophobicContact CZ-CG 4.13Å; Q434-F438 WeakPolarHBondContact O-CB 3.44Å; Q434-F438 PolarHBondContact O-N 2.82Å; L435-F438 PolarHBondContact O-N 3.07Å; K436-F438 VanDerWaalsContact C-N 3.28Å; K436-F438 PolarHBondContact O-N 3.23Å; F438-E441 WeakPolarHBondContact O-CB 3.43Å; F438-E441 PolarHBondContact O-N 3.04Å; F438-V442 HydrophobicContact CD1-CG2 3.98Å; F438-V442 HydrophobicContact CD2-CG2 4.45Å; F438-V442 HydrophobicContact CE1-CG2 3.48Å; F438-V442 VanDerWaalsContact CE1-CG2 3.48Å; F438-V442 HydrophobicContact CE2-CG2 3.98Å; F438-V442 HydrophobicContact CG-CG2 4.43Å; F438-V442 HydrophobicContact CZ-CG2 3.45Å; F438-V442 VanDerWaalsContact CZ-CG2 3.45Å; F438-V442 WeakPolarHBondContact O-CG2 3.26Å; F438-V442 PolarHBondContact O-N 3.32Å
439	A	73.9	Confident	70.9	Confident	16 Å²	16	55.9 Å²	55.9	13%	0.132	28%	0.28	C	S	.	.	H	α-helix	trans	-65.2	-42.5	179.5	0	0	0	0	0	112.1	L397 L435 K436 E441 V442 Q443	L397-A439 HydrophobicContact CD1-CB 4.47Å; L435-A439 WeakPolarHBondContact O-CB 3.43Å; L435-A439 PolarHBondContact O-N 3.45Å; K436-A439 PolarHBondContact O-N 3.15Å; A439-E441 PolarHBondContact O-N 3.38Å; A439-V442 PolarHBondContact O-N 2.92Å; A439-Q443 WeakPolarHBondContact O-CB 2.93Å; A439-Q443 PolarHBondContact O-N 3.11Å
440	E	75.8	Confident	71.3	Confident	98 Å²	98	55 Å²	55	46%	0.458	28%	0.28	S	S	.	.	H	α-helix	trans	-59.2	-39.2	173.2	-74.3	176.4	-170.9	0	0	111.2	K436 Q444	K436-E440 VanDerWaalsContact CE-OE1 3.23Å; K436-E440 WeakPolarHBondContact CE-OE1 3.29Å; K436-E440 WeakPolarHBondContact O-CB 3.21Å; K436-E440 WeakPolarHBondContact O-CG 3.34Å; K436-E440 PolarHBondContact O-N 3.08Å; E440-Q444 WeakPolarHBondContact O-CG 3.3Å; E440-Q444 PolarHBondContact O-N 3.34Å
441	E	72.8	Confident	71.6	Confident	13 Å²	13	54 Å²	54	6%	0.061	27%	0.274	C	S	.	.	H	α-helix	trans	-70.6	-44	177.4	179.5	153.8	-161	0	0	113.2	R318 Y320 M368 V437 F438 A439 Q443 Q444 Q445	R318-E441 WeakPolarHBondContact CD-OE1 3.5Å; R318-E441 WeakPolarHBondContact CG-OE1 3.25Å; R318-E441 IonicContact CZ-OE1 3.32Å; R318-E441 IonicContact CZ-OE2 3.41Å; R318-E441 VanDerWaalsContact CZ-OE2 3.32Å; R318-E441 IonicContact NE-OE1 2.81Å; R318-E441 PolarHBondContact NE-OE1 2.96Å; R318-E441 IonicContact NE-OE2 3.25Å; R318-E441 PolarHBondContact NE-OE2 3.34Å; R318-E441 IonicContact NH2-OE1 3.01Å; R318-E441 IonicContact NH2-OE2 2.73Å; R318-E441 PolarHBondContact NH2-OE2 3.39Å; Y320-E441 VanDerWaalsContact OH-CD 3.24Å; Y320-E441 PolarHBondContact OH-OE1 3.44Å; M368-E441 HydrophobicContact CE-CG 4.16Å; V437-E441 PolarHBondContact O-N 2.9Å; F438-E441 WeakPolarHBondContact O-CB 3.43Å; F438-E441 PolarHBondContact O-N 3.04Å; A439-E441 PolarHBondContact O-N 3.38Å; E441-Q443 VanDerWaalsContact C-N 3.32Å; E441-Q443 PolarHBondContact O-N 2.99Å; E441-Q444 PolarHBondContact O-N 3.49Å; E441-Q445 WeakPolarHBondContact O-CB 3.25Å; E441-Q445 PolarHBondContact O-N 2.93Å
442	V	73.7	Confident	71.9	Confident	5 Å²	5	52.5 Å²	52.5	3%	0.03	27%	0.266	C	S	.	.	H	α-helix	trans	-60.2	-43	175.5	169.7	0	0	0	0	110.8	M368 L397 F400 F438 A439 Q444 Q445 A446	M368-V442 HydrophobicContact CE-CG2 3.99Å; M368-V442 HydrophobicContact SD-CG2 4.24Å; L397-V442 HydrophobicContact CD1-CB 4.23Å; L397-V442 HydrophobicContact CD1-CG1 3.83Å; F400-V442 HydrophobicContact CB-CG1 4.38Å; F400-V442 HydrophobicContact CD1-CG1 3.88Å; F400-V442 HydrophobicContact CD1-CG2 3.95Å; F400-V442 HydrophobicContact CD2-CG1 3.61Å; F400-V442 HydrophobicContact CE1-CG1 3.95Å; F400-V442 HydrophobicContact CE1-CG2 4.26Å; F400-V442 HydrophobicContact CE2-CG1 3.68Å; F400-V442 HydrophobicContact CG-CG1 3.7Å; F400-V442 HydrophobicContact CG-CG2 4.34Å; F400-V442 HydrophobicContact CZ-CG1 3.85Å; F438-V442 HydrophobicContact CD1-CG2 3.98Å; F438-V442 HydrophobicContact CD2-CG2 4.45Å; F438-V442 HydrophobicContact CE1-CG2 3.48Å; F438-V442 VanDerWaalsContact CE1-CG2 3.48Å; F438-V442 HydrophobicContact CE2-CG2 3.98Å; F438-V442 HydrophobicContact CG-CG2 4.43Å; F438-V442 HydrophobicContact CZ-CG2 3.45Å; F438-V442 VanDerWaalsContact CZ-CG2 3.45Å; F438-V442 WeakPolarHBondContact O-CG2 3.26Å; F438-V442 PolarHBondContact O-N 3.32Å; A439-V442 PolarHBondContact O-N 2.92Å; V442-Q444 VanDerWaalsContact C-N 3.35Å; V442-Q444 PolarHBondContact O-N 3.09Å; V442-Q445 PolarHBondContact O-N 2.96Å; V442-Q445 VanDerWaalsContact O-N 3.12Å; V442-A446 WeakPolarHBondContact O-CB 3Å; V442-A446 PolarHBondContact O-N 2.92Å
443	Q	72.9	Confident	72.1	Confident	126 Å²	126	51.3 Å²	51.3	59%	0.589	27%	0.269	S	S	*	.	H	α-helix	trans	-61.8	-43.5	178.5	-172.4	175.6	11.4	0	0	111.6	A439 E441 Q445	A439-Q443 WeakPolarHBondContact O-CB 2.93Å; A439-Q443 PolarHBondContact O-N 3.11Å; E441-Q443 VanDerWaalsContact C-N 3.32Å; E441-Q443 PolarHBondContact O-N 2.99Å; Q443-Q445 VanDerWaalsContact C-N 3.32Å; Q443-Q445 PolarHBondContact O-N 3.3Å
444	Q	70.6	Confident	72.1	Confident	89 Å²	89	49 Å²	49	42%	0.416	26%	0.257	S	S	.	.	H	α-helix	trans	-66.6	-33.9	174.7	-68.9	176.8	5.6	0	0	112.2	E440 E441 V442 L448	E440-Q444 WeakPolarHBondContact O-CG 3.3Å; E440-Q444 PolarHBondContact O-N 3.34Å; E441-Q444 PolarHBondContact O-N 3.49Å; V442-Q444 VanDerWaalsContact C-N 3.35Å; V442-Q444 PolarHBondContact O-N 3.09Å; Q444-L448 WeakPolarHBondContact O-CG 3.26Å
445	Q	69.3	Low	72.1	Confident	16 Å²	16	47.9 Å²	47.9	8%	0.075	25%	0.252	C	S	.	.	H	α-helix	trans	-75.6	-32.4	179.9	-164.9	72.9	5.5	0	0	112.5	M368 E441 V442 Q443 Q447 L448 S449	M368-Q445 HydrophobicContact CB-CG 4.15Å; M368-Q445 HydrophobicContact CE-CB 3.97Å; M368-Q445 HydrophobicContact CE-CG 4.04Å; M368-Q445 HydrophobicContact CG-CG 4.38Å; M368-Q445 PolarHBondContact O-NE2 2.92Å; E441-Q445 WeakPolarHBondContact O-CB 3.25Å; E441-Q445 PolarHBondContact O-N 2.93Å; V442-Q445 PolarHBondContact O-N 2.96Å; V442-Q445 VanDerWaalsContact O-N 3.12Å; Q443-Q445 VanDerWaalsContact C-N 3.32Å; Q443-Q445 PolarHBondContact O-N 3.3Å; Q445-Q447 VanDerWaalsContact C-N 3.29Å; Q445-Q447 PolarHBondContact O-N 3.27Å; Q445-L448 WeakPolarHBondContact O-CA 3.49Å; Q445-L448 WeakPolarHBondContact O-CB 3.46Å; Q445-L448 PolarHBondContact O-N 2.9Å; Q445-S449 PolarHBondContact O-N 2.67Å
446	A	69.2	Low	71.9	Confident	34 Å²	34	52.9 Å²	52.9	28%	0.281	27%	0.273	S	S	.	.	H	α-helix	trans	-57.8	-43.9	177.7	0	0	0	0	0	111.3	V442 L448 S449 T450	V442-A446 WeakPolarHBondContact O-CB 3Å; V442-A446 PolarHBondContact O-N 2.92Å; A446-L448 VanDerWaalsContact C-N 3.26Å; A446-L448 PolarHBondContact O-N 2.91Å; A446-S449 PolarHBondContact O-N 2.99Å; A446-S449 VanDerWaalsContact O-N 3.16Å; A446-S449 PolarHBondContact O-OG 3.45Å; A446-T450 PolarHBondContact O-N 3.06Å
447	Q	67.8	Low	71.7	Confident	87 Å²	87	53.1 Å²	53.1	41%	0.407	28%	0.279	S	S	.	.	H	α-helix	trans	-62.7	-30.3	174.5	-66.5	-179.3	-24.4	0	0	112.7	Q445 T450 I451	Q445-Q447 VanDerWaalsContact C-N 3.29Å; Q445-Q447 PolarHBondContact O-N 3.27Å; Q447-T450 PolarHBondContact O-OG1 3.46Å; Q447-I451 WeakPolarHBondContact O-CD1 3.26Å; Q447-I451 VanDerWaalsContact O-CG1 3.24Å; Q447-I451 WeakPolarHBondContact O-CG1 3.39Å; Q447-I451 PolarHBondContact O-N 3.15Å
448	L	70.2	Confident	71.5	Confident	3 Å²	3	53.4 Å²	53.4	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-76.8	-28.9	177	-57.9	172.2	0	0	0	112.1	Q444 Q445 A446 R452 V483 F484 K487	Q444-L448 WeakPolarHBondContact O-CG 3.26Å; Q445-L448 WeakPolarHBondContact O-CA 3.49Å; Q445-L448 WeakPolarHBondContact O-CB 3.46Å; Q445-L448 PolarHBondContact O-N 2.9Å; A446-L448 VanDerWaalsContact C-N 3.26Å; A446-L448 PolarHBondContact O-N 2.91Å; L448-R452 VanDerWaalsContact O-CB 3.28Å; L448-R452 WeakPolarHBondContact O-CB 3.07Å; L448-R452 PolarHBondContact O-N 3.26Å; L448-V483 HydrophobicContact CD2-CG1 4.39Å; L448-F484 HydrophobicContact CB-CD2 4.1Å; L448-F484 HydrophobicContact CD2-CB 3.7Å; L448-F484 HydrophobicContact CD2-CD2 3.81Å; L448-F484 HydrophobicContact CD2-CG 4.21Å; L448-F484 HydrophobicContact CG-CD2 4.5Å; L448-K487 HydrophobicContact CD1-CB 3.96Å; L448-K487 HydrophobicContact CD1-CD 3.39Å; L448-K487 HydrophobicContact CD1-CG 4.3Å
449	S	68.6	Low	71.4	Confident	44 Å²	44	58.1 Å²	58.1	31%	0.308	30%	0.301	S	S	.	.	H	α-helix	trans	-69.3	-37.8	177.8	81.9	0	0	0	0	112	Q445 A446 S453	Q445-S449 PolarHBondContact O-N 2.67Å; A446-S449 PolarHBondContact O-N 2.99Å; A446-S449 VanDerWaalsContact O-N 3.16Å; A446-S449 PolarHBondContact O-OG 3.45Å; S449-S453 PolarHBondContact O-N 2.86Å; S449-S453 PolarHBondContact O-OG 3.41Å
450	T	71.6	Confident	71.4	Confident	60 Å²	60	60.6 Å²	60.6	37%	0.368	32%	0.315	S	S	.	.	H	α-helix	trans	-66.9	-48.6	173.8	54.8	0	0	0	0	110.1	A446 Q447 R452 S453 F454	A446-T450 PolarHBondContact O-N 3.06Å; Q447-T450 PolarHBondContact O-OG1 3.46Å; T450-R452 VanDerWaalsContact C-N 3.34Å; T450-R452 PolarHBondContact O-N 3.14Å; T450-S453 WeakPolarHBondContact O-CB 3.42Å; T450-S453 PolarHBondContact O-N 2.97Å; T450-S453 VanDerWaalsContact O-N 3.09Å; T450-F454 WeakPolarHBondContact O-CD2 3.29Å; T450-F454 PolarHBondContact O-N 2.82Å; T450-F454 VanDerWaalsContact O-N 3.08Å
451	I	71.6	Confident	71.4	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-57.1	-46	175.2	-67	167.5	0	0	0	111	Q447 S453 F454 L455 L470 Q480 F484	Q447-I451 WeakPolarHBondContact O-CD1 3.26Å; Q447-I451 VanDerWaalsContact O-CG1 3.24Å; Q447-I451 WeakPolarHBondContact O-CG1 3.39Å; Q447-I451 PolarHBondContact O-N 3.15Å; I451-S453 VanDerWaalsContact C-N 3.28Å; I451-S453 PolarHBondContact O-N 2.93Å; I451-F454 PolarHBondContact O-N 3.38Å; I451-L455 HydrophobicContact CG2-CD1 3.67Å; I451-L455 HydrophobicContact CG2-CG 4.05Å; I451-L455 WeakPolarHBondContact O-CB 3.48Å; I451-L455 VanDerWaalsContact O-CG 3.3Å; I451-L455 WeakPolarHBondContact O-CG 3.18Å; I451-L455 PolarHBondContact O-N 2.85Å; I451-L470 HydrophobicContact CG1-CD1 4.04Å; I451-Q480 HydrophobicContact CD1-CB 4.01Å; I451-F484 HydrophobicContact CB-CD2 4.42Å; I451-F484 HydrophobicContact CG2-CD2 4.01Å; I451-F484 HydrophobicContact CG2-CE2 4.28Å
452	R	71.1	Confident	71.8	Confident	26 Å²	26	57.8 Å²	57.8	10%	0.098	31%	0.305	C	S	.	.	H	α-helix	trans	-57.2	-42	176.4	-174.7	175	174.4	171.1	-4	112.1	L448 T450 L455 K456 F484	L448-R452 VanDerWaalsContact O-CB 3.28Å; L448-R452 WeakPolarHBondContact O-CB 3.07Å; L448-R452 PolarHBondContact O-N 3.26Å; T450-R452 VanDerWaalsContact C-N 3.34Å; T450-R452 PolarHBondContact O-N 3.14Å; R452-L455 PolarHBondContact O-N 3.33Å; R452-K456 WeakPolarHBondContact O-CB 3.1Å; R452-K456 PolarHBondContact O-N 2.94Å; R452-F484 HydrophobicContact CB-CE2 3.91Å; R452-F484 HydrophobicContact CB-CZ 4.25Å; R452-F484 HydrophobicContact CG-CZ 4.5Å
453	S	72.8	Confident	72.1	Confident	74 Å²	74	57.5 Å²	57.5	52%	0.517	30%	0.304	S	S	.	.	H	α-helix	trans	-64.8	-42.2	-179.3	-58.9	0	0	0	0	111.2	S449 T450 I451 K456 L457	S449-S453 PolarHBondContact O-N 2.86Å; S449-S453 PolarHBondContact O-OG 3.41Å; T450-S453 WeakPolarHBondContact O-CB 3.42Å; T450-S453 PolarHBondContact O-N 2.97Å; T450-S453 VanDerWaalsContact O-N 3.09Å; I451-S453 VanDerWaalsContact C-N 3.28Å; I451-S453 PolarHBondContact O-N 2.93Å; S453-K456 PolarHBondContact O-N 3.05Å; S453-L457 WeakPolarHBondContact O-CG 3.31Å
454	F	70.7	Confident	72.3	Confident	65 Å²	65	53.5 Å²	53.5	29%	0.285	29%	0.292	S	S	.	.	H	α-helix	trans	-66.1	-47.6	173.4	-68.2	-64.3	0	0	0	111.8	T450 I451 K456 L457 Y458 L466 L470	T450-F454 WeakPolarHBondContact O-CD2 3.29Å; T450-F454 PolarHBondContact O-N 2.82Å; T450-F454 VanDerWaalsContact O-N 3.08Å; I451-F454 PolarHBondContact O-N 3.38Å; F454-K456 PolarHBondContact O-N 3.02Å; F454-K456 VanDerWaalsContact O-N 3.14Å; F454-L457 PolarHBondContact O-N 3.34Å; F454-Y458 WeakPolarHBondContact O-CD2 3.32Å; F454-Y458 PolarHBondContact O-N 2.98Å; F454-L466 HydrophobicContact CB-CD2 4.31Å; F454-L470 HydrophobicContact CD2-CD2 4.22Å; F454-L470 HydrophobicContact CE2-CD2 3.88Å
455	L	70.1	Confident	72.7	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-61.3	-23.7	178.5	-68	176.2	0	0	0	113.2	I451 R452 L466 F484 V510 F512 I519 I521	I451-L455 HydrophobicContact CG2-CD1 3.67Å; I451-L455 HydrophobicContact CG2-CG 4.05Å; I451-L455 WeakPolarHBondContact O-CB 3.48Å; I451-L455 VanDerWaalsContact O-CG 3.3Å; I451-L455 WeakPolarHBondContact O-CG 3.18Å; I451-L455 PolarHBondContact O-N 2.85Å; R452-L455 PolarHBondContact O-N 3.33Å; L455-L466 HydrophobicContact CD2-CD1 4.16Å; L455-F484 HydrophobicContact CD1-CE1 4.17Å; L455-F484 HydrophobicContact CD1-CE2 4.39Å; L455-F484 HydrophobicContact CD1-CZ 4.06Å; L455-V510 HydrophobicContact CB-CG1 4.39Å; L455-F512 HydrophobicContact CD1-CD1 3.99Å; L455-F512 HydrophobicContact CD1-CE1 3.96Å; L455-I519 HydrophobicContact CD2-CG2 4.37Å; L455-I521 HydrophobicContact CB-CD1 4.32Å; L455-I521 HydrophobicContact CD2-CD1 3.66Å; L455-I521 HydrophobicContact CD2-CG1 4.08Å
456	K	70.5	Confident	72.9	Confident	136 Å²	136	54.9 Å²	54.9	59%	0.591	30%	0.296	S	S	*	.	H	α-helix	trans	-77.9	-24.8	175.7	-171.4	167.6	-179	161.8	0	113.6	R452 S453 F454 E509	R452-K456 WeakPolarHBondContact O-CB 3.1Å; R452-K456 PolarHBondContact O-N 2.94Å; S453-K456 PolarHBondContact O-N 3.05Å; F454-K456 PolarHBondContact O-N 3.02Å; F454-K456 VanDerWaalsContact O-N 3.14Å; K456-E509 IonicContact NZ-OE2 2.63Å; K456-E509 PolarHBondContact NZ-OE2 2.78Å; K456-E509 VanDerWaalsContact NZ-OE2 3.09Å
457	L	72.6	Confident	73.4	Confident	133 Å²	133	53.3 Å²	53.3	70%	0.696	28%	0.284	S	S	*	.	H	α-helix	trans	-85.8	-22.6	-176.1	-70.4	168.2	0	0	0	113	S453 F454	S453-L457 WeakPolarHBondContact O-CG 3.31Å; F454-L457 PolarHBondContact O-N 3.34Å
458	Y	72.7	Confident	73.8	Confident	87 Å²	87	51.5 Å²	51.5	34%	0.341	29%	0.288	S	S	.	.			trans	-117.9	144.5	-173.7	-59	-76.5	0	0	0	111.3	F454 M461 I521	F454-Y458 WeakPolarHBondContact O-CD2 3.32Å; F454-Y458 PolarHBondContact O-N 2.98Å; Y458-M461 HydrophobicContact CD1-CE 4.11Å; Y458-M461 HydrophobicContact CD1-CG 4.05Å; Y458-M461 HydrophobicContact CD1-SD 3.69Å; Y458-M461 HydrophobicContact CD2-CE 3.17Å; Y458-M461 HydrophobicContact CD2-SD 3.9Å; Y458-M461 HydrophobicContact CE1-CE 4.39Å; Y458-M461 HydrophobicContact CE1-SD 3.88Å; Y458-M461 HydrophobicContact CE2-CE 3.53Å; Y458-M461 HydrophobicContact CE2-SD 4.08Å; Y458-M461 HydrophobicContact CG-CE 3.51Å; Y458-M461 HydrophobicContact CG-CG 3.95Å; Y458-M461 HydrophobicContact CG-SD 3.7Å; Y458-I521 WeakPolarHBondContact O-CD1 3.39Å
459	T	70.7	Confident	74.1	Confident	107 Å²	107	56.8 Å²	56.8	66%	0.656	31%	0.311	S	S	*	.	S	Bend	trans	-93.5	-35.8	175.9	48.9	0	0	0	0	112.2	I521	T459-I521 WeakPolarHBondContact O-CB 3.31Å; T459-I521 PolarHBondContact O-N 3.33Å
460	T	75.1	Confident	74.3	Confident	68 Å²	68	56.5 Å²	56.5	42%	0.417	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	134.9	174.2	57.2	0	0	0	0	109.6	I519 H520	T460-I519 VanDerWaalsContact CA-O 3.29Å; T460-I519 WeakPolarHBondContact CA-O 3.11Å; T460-H520 WeakPolarHBondContact CG2-ND1 3.44Å
461	M	75.9	Confident	74.6	Confident	16 Å²	16	61.1 Å²	61.1	8%	0.079	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	147.8	172.3	-84.7	-150.9	-56.7	0	0	113.1	Y458 L466 F469 I519	Y458-M461 HydrophobicContact CD1-CE 4.11Å; Y458-M461 HydrophobicContact CD1-CG 4.05Å; Y458-M461 HydrophobicContact CD1-SD 3.69Å; Y458-M461 HydrophobicContact CD2-CE 3.17Å; Y458-M461 HydrophobicContact CD2-SD 3.9Å; Y458-M461 HydrophobicContact CE1-CE 4.39Å; Y458-M461 HydrophobicContact CE1-SD 3.88Å; Y458-M461 HydrophobicContact CE2-CE 3.53Å; Y458-M461 HydrophobicContact CE2-SD 4.08Å; Y458-M461 HydrophobicContact CG-CE 3.51Å; Y458-M461 HydrophobicContact CG-CG 3.95Å; Y458-M461 HydrophobicContact CG-SD 3.7Å; M461-L466 HydrophobicContact CE-CB 4.39Å; M461-L466 HydrophobicContact CE-CD1 3.54Å; M461-L466 HydrophobicContact CE-CG 3.67Å; M461-F469 HydrophobicContact SD-CE2 4.47Å; M461-I519 PolarHBondContact N-O 3.48Å; M461-I519 VanDerWaalsContact N-O 3.09Å; M461-I519 PolarHBondContact O-N 3.27Å
462	P	80.9	Confident	74.9	Confident	36 Å²	36	63.5 Å²	63.5	23%	0.234	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	143.1	170.2	-12.8	25.1	0	0	0	112.1	A464 K465 L466 D517 M518	P462-A464 VanDerWaalsContact C-N 3.3Å; P462-A464 PolarHBondContact O-N 2.8Å; P462-K465 HydrophobicContact CG-CD 4.19Å; P462-K465 HydrophobicContact CG-CG 4.32Å; P462-K465 PolarHBondContact O-N 3.09Å; P462-L466 PolarHBondContact O-N 3.46Å; P462-D517 CarbonylContact C-O 3.56Å; P462-D517 VanDerWaalsContact CA-O 3.27Å; P462-D517 WeakPolarHBondContact CA-O 3.33Å; P462-M518 HydrophobicContact CB-SD 3.87Å; P462-M518 HydrophobicContact CG-CE 4.35Å; P462-M518 HydrophobicContact CG-SD 3.65Å
463	V	79	Confident	75.3	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-56.7	-44.3	176.6	178.1	0	0	0	0	110.8	K465 L466 A467 F477 R478 I514 D517 I519	V463-K465 VanDerWaalsContact C-N 3.32Å; V463-K465 PolarHBondContact O-N 3.43Å; V463-L466 PolarHBondContact O-N 3.3Å; V463-A467 WeakPolarHBondContact O-CB 3.38Å; V463-A467 PolarHBondContact O-N 3.46Å; V463-F477 HydrophobicContact CG1-CD1 3.73Å; V463-F477 HydrophobicContact CG1-CE1 4.13Å; V463-R478 HydrophobicContact CG1-CG 4.2Å; V463-I514 HydrophobicContact CG2-CG2 4.47Å; V463-D517 PolarHBondContact N-O 2.94Å; V463-I519 HydrophobicContact CG2-CD1 4.07Å; V463-I519 HydrophobicContact CG2-CG1 3.8Å
464	A	78	Confident	75.5	Confident	41 Å²	41	65.2 Å²	65.2	34%	0.339	35%	0.347	S	S	.	.	H	α-helix	trans	-57.1	-39.2	179.5	0	0	0	0	0	113.8	P462 G468 E474	P462-A464 VanDerWaalsContact C-N 3.3Å; P462-A464 PolarHBondContact O-N 2.8Å; A464-G468 PolarHBondContact O-N 3.42Å; A464-E474 WeakPolarHBondContact CB-OE1 3.23Å
465	K	78.5	Confident	75.8	Confident	133 Å²	133	69.6 Å²	69.6	58%	0.578	37%	0.368	S	S	*	.	H	α-helix	trans	-71.9	-40.7	179	-75.5	-168.9	177.9	-178.4	0	111.8	P462 V463 G468 F469	P462-K465 HydrophobicContact CG-CD 4.19Å; P462-K465 HydrophobicContact CG-CG 4.32Å; P462-K465 PolarHBondContact O-N 3.09Å; V463-K465 VanDerWaalsContact C-N 3.32Å; V463-K465 PolarHBondContact O-N 3.43Å; K465-G468 PolarHBondContact O-N 3.41Å; K465-F469 WeakPolarHBondContact O-CD2 3.36Å; K465-F469 PolarHBondContact O-N 3.13Å
466	L	74.3	Confident	76.2	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	39%	0.39	C	S	.	.	H	α-helix	trans	-70.2	-38.4	179.6	-134.3	157.9	0	0	0	111.2	F454 L455 M461 P462 V463 F469 L470 F477 I519	F454-L466 HydrophobicContact CB-CD2 4.31Å; L455-L466 HydrophobicContact CD2-CD1 4.16Å; M461-L466 HydrophobicContact CE-CB 4.39Å; M461-L466 HydrophobicContact CE-CD1 3.54Å; M461-L466 HydrophobicContact CE-CG 3.67Å; P462-L466 PolarHBondContact O-N 3.46Å; V463-L466 PolarHBondContact O-N 3.3Å; L466-F469 PolarHBondContact O-N 3.3Å; L466-L470 HydrophobicContact CD2-CD1 3.84Å; L466-L470 PolarHBondContact O-N 2.87Å; L466-F477 HydrophobicContact CB-CE1 3.71Å; L466-F477 HydrophobicContact CB-CE2 4.47Å; L466-F477 HydrophobicContact CB-CZ 3.68Å; L466-F477 HydrophobicContact CD1-CZ 4Å; L466-F477 HydrophobicContact CD2-CE1 4.36Å; L466-F477 HydrophobicContact CD2-CE2 3.66Å; L466-F477 HydrophobicContact CD2-CZ 3.44Å; L466-F477 VanDerWaalsContact CD2-CZ 3.44Å; L466-F477 HydrophobicContact CG-CE1 4.38Å; L466-F477 HydrophobicContact CG-CZ 3.86Å; L466-I519 HydrophobicContact CD1-CD1 4.07Å
467	A	78.7	Confident	76.5	Confident	2 Å²	2	67.9 Å²	67.9	2%	0.017	36%	0.362	C	S	.	.	H	α-helix	trans	-60.7	-44.1	170.7	0	0	0	0	0	111.4	V463 F469 L470 D471 M472 E474 F477	V463-A467 WeakPolarHBondContact O-CB 3.38Å; V463-A467 PolarHBondContact O-N 3.46Å; A467-F469 VanDerWaalsContact C-N 3.34Å; A467-F469 PolarHBondContact O-N 3.05Å; A467-L470 CarbonylContact O-C 3.59Å; A467-L470 PolarHBondContact O-N 3.28Å; A467-D471 PolarHBondContact O-N 2.86Å; A467-D471 VanDerWaalsContact O-N 3.1Å; A467-M472 PolarHBondContact O-N 3.47Å; A467-E474 HydrophobicContact CB-CG 4.24Å; A467-F477 HydrophobicContact CB-CB 4.04Å; A467-F477 HydrophobicContact CB-CD1 4.15Å; A467-F477 HydrophobicContact CB-CG 4.2Å
468	G	77.1	Confident	76.7	Confident	48 Å²	48	66.8 Å²	66.8	50%	0.495	35%	0.349	S	S	.	.	H	α-helix	trans	-65.5	-28.5	174.5	0	0	0	0	0	114.8	A464 K465 L470	A464-G468 PolarHBondContact O-N 3.42Å; K465-G468 PolarHBondContact O-N 3.41Å; G468-L470 VanDerWaalsContact C-N 3.35Å
469	F	76.6	Confident	77	Confident	115 Å²	115	67.8 Å²	67.8	50%	0.504	36%	0.359	S	S	.	.	H	α-helix	trans	-75	-24.1	173.2	-80	-60.6	0	0	0	113.6	M461 K465 L466 A467	M461-F469 HydrophobicContact SD-CE2 4.47Å; K465-F469 WeakPolarHBondContact O-CD2 3.36Å; K465-F469 PolarHBondContact O-N 3.13Å; L466-F469 PolarHBondContact O-N 3.3Å; A467-F469 VanDerWaalsContact C-N 3.34Å; A467-F469 PolarHBondContact O-N 3.05Å
470	L	72.9	Confident	77.1	Confident	38 Å²	38	63.9 Å²	63.9	20%	0.199	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	0.6	178.7	-71.4	165.2	0	0	0	112.3	I451 F454 L466 A467 G468 M472 F477	I451-L470 HydrophobicContact CG1-CD1 4.04Å; F454-L470 HydrophobicContact CD2-CD2 4.22Å; F454-L470 HydrophobicContact CE2-CD2 3.88Å; L466-L470 HydrophobicContact CD2-CD1 3.84Å; L466-L470 PolarHBondContact O-N 2.87Å; A467-L470 CarbonylContact O-C 3.59Å; A467-L470 PolarHBondContact O-N 3.28Å; G468-L470 VanDerWaalsContact C-N 3.35Å; L470-M472 HydrophobicContact CB-CB 4.47Å; L470-M472 HydrophobicContact CB-CG 4.04Å; L470-M472 HydrophobicContact CB-SD 4.36Å; L470-M472 WeakPolarHBondContact O-CG 3.2Å; L470-M472 PolarHBondContact O-N 3.19Å; L470-F477 HydrophobicContact CD1-CD2 3.66Å; L470-F477 HydrophobicContact CD1-CE2 3.52Å
471	D	76.4	Confident	77.1	Confident	156 Å²	156	60.7 Å²	60.7	83%	0.834	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	36.5	-172.2	-64.8	-40	0	0	0	113	A467	A467-D471 PolarHBondContact O-N 2.86Å; A467-D471 VanDerWaalsContact O-N 3.1Å
472	M	77.6	Confident	77	Confident	50 Å²	50	66 Å²	66	25%	0.246	34%	0.342	C	S	.	.			trans	-114.5	157.6	-179	-63.1	-171.1	79.7	0	0	111.7	A467 L470 E476 Q480	A467-M472 PolarHBondContact O-N 3.47Å; L470-M472 HydrophobicContact CB-CB 4.47Å; L470-M472 HydrophobicContact CB-CG 4.04Å; L470-M472 HydrophobicContact CB-SD 4.36Å; L470-M472 WeakPolarHBondContact O-CG 3.2Å; L470-M472 PolarHBondContact O-N 3.19Å; M472-E476 HydrophobicContact CE-CB 3.8Å; M472-Q480 HydrophobicContact CE-CG 4.43Å; M472-Q480 VanDerWaalsContact CE-NE2 3.29Å; M472-Q480 PolarHBondContact SD-OE1 3.47Å; M472-Q480 VanDerWaalsContact SD-OE1 3.39Å
473	S	80.8	Confident	76.5	Confident	51 Å²	51	66.9 Å²	66.9	36%	0.357	35%	0.346	S	S	.	.			trans	-69.3	151.7	169.8	69	0	0	0	0	111.3	Q475 E476 F477	S473-Q475 PolarHBondContact O-N 3.36Å; S473-E476 WeakPolarHBondContact CB-OE2 3.43Å; S473-E476 PolarHBondContact N-OE2 3.22Å; S473-E476 PolarHBondContact O-N 3.06Å; S473-E476 WeakPolarHBondContact OG-CB 3.48Å; S473-E476 WeakPolarHBondContact OG-CG 3.32Å; S473-E476 PolarHBondContact OG-N 2.96Å; S473-E476 PolarHBondContact OG-OE2 3.1Å; S473-F477 WeakPolarHBondContact O-CB 3.49Å; S473-F477 PolarHBondContact O-N 3.44Å
474	E	76.5	Confident	76.2	Confident	86 Å²	86	67 Å²	67	40%	0.402	35%	0.346	S	S	.	.	H	α-helix	trans	-58.7	-32	177.3	-67.8	-179.6	178.6	0	0	112.6	A464 A467 R478	A464-E474 WeakPolarHBondContact CB-OE1 3.23Å; A467-E474 HydrophobicContact CB-CG 4.24Å; E474-R478 WeakPolarHBondContact O-CB 3.49Å; E474-R478 VanDerWaalsContact O-CG 3.3Å; E474-R478 WeakPolarHBondContact O-CG 3.35Å; E474-R478 PolarHBondContact O-N 3Å
475	Q	77.1	Confident	75.8	Confident	156 Å²	156	69 Å²	69	73%	0.729	35%	0.348	S	S	*	.	H	α-helix	trans	-69.9	-48.1	178.5	-68.4	-176.4	-14.5	0	0	111.6	S473 F477 R478 I479	S473-Q475 PolarHBondContact O-N 3.36Å; Q475-F477 VanDerWaalsContact C-N 3.29Å; Q475-F477 PolarHBondContact O-N 2.8Å; Q475-R478 PolarHBondContact O-N 3.36Å; Q475-I479 WeakPolarHBondContact O-CG1 3.29Å; Q475-I479 PolarHBondContact O-N 3.28Å
476	E	78.3	Confident	75.3	Confident	101 Å²	101	69.6 Å²	69.6	47%	0.472	35%	0.352	S	S	.	.	H	α-helix	trans	-63.3	-39	176.3	-70.6	164.3	146.7	0	0	111.3	M472 S473 I479 Q480	M472-E476 HydrophobicContact CE-CB 3.8Å; S473-E476 WeakPolarHBondContact CB-OE2 3.43Å; S473-E476 PolarHBondContact N-OE2 3.22Å; S473-E476 PolarHBondContact O-N 3.06Å; S473-E476 WeakPolarHBondContact OG-CB 3.48Å; S473-E476 WeakPolarHBondContact OG-CG 3.32Å; S473-E476 PolarHBondContact OG-N 2.96Å; S473-E476 PolarHBondContact OG-OE2 3.1Å; E476-I479 PolarHBondContact O-N 3.43Å; E476-Q480 WeakPolarHBondContact O-CG 3.43Å; E476-Q480 PolarHBondContact O-N 2.94Å
477	F	77.1	Confident	74.9	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-66.6	-38.9	178.1	-178.7	-114.6	0	0	0	112.4	V463 L466 A467 L470 S473 Q475 Q480 L481 I519	V463-F477 HydrophobicContact CG1-CD1 3.73Å; V463-F477 HydrophobicContact CG1-CE1 4.13Å; L466-F477 HydrophobicContact CB-CE1 3.71Å; L466-F477 HydrophobicContact CB-CE2 4.47Å; L466-F477 HydrophobicContact CB-CZ 3.68Å; L466-F477 HydrophobicContact CD1-CZ 4Å; L466-F477 HydrophobicContact CD2-CE1 4.36Å; L466-F477 HydrophobicContact CD2-CE2 3.66Å; L466-F477 HydrophobicContact CD2-CZ 3.44Å; L466-F477 VanDerWaalsContact CD2-CZ 3.44Å; L466-F477 HydrophobicContact CG-CE1 4.38Å; L466-F477 HydrophobicContact CG-CZ 3.86Å; A467-F477 HydrophobicContact CB-CB 4.04Å; A467-F477 HydrophobicContact CB-CD1 4.15Å; A467-F477 HydrophobicContact CB-CG 4.2Å; L470-F477 HydrophobicContact CD1-CD2 3.66Å; L470-F477 HydrophobicContact CD1-CE2 3.52Å; S473-F477 WeakPolarHBondContact O-CB 3.49Å; S473-F477 PolarHBondContact O-N 3.44Å; Q475-F477 VanDerWaalsContact C-N 3.29Å; Q475-F477 PolarHBondContact O-N 2.8Å; F477-Q480 PolarHBondContact O-N 3.41Å; F477-L481 HydrophobicContact CD1-CD1 3.76Å; F477-L481 HydrophobicContact CE1-CD1 3.28Å; F477-L481 HydrophobicContact CE1-CG 4.18Å; F477-L481 HydrophobicContact CE2-CD1 4.21Å; F477-L481 HydrophobicContact CE2-CG 4.26Å; F477-L481 HydrophobicContact CG-CD1 4.38Å; F477-L481 HydrophobicContact CZ-CD1 3.49Å; F477-L481 VanDerWaalsContact CZ-CD1 3.49Å; F477-L481 HydrophobicContact CZ-CD2 4.33Å; F477-L481 HydrophobicContact CZ-CG 3.89Å; F477-L481 PolarHBondContact O-N 2.87Å; F477-I519 HydrophobicContact CE1-CD1 3.79Å; F477-I519 HydrophobicContact CZ-CD1 4.13Å
478	R	76.8	Confident	74	Confident	110 Å²	110	71.8 Å²	71.8	42%	0.415	36%	0.361	S	S	.	.	H	α-helix	trans	-63.1	-39.7	171.8	-76.9	176.8	-179.6	175.2	4.4	112.3	V463 E474 Q475 L481 L482 D517	V463-R478 HydrophobicContact CG1-CG 4.2Å; E474-R478 WeakPolarHBondContact O-CB 3.49Å; E474-R478 VanDerWaalsContact O-CG 3.3Å; E474-R478 WeakPolarHBondContact O-CG 3.35Å; E474-R478 PolarHBondContact O-N 3Å; Q475-R478 PolarHBondContact O-N 3.36Å; R478-L481 PolarHBondContact O-N 3.38Å; R478-L482 PolarHBondContact O-N 3.18Å; R478-D517 IonicContact NH2-OD1 2.84Å; R478-D517 PolarHBondContact NH2-OD1 3.49Å
479	I	79.4	Confident	73.2	Confident	108 Å²	108	74.3 Å²	74.3	55%	0.554	36%	0.359	S	S	*	.	H	α-helix	trans	-63.2	-44.7	174.2	-66.9	165.3	0	0	0	110	Q475 E476 L481 L482 V483	Q475-I479 WeakPolarHBondContact O-CG1 3.29Å; Q475-I479 PolarHBondContact O-N 3.28Å; E476-I479 PolarHBondContact O-N 3.43Å; I479-L481 PolarHBondContact O-N 2.98Å; I479-L482 WeakPolarHBondContact O-CB 3.33Å; I479-L482 PolarHBondContact O-N 2.91Å; I479-V483 HydrophobicContact CG2-CG2 4.48Å; I479-V483 VanDerWaalsContact O-CG2 3.31Å; I479-V483 WeakPolarHBondContact O-CG2 3.15Å; I479-V483 PolarHBondContact O-N 3Å
480	Q	72.9	Confident	72.2	Confident	25 Å²	25	69.9 Å²	69.9	12%	0.117	34%	0.341	C	S	.	.	H	α-helix	trans	-65.8	-35.4	177.2	-75.5	-165.7	-7.1	0	0	113.4	I451 M472 E476 F477 L482 V483 F484	I451-Q480 HydrophobicContact CD1-CB 4.01Å; M472-Q480 HydrophobicContact CE-CG 4.43Å; M472-Q480 VanDerWaalsContact CE-NE2 3.29Å; M472-Q480 PolarHBondContact SD-OE1 3.47Å; M472-Q480 VanDerWaalsContact SD-OE1 3.39Å; E476-Q480 WeakPolarHBondContact O-CG 3.43Å; E476-Q480 PolarHBondContact O-N 2.94Å; F477-Q480 PolarHBondContact O-N 3.41Å; Q480-L482 VanDerWaalsContact C-N 3.34Å; Q480-V483 PolarHBondContact O-N 2.81Å; Q480-F484 WeakPolarHBondContact O-CB 3.23Å; Q480-F484 PolarHBondContact O-N 3.27Å
481	L	73.3	Confident	71.3	Confident	2 Å²	2	70.3 Å²	70.3	1%	0.01	34%	0.343	C	S	.	.	H	α-helix	trans	-63.5	-38.8	171.4	-84.9	156.7	0	0	0	112.1	F477 R478 I479 F484 K485 F512 I514 I519	F477-L481 HydrophobicContact CD1-CD1 3.76Å; F477-L481 HydrophobicContact CE1-CD1 3.28Å; F477-L481 HydrophobicContact CE1-CG 4.18Å; F477-L481 HydrophobicContact CE2-CD1 4.21Å; F477-L481 HydrophobicContact CE2-CG 4.26Å; F477-L481 HydrophobicContact CG-CD1 4.38Å; F477-L481 HydrophobicContact CZ-CD1 3.49Å; F477-L481 VanDerWaalsContact CZ-CD1 3.49Å; F477-L481 HydrophobicContact CZ-CD2 4.33Å; F477-L481 HydrophobicContact CZ-CG 3.89Å; F477-L481 PolarHBondContact O-N 2.87Å; R478-L481 PolarHBondContact O-N 3.38Å; I479-L481 PolarHBondContact O-N 2.98Å; L481-F484 WeakPolarHBondContact O-CB 3.41Å; L481-F484 PolarHBondContact O-N 3.22Å; L481-K485 PolarHBondContact O-N 2.84Å; L481-F512 HydrophobicContact CB-CE2 4.32Å; L481-F512 HydrophobicContact CB-CZ 4.37Å; L481-F512 HydrophobicContact CD2-CD2 4.06Å; L481-F512 HydrophobicContact CD2-CE1 4.16Å; L481-F512 HydrophobicContact CD2-CE2 3.32Å; L481-F512 HydrophobicContact CD2-CZ 3.38Å; L481-F512 HydrophobicContact CG-CE2 4.39Å; L481-F512 HydrophobicContact CG-CZ 4.49Å; L481-I514 HydrophobicContact CD1-CD1 4.25Å; L481-I519 HydrophobicContact CD1-CD1 3.83Å; L481-I519 HydrophobicContact CD2-CD1 4.41Å
482	L	74.8	Confident	70.2	Confident	128 Å²	128	62.9 Å²	62.9	67%	0.67	30%	0.303	S	S	*	.	H	α-helix	trans	-65.1	-45.1	173.8	-166.8	85.2	0	0	0	110.8	R478 I479 Q480 F484 K485 H486	R478-L482 PolarHBondContact O-N 3.18Å; I479-L482 WeakPolarHBondContact O-CB 3.33Å; I479-L482 PolarHBondContact O-N 2.91Å; Q480-L482 VanDerWaalsContact C-N 3.34Å; L482-F484 VanDerWaalsContact C-N 3.28Å; L482-F484 PolarHBondContact O-N 3.22Å; L482-K485 PolarHBondContact O-N 3.13Å; L482-K485 VanDerWaalsContact O-N 3.17Å; L482-H486 WeakPolarHBondContact O-CB 3.48Å; L482-H486 PolarHBondContact O-N 3.1Å
483	V	71	Confident	68.8	Low	53 Å²	53	63.7 Å²	63.7	32%	0.321	30%	0.303	S	S	.	.	H	α-helix	trans	-60.1	-39.9	174.8	171.8	0	0	0	0	110.8	L448 I479 Q480 H486 K487	L448-V483 HydrophobicContact CD2-CG1 4.39Å; I479-V483 HydrophobicContact CG2-CG2 4.48Å; I479-V483 VanDerWaalsContact O-CG2 3.31Å; I479-V483 WeakPolarHBondContact O-CG2 3.15Å; I479-V483 PolarHBondContact O-N 3Å; Q480-V483 PolarHBondContact O-N 2.81Å; V483-H486 PolarHBondContact O-N 3.46Å; V483-K487 HydrophobicContact CG1-CD 3.78Å; V483-K487 HydrophobicContact CG1-CG 4.32Å; V483-K487 WeakPolarHBondContact O-CB 3.42Å; V483-K487 WeakPolarHBondContact O-CG 3.38Å; V483-K487 PolarHBondContact O-N 2.86Å
484	F	71.4	Confident	67.3	Low	2 Å²	2	63.4 Å²	63.4	1%	0.009	30%	0.299	C	S	.	.	H	α-helix	trans	-60.3	-48.4	173.8	-175.1	-80.8	0	0	0	111.2	L448 I451 R452 L455 Q480 L481 L482 H486 K487 M488 F512	L448-F484 HydrophobicContact CB-CD2 4.1Å; L448-F484 HydrophobicContact CD2-CB 3.7Å; L448-F484 HydrophobicContact CD2-CD2 3.81Å; L448-F484 HydrophobicContact CD2-CG 4.21Å; L448-F484 HydrophobicContact CG-CD2 4.5Å; I451-F484 HydrophobicContact CB-CD2 4.42Å; I451-F484 HydrophobicContact CG2-CD2 4.01Å; I451-F484 HydrophobicContact CG2-CE2 4.28Å; R452-F484 HydrophobicContact CB-CE2 3.91Å; R452-F484 HydrophobicContact CB-CZ 4.25Å; R452-F484 HydrophobicContact CG-CZ 4.5Å; L455-F484 HydrophobicContact CD1-CE1 4.17Å; L455-F484 HydrophobicContact CD1-CE2 4.39Å; L455-F484 HydrophobicContact CD1-CZ 4.06Å; Q480-F484 WeakPolarHBondContact O-CB 3.23Å; Q480-F484 PolarHBondContact O-N 3.27Å; L481-F484 WeakPolarHBondContact O-CB 3.41Å; L481-F484 PolarHBondContact O-N 3.22Å; L482-F484 VanDerWaalsContact C-N 3.28Å; L482-F484 PolarHBondContact O-N 3.22Å; F484-H486 VanDerWaalsContact C-N 3.32Å; F484-H486 PolarHBondContact O-N 3.19Å; F484-K487 PolarHBondContact O-N 3.43Å; F484-M488 HydrophobicContact CD1-CG 3.73Å; F484-M488 HydrophobicContact CD2-CE 4.21Å; F484-M488 HydrophobicContact CD2-CG 4.41Å; F484-M488 HydrophobicContact CE1-CB 4.42Å; F484-M488 HydrophobicContact CE1-CG 3.53Å; F484-M488 HydrophobicContact CE2-CE 3.7Å; F484-M488 HydrophobicContact CE2-CG 4.21Å; F484-M488 HydrophobicContact CG-CG 4.2Å; F484-M488 HydrophobicContact CZ-CE 3.94Å; F484-M488 HydrophobicContact CZ-CG 3.78Å; F484-M488 HydrophobicContact CZ-SD 4.22Å; F484-M488 VanDerWaalsContact O-CB 3.24Å; F484-M488 WeakPolarHBondContact O-CB 3.37Å; F484-M488 WeakPolarHBondContact O-CG 3.34Å; F484-M488 PolarHBondContact O-N 2.92Å; F484-F512 AromaticContact CD1-CE1 3.44Å; F484-F512 HydrophobicContact CD1-CE1 3.44Å; F484-F512 VanDerWaalsContact CD1-CE1 3.44Å; F484-F512 AromaticContact CD1-CZ 3.99Å; F484-F512 HydrophobicContact CD1-CZ 3.99Å; F484-F512 HydrophobicContact CE1-CD1 4.38Å; F484-F512 AromaticContact CE1-CE1 3.63Å; F484-F512 HydrophobicContact CE1-CE1 3.63Å; F484-F512 HydrophobicContact CG-CE1 4.42Å
485	K	70.7	Confident	65.7	Low	85 Å²	85	64 Å²	64	37%	0.37	31%	0.313	S	S	.	.	H	α-helix	trans	-65.1	-35.7	179.3	-166.1	166.2	-171.6	155.1	0	112.5	L481 L482 K489	L481-K485 PolarHBondContact O-N 2.84Å; L482-K485 PolarHBondContact O-N 3.13Å; L482-K485 VanDerWaalsContact O-N 3.17Å; K485-K489 WeakPolarHBondContact O-CG 3.42Å
486	H	68.4	Low	64.1	Low	145 Å²	145	58 Å²	58	67%	0.671	29%	0.293	S	S	*	.	H	α-helix	trans	-67.8	-47.3	174.3	179.9	-88.7	0	0	0	111.7	L482 V483 F484 K489	L482-H486 WeakPolarHBondContact O-CB 3.48Å; L482-H486 PolarHBondContact O-N 3.1Å; V483-H486 PolarHBondContact O-N 3.46Å; F484-H486 VanDerWaalsContact C-N 3.32Å; F484-H486 PolarHBondContact O-N 3.19Å; H486-K489 PolarHBondContact O-N 2.86Å
487	K	64.9	Low	62.7	Low	38 Å²	38	58 Å²	58	17%	0.165	30%	0.296	C	S	.	.	H	α-helix	trans	-77.9	-23.2	-176.1	-72.7	-178.2	168.3	-154.1	0	114.4	L448 V483 F484 K489	L448-K487 HydrophobicContact CD1-CB 3.96Å; L448-K487 HydrophobicContact CD1-CD 3.39Å; L448-K487 HydrophobicContact CD1-CG 4.3Å; V483-K487 HydrophobicContact CG1-CD 3.78Å; V483-K487 HydrophobicContact CG1-CG 4.32Å; V483-K487 WeakPolarHBondContact O-CB 3.42Å; V483-K487 WeakPolarHBondContact O-CG 3.38Å; V483-K487 PolarHBondContact O-N 2.86Å; F484-K487 PolarHBondContact O-N 3.43Å; K487-K489 VanDerWaalsContact C-N 3.33Å
488	M	60.9	Low	61.5	Low	10 Å²	10	59 Å²	59	5%	0.049	30%	0.302	C	S	.	.	H	α-helix	trans	-80.2	-15.9	174.1	-70.8	-69	156	0	0	113.2	F484 N490 S506 A507	F484-M488 HydrophobicContact CD1-CG 3.73Å; F484-M488 HydrophobicContact CD2-CE 4.21Å; F484-M488 HydrophobicContact CD2-CG 4.41Å; F484-M488 HydrophobicContact CE1-CB 4.42Å; F484-M488 HydrophobicContact CE1-CG 3.53Å; F484-M488 HydrophobicContact CE2-CE 3.7Å; F484-M488 HydrophobicContact CE2-CG 4.21Å; F484-M488 HydrophobicContact CG-CG 4.2Å; F484-M488 HydrophobicContact CZ-CE 3.94Å; F484-M488 HydrophobicContact CZ-CG 3.78Å; F484-M488 HydrophobicContact CZ-SD 4.22Å; F484-M488 VanDerWaalsContact O-CB 3.24Å; F484-M488 WeakPolarHBondContact O-CB 3.37Å; F484-M488 WeakPolarHBondContact O-CG 3.34Å; F484-M488 PolarHBondContact O-N 2.92Å; M488-N490 PolarHBondContact O-N 3.3Å; M488-S506 WeakPolarHBondContact O-CA 3.46Å; M488-A507 PolarHBondContact O-N 3.27Å
489	K	59.5	Low	60.3	Low	101 Å²	101	54.2 Å²	54.2	44%	0.439	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	90.5	166.5	-73.3	-176.2	177	-167.4	0	108.6	K485 H486 K487	K485-K489 WeakPolarHBondContact O-CG 3.42Å; H486-K489 PolarHBondContact O-N 2.86Å; K487-K489 VanDerWaalsContact C-N 3.33Å
490	N	55.9	Low	59.1	Low	23 Å²	23	50.2 Å²	50.2	12%	0.123	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	147.9	177.4	-150.5	-12.5	0	0	0	110.3	R318 M488 V492 F504 Q505	R318-N490 PolarHBondContact O-ND2 2.81Å; R318-N490 PolarHBondContact O-OD1 3.47Å; M488-N490 PolarHBondContact O-N 3.3Å; N490-V492 HydrophobicContact CB-CG2 4.43Å; N490-V492 PolarHBondContact O-N 3.02Å; N490-F504 WeakPolarHBondContact O-CA 3.47Å; N490-Q505 PolarHBondContact N-O 3.44Å; N490-Q505 PolarHBondContact O-N 3.27Å
491	L	53.2	Low	58.2	Low	46 Å²	46	53.5 Å²	53.5	24%	0.241	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	106.3	170.8	-166.8	75.2	0	0	0	107.3	R319 G502 F504	R319-L491 PolarHBondContact NE-O 2.84Å; L491-G502 VanDerWaalsContact CD1-C 3.5Å; L491-G502 WeakPolarHBondContact CD1-O 3.34Å; L491-F504 HydrophobicContact CB-CE1 4.46Å; L491-F504 HydrophobicContact CD1-CD1 4.42Å; L491-F504 HydrophobicContact CD1-CD2 4.06Å; L491-F504 HydrophobicContact CD1-CE1 4.33Å; L491-F504 HydrophobicContact CD1-CE2 3.96Å; L491-F504 HydrophobicContact CD1-CG 4.29Å; L491-F504 HydrophobicContact CD1-CZ 4.1Å
492	V	54.8	Low	57.3	Low	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.9	-177.1	175.3	0	0	0	0	108.4	Q321 N490 T494 G502 E503 Q505	Q321-V492 HydrophobicContact CB-CG2 4.17Å; Q321-V492 HydrophobicContact CG-CG1 4.05Å; Q321-V492 HydrophobicContact CG-CG2 4.15Å; Q321-V492 VanDerWaalsContact NE2-CG1 3.29Å; Q321-V492 VanDerWaalsContact OE1-CG2 3.31Å; N490-V492 HydrophobicContact CB-CG2 4.43Å; N490-V492 PolarHBondContact O-N 3.02Å; V492-T494 HydrophobicContact CG1-CG2 4.38Å; V492-T494 PolarHBondContact O-N 3.48Å; V492-G502 CarbonylContact O-C 3.56Å; V492-G502 WeakPolarHBondContact O-CA 3.32Å; V492-E503 PolarHBondContact N-O 2.89Å; V492-E503 PolarHBondContact O-N 3.25Å; V492-Q505 HydrophobicContact CB-CB 4.06Å; V492-Q505 HydrophobicContact CB-CG 4.21Å; V492-Q505 HydrophobicContact CG2-CB 3.94Å
493	W	47.7	Very low	56.2	Low	68 Å²	68	54 Å²	54	26%	0.258	29%	0.291	S	S	.	.			trans	-67.4	117.7	169.5	-167.4	88	0	0	0	109.4	N291 D322 R325 G496 S498	N291-W493 WeakPolarHBondContact ND2-CZ3 3.27Å; D322-W493 PolarHBondContact OD1-N 3.31Å; D322-W493 WeakPolarHBondContact OD2-CB 3.08Å; D322-W493 PolarHBondContact OD2-N 2.96Å; R325-W493 PolarHBondContact NH1-O 3.48Å; W493-G496 WeakPolarHBondContact CZ2-O 3.25Å; W493-G496 PolarHBondContact NE1-O 3.39Å; W493-S498 PolarHBondContact NE1-O 3.44Å; W493-S498 VanDerWaalsContact NE1-O 3.13Å
494	T	49.3	Very low	55.4	Low	44 Å²	44	59 Å²	59	27%	0.27	31%	0.308	S	S	.	.			trans	-110.3	-48.6	-177	47.4	0	0	0	0	111.1	V492 E503 Q505	V492-T494 HydrophobicContact CG1-CG2 4.38Å; V492-T494 PolarHBondContact O-N 3.48Å; T494-E503 HydrophobicContact CG2-CB 4.21Å; T494-E503 PolarHBondContact OG1-OE2 3.32Å; T494-Q505 VanDerWaalsContact CG2-CD 3.43Å; T494-Q505 HydrophobicContact CG2-CG 4.06Å
495	S	42.7	Very low	54.6	Low	100 Å²	100	62.5 Å²	62.5	70%	0.699	32%	0.324	S	S	*	.	S	Bend	trans	-171.4	126.7	168.8	51.5	0	0	0	0	109.8
496	G	42.7	Very low	53.9	Low	30 Å²	30	61.4 Å²	61.4	31%	0.309	33%	0.328	S	S	.	.			trans	-179.4	152.7	176.7	0	0	0	0	0	110.4	W493 S498	W493-G496 WeakPolarHBondContact CZ2-O 3.25Å; W493-G496 PolarHBondContact NE1-O 3.39Å; G496-S498 VanDerWaalsContact C-N 3.27Å
497	I	48.8	Very low	53.2	Low	101 Å²	101	55.5 Å²	55.5	52%	0.518	30%	0.304	S	S	.	.	S	Bend	trans	-68	-35.8	177	-63.9	163.8	0	0	0	109.6	T239	T239-I497 HydrophobicContact CG2-CB 4.3Å; T239-I497 HydrophobicContact CG2-CD1 4.16Å; T239-I497 HydrophobicContact CG2-CG1 3.81Å; T239-I497 HydrophobicContact CG2-CG2 3.64Å
498	S	51.8	Low	52.7	Low	20 Å²	20	54.1 Å²	54.1	14%	0.14	30%	0.299	C	S	.	.	S	Bend	trans	-80.2	132	177.9	-179.5	0	0	0	0	112	E286 W493 G496 L500 D501	E286-S498 WeakPolarHBondContact CG-OG 3.41Å; W493-S498 PolarHBondContact NE1-O 3.44Å; W493-S498 VanDerWaalsContact NE1-O 3.13Å; G496-S498 VanDerWaalsContact C-N 3.27Å; S498-L500 PolarHBondContact O-N 2.84Å; S498-L500 PolarHBondContact OG-N 3.39Å; S498-D501 WeakPolarHBondContact CB-OD2 3.46Å; S498-D501 PolarHBondContact O-N 2.86Å
499	A	53.1	Low	52.4	Low	9 Å²	9	55.8 Å²	55.8	7%	0.074	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-16	170.2	0	0	0	0	0	112.9	I282 Y314 R319	I282-A499 HydrophobicContact CG2-CB 3.92Å; Y314-A499 VanDerWaalsContact OH-CB 3.3Å; Y314-A499 WeakPolarHBondContact OH-CB 3.46Å; Y314-A499 PolarHBondContact OH-O 3.28Å; R319-A499 PolarHBondContact NH1-O 2.84Å; R319-A499 PolarHBondContact NH2-O 3.4Å
500	L	54.4	Low	52.5	Low	25 Å²	25	51.5 Å²	51.5	13%	0.131	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-20.8	177.7	-86.1	147.3	0	0	0	113.8	Y279 I282 K283 E286 M317 S498	Y279-L500 HydrophobicContact CD2-CD2 3.81Å; Y279-L500 HydrophobicContact CE2-CD2 3.59Å; I282-L500 HydrophobicContact CB-CD1 4.31Å; I282-L500 HydrophobicContact CB-CG 4.34Å; I282-L500 HydrophobicContact CG2-CD1 4.05Å; I282-L500 HydrophobicContact CG2-CD2 4.42Å; I282-L500 HydrophobicContact CG2-CG 3.77Å; K283-L500 HydrophobicContact CB-CD1 3.98Å; E286-L500 HydrophobicContact CG-CD1 3.78Å; E286-L500 WeakPolarHBondContact OE1-CD1 3.25Å; M317-L500 HydrophobicContact CE-CD2 4.08Å; S498-L500 PolarHBondContact O-N 2.84Å; S498-L500 PolarHBondContact OG-N 3.39Å
501	D	53	Low	52.9	Low	94 Å²	94	53.9 Å²	53.9	50%	0.503	30%	0.301	S	S	.	.			trans	-70.3	136.9	175.8	-73.1	-24.9	0	0	0	110.4	S498	S498-D501 WeakPolarHBondContact CB-OD2 3.46Å; S498-D501 PolarHBondContact O-N 2.86Å
502	G	54.3	Low	53.8	Low	27 Å²	27	52.1 Å²	52.1	28%	0.278	29%	0.292	S	S	.	.			trans	-161.1	156	175	0	0	0	0	0	110.2	L491 V492	L491-G502 VanDerWaalsContact CD1-C 3.5Å; L491-G502 WeakPolarHBondContact CD1-O 3.34Å; V492-G502 CarbonylContact O-C 3.56Å; V492-G502 WeakPolarHBondContact O-CA 3.32Å
503	E	52.2	Low	54.8	Low	114 Å²	114	58.2 Å²	58.2	53%	0.533	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	141.7	171.7	-68.4	177.1	149.2	0	0	108.1	V492 T494 Q505	V492-E503 PolarHBondContact N-O 2.89Å; V492-E503 PolarHBondContact O-N 3.25Å; T494-E503 HydrophobicContact CG2-CB 4.21Å; T494-E503 PolarHBondContact OG1-OE2 3.32Å; E503-Q505 HydrophobicContact CB-CG 4.49Å; E503-Q505 PolarHBondContact O-N 2.79Å
504	F	54.3	Low	56.2	Low	156 Å²	156	58.5 Å²	58.5	68%	0.684	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.2	102.8	170.6	-75.5	-79.5	0	0	0	108.6	N490 L491	N490-F504 WeakPolarHBondContact O-CA 3.47Å; L491-F504 HydrophobicContact CB-CE1 4.46Å; L491-F504 HydrophobicContact CD1-CD1 4.42Å; L491-F504 HydrophobicContact CD1-CD2 4.06Å; L491-F504 HydrophobicContact CD1-CE1 4.33Å; L491-F504 HydrophobicContact CD1-CE2 3.96Å; L491-F504 HydrophobicContact CD1-CG 4.29Å; L491-F504 HydrophobicContact CD1-CZ 4.1Å
505	Q	55.1	Low	57.5	Low	76 Å²	76	60.5 Å²	60.5	36%	0.355	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	127	172.8	-64.6	-158.5	-15	0	0	109.1	N490 V492 T494 E503 A507	N490-Q505 PolarHBondContact N-O 3.44Å; N490-Q505 PolarHBondContact O-N 3.27Å; V492-Q505 HydrophobicContact CB-CB 4.06Å; V492-Q505 HydrophobicContact CB-CG 4.21Å; V492-Q505 HydrophobicContact CG2-CB 3.94Å; T494-Q505 VanDerWaalsContact CG2-CD 3.43Å; T494-Q505 HydrophobicContact CG2-CG 4.06Å; E503-Q505 HydrophobicContact CB-CG 4.49Å; E503-Q505 PolarHBondContact O-N 2.79Å; Q505-A507 PolarHBondContact O-N 2.84Å; Q505-A507 VanDerWaalsContact O-N 3.12Å
506	S	55.7	Low	59	Low	63 Å²	63	64.6 Å²	64.6	44%	0.441	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	106.8	164.2	-64.8	0	0	0	0	107.2	M488 S508	M488-S506 WeakPolarHBondContact O-CA 3.46Å; S506-S508 VanDerWaalsContact C-N 3.34Å
507	A	52.7	Low	60.5	Low	21 Å²	21	66.2 Å²	66.2	17%	0.174	34%	0.337	C	S	.	.			trans	-88.7	-14.7	-174.7	0	0	0	0	0	110.7	Y369 M488 Q505 E509	Y369-A507 HydrophobicContact CE1-CB 3.94Å; Y369-A507 HydrophobicContact CE2-CB 3.88Å; Y369-A507 VanDerWaalsContact OH-CA 3.28Å; Y369-A507 WeakPolarHBondContact OH-CA 3.2Å; Y369-A507 WeakPolarHBondContact OH-CB 3.21Å; Y369-A507 PolarHBondContact OH-O 3.46Å; M488-A507 PolarHBondContact O-N 3.27Å; Q505-A507 PolarHBondContact O-N 2.84Å; Q505-A507 VanDerWaalsContact O-N 3.12Å; A507-E509 PolarHBondContact O-N 2.84Å
508	S	54.6	Low	61.8	Low	8 Å²	8	64.9 Å²	64.9	6%	0.056	33%	0.33	C	S	.	.			trans	-62.2	127.3	175.3	42.1	0	0	0	0	112.4	S506 V510 T524	S506-S508 VanDerWaalsContact C-N 3.34Å; S508-V510 WeakPolarHBondContact CB-O 2.94Å; S508-V510 PolarHBondContact O-N 3.33Å; S508-V510 PolarHBondContact OG-O 2.93Å; S508-T524 PolarHBondContact O-OG1 3.36Å; S508-T524 VanDerWaalsContact O-OG1 3.12Å
509	E	54.7	Low	63	Low	46 Å²	46	63.9 Å²	63.9	22%	0.215	32%	0.323	C	S	.	.	S	Bend	trans	-56.7	-17.4	169.1	-60.4	-174.5	137.6	0	0	112.4	K456 A507 T524 K525	K456-E509 IonicContact NZ-OE2 2.63Å; K456-E509 PolarHBondContact NZ-OE2 2.78Å; K456-E509 VanDerWaalsContact NZ-OE2 3.09Å; A507-E509 PolarHBondContact O-N 2.84Å; E509-T524 WeakPolarHBondContact CA-OG1 3.2Å; E509-T524 PolarHBondContact O-N 3.45Å; E509-T524 PolarHBondContact O-OG1 3.45Å; E509-K525 WeakPolarHBondContact OE1-CE 3.48Å; E509-K525 IonicContact OE1-NZ 3.99Å; E509-K525 PolarHBondContact OE1-NZ 2.86Å
510	V	60.5	Low	64.1	Low	11 Å²	11	65.7 Å²	65.7	7%	0.067	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	120.8	-172.8	-167.4	0	0	0	0	108.5	L455 S508 I521	L455-V510 HydrophobicContact CB-CG1 4.39Å; S508-V510 WeakPolarHBondContact CB-O 2.94Å; S508-V510 PolarHBondContact O-N 3.33Å; S508-V510 PolarHBondContact OG-O 2.93Å; V510-I521 HydrophobicContact CG1-CB 4.49Å; V510-I521 HydrophobicContact CG1-CG2 3.17Å
511	D	66.3	Low	64.9	Low	72 Å²	72	65.9 Å²	65.9	39%	0.385	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	151.1	166.6	-171.6	17.4	0	0	0	107.8	I521 A522 T524	D511-I521 CarbonylContact O-C 3.58Å; D511-A522 PolarHBondContact N-O 2.72Å; D511-A522 PolarHBondContact O-N 3.17Å; D511-T524 HydrophobicContact CB-CG2 3.31Å
512	F	70.3	Confident	65.4	Low	9 Å²	9	63.5 Å²	63.5	4%	0.039	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	151.1	177	66.3	-89.2	0	0	0	111.3	L455 L481 F484 I514 I519 H520 I521	L455-F512 HydrophobicContact CD1-CD1 3.99Å; L455-F512 HydrophobicContact CD1-CE1 3.96Å; L481-F512 HydrophobicContact CB-CE2 4.32Å; L481-F512 HydrophobicContact CB-CZ 4.37Å; L481-F512 HydrophobicContact CD2-CD2 4.06Å; L481-F512 HydrophobicContact CD2-CE1 4.16Å; L481-F512 HydrophobicContact CD2-CE2 3.32Å; L481-F512 HydrophobicContact CD2-CZ 3.38Å; L481-F512 HydrophobicContact CG-CE2 4.39Å; L481-F512 HydrophobicContact CG-CZ 4.49Å; F484-F512 AromaticContact CD1-CE1 3.44Å; F484-F512 HydrophobicContact CD1-CE1 3.44Å; F484-F512 VanDerWaalsContact CD1-CE1 3.44Å; F484-F512 AromaticContact CD1-CZ 3.99Å; F484-F512 HydrophobicContact CD1-CZ 3.99Å; F484-F512 HydrophobicContact CE1-CD1 4.38Å; F484-F512 AromaticContact CE1-CE1 3.63Å; F484-F512 HydrophobicContact CE1-CE1 3.63Å; F484-F512 HydrophobicContact CG-CE1 4.42Å; F512-I514 HydrophobicContact CD2-CG1 4.49Å; F512-I519 HydrophobicContact CB-CG2 4Å; F512-I519 HydrophobicContact CD2-CG2 3.96Å; F512-I519 HydrophobicContact CG-CG2 4.18Å; F512-H520 WeakPolarHBondContact CA-O 3.39Å; F512-H520 VanDerWaalsContact CB-O 3.31Å; F512-H520 WeakPolarHBondContact CB-O 3.41Å; F512-I521 HydrophobicContact CB-CG1 4.06Å
513	Y	77.4	Confident	65.6	Low	129 Å²	129	67.6 Å²	67.6	51%	0.506	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	149.2	169.4	65.3	-87.3	0	0	0	109.3	D515 H520	Y513-D515 HydrophobicContact CD2-CB 4.32Å; Y513-D515 HydrophobicContact CE2-CB 4.17Å; Y513-H520 HydrophobicContact CD1-CB 3.91Å; Y513-H520 HydrophobicContact CD2-CB 4.05Å; Y513-H520 HydrophobicContact CE1-CB 3.41Å; Y513-H520 VanDerWaalsContact CE1-CB 3.41Å; Y513-H520 HydrophobicContact CE2-CB 3.57Å; Y513-H520 AromaticContact CE2-CD2 3.51Å; Y513-H520 AromaticContact CE2-CG 3.67Å; Y513-H520 HydrophobicContact CG-CB 4.21Å; Y513-H520 AromaticContact CZ-CD2 3.91Å; Y513-H520 AromaticContact CZ-CG 3.56Å; Y513-H520 PolarHBondContact N-O 3.2Å; Y513-H520 PolarHBondContact O-N 3.38Å
514	I	76.7	Confident	65.8	Low	73 Å²	73	65.2 Å²	65.2	37%	0.374	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	113.3	177.2	-57.8	172.1	0	0	0	105.7	V463 L481 F512 I519	V463-I514 HydrophobicContact CG2-CG2 4.47Å; L481-I514 HydrophobicContact CD1-CD1 4.25Å; F512-I514 HydrophobicContact CD2-CG1 4.49Å; I514-I519 HydrophobicContact CG1-CG1 4.4Å
515	D	75.4	Confident	65.6	Low	87 Å²	87	62.6 Å²	62.6	47%	0.465	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	109.2	168.2	-174.8	12.6	0	0	0	108.7	Y513 D517 M518	Y513-D515 HydrophobicContact CD2-CB 4.32Å; Y513-D515 HydrophobicContact CE2-CB 4.17Å; D515-D517 VanDerWaalsContact C-N 3.32Å; D515-D517 PolarHBondContact O-N 3.38Å; D515-M518 PolarHBondContact N-O 2.84Å; D515-M518 PolarHBondContact O-N 3.12Å
516	K	75.9	Confident	65.3	Low	186 Å²	186	63.5 Å²	63.5	81%	0.809	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	-87.8	-171.3	-60.8	174.6	-177.5	175.8	0	112.5
517	D	72.9	Confident	64.8	Low	63 Å²	63	64.2 Å²	64.2	34%	0.337	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.5	7.2	-175	-139.9	31.1	0	0	0	112.8	P462 V463 R478 D515	P462-D517 CarbonylContact C-O 3.56Å; P462-D517 VanDerWaalsContact CA-O 3.27Å; P462-D517 WeakPolarHBondContact CA-O 3.33Å; V463-D517 PolarHBondContact N-O 2.94Å; R478-D517 IonicContact NH2-OD1 2.84Å; R478-D517 PolarHBondContact NH2-OD1 3.49Å; D515-D517 VanDerWaalsContact C-N 3.32Å; D515-D517 PolarHBondContact O-N 3.38Å
518	M	75.7	Confident	64.8	Low	73 Å²	73	73.7 Å²	73.7	36%	0.36	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	124.7	176.8	-66.3	-64.9	-71.8	0	0	109.5	P462 D515	P462-M518 HydrophobicContact CB-SD 3.87Å; P462-M518 HydrophobicContact CG-CE 4.35Å; P462-M518 HydrophobicContact CG-SD 3.65Å; D515-M518 PolarHBondContact N-O 2.84Å; D515-M518 PolarHBondContact O-N 3.12Å
519	I	77.2	Confident	65	Low	0 Å²	0	80.4 Å²	80.4	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	116.8	172	-54.1	171.6	0	0	0	106.9	L455 T460 M461 V463 L466 F477 L481 F512 I514 I521	L455-I519 HydrophobicContact CD2-CG2 4.37Å; T460-I519 VanDerWaalsContact CA-O 3.29Å; T460-I519 WeakPolarHBondContact CA-O 3.11Å; M461-I519 PolarHBondContact N-O 3.48Å; M461-I519 VanDerWaalsContact N-O 3.09Å; M461-I519 PolarHBondContact O-N 3.27Å; V463-I519 HydrophobicContact CG2-CD1 4.07Å; V463-I519 HydrophobicContact CG2-CG1 3.8Å; L466-I519 HydrophobicContact CD1-CD1 4.07Å; F477-I519 HydrophobicContact CE1-CD1 3.79Å; F477-I519 HydrophobicContact CZ-CD1 4.13Å; L481-I519 HydrophobicContact CD1-CD1 3.83Å; L481-I519 HydrophobicContact CD2-CD1 4.41Å; F512-I519 HydrophobicContact CB-CG2 4Å; F512-I519 HydrophobicContact CD2-CG2 3.96Å; F512-I519 HydrophobicContact CG-CG2 4.18Å; I514-I519 HydrophobicContact CG1-CG1 4.4Å; I519-I521 HydrophobicContact CG2-CG1 4.08Å
520	H	76.4	Confident	65.1	Low	47 Å²	47	86.8 Å²	86.8	22%	0.218	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	119.5	172.6	-69.2	-83.2	0	0	0	109	T460 F512 Y513	T460-H520 WeakPolarHBondContact CG2-ND1 3.44Å; F512-H520 WeakPolarHBondContact CA-O 3.39Å; F512-H520 VanDerWaalsContact CB-O 3.31Å; F512-H520 WeakPolarHBondContact CB-O 3.41Å; Y513-H520 HydrophobicContact CD1-CB 3.91Å; Y513-H520 HydrophobicContact CD2-CB 4.05Å; Y513-H520 HydrophobicContact CE1-CB 3.41Å; Y513-H520 VanDerWaalsContact CE1-CB 3.41Å; Y513-H520 HydrophobicContact CE2-CB 3.57Å; Y513-H520 AromaticContact CE2-CD2 3.51Å; Y513-H520 AromaticContact CE2-CG 3.67Å; Y513-H520 HydrophobicContact CG-CB 4.21Å; Y513-H520 AromaticContact CZ-CD2 3.91Å; Y513-H520 AromaticContact CZ-CG 3.56Å; Y513-H520 PolarHBondContact N-O 3.2Å; Y513-H520 PolarHBondContact O-N 3.38Å
521	I	71.9	Confident	65.3	Low	28 Å²	28	88.2 Å²	88.2	14%	0.144	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	116.2	-177.6	-65.5	154.5	0	0	0	107.8	L455 Y458 T459 V510 D511 F512 I519	L455-I521 HydrophobicContact CB-CD1 4.32Å; L455-I521 HydrophobicContact CD2-CD1 3.66Å; L455-I521 HydrophobicContact CD2-CG1 4.08Å; Y458-I521 WeakPolarHBondContact O-CD1 3.39Å; T459-I521 WeakPolarHBondContact O-CB 3.31Å; T459-I521 PolarHBondContact O-N 3.33Å; V510-I521 HydrophobicContact CG1-CB 4.49Å; V510-I521 HydrophobicContact CG1-CG2 3.17Å; D511-I521 CarbonylContact O-C 3.58Å; F512-I521 HydrophobicContact CB-CG1 4.06Å; I519-I521 HydrophobicContact CG2-CG1 4.08Å
522	A	63.7	Low	65.4	Low	45 Å²	45	87.7 Å²	87.7	37%	0.372	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	123.8	173.7	0	0	0	0	0	109.2	D511 T524	D511-A522 PolarHBondContact N-O 2.72Å; D511-A522 PolarHBondContact O-N 3.17Å; A522-T524 PolarHBondContact O-N 3.42Å
523	D	59	Low	65.6	Low	113 Å²	113	93.5 Å²	93.5	60%	0.604	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	114.4	170.2	-152.8	-20.1	0	0	0	108.2	K525	D523-K525 PolarHBondContact O-N 2.85Å; D523-K525 PolarHBondContact OD1-N 2.65Å
524	T	55	Low	65.6	Low	64 Å²	64	93.5 Å²	93.5	39%	0.393	46%	0.463	S	S	.	.	S	Bend	trans	-74.3	-14.7	179.5	57.2	0	0	0	0	112.1	S508 E509 D511 A522 V526	S508-T524 PolarHBondContact O-OG1 3.36Å; S508-T524 VanDerWaalsContact O-OG1 3.12Å; E509-T524 WeakPolarHBondContact CA-OG1 3.2Å; E509-T524 PolarHBondContact O-N 3.45Å; E509-T524 PolarHBondContact O-OG1 3.45Å; D511-T524 HydrophobicContact CB-CG2 3.31Å; A522-T524 PolarHBondContact O-N 3.42Å; T524-V526 PolarHBondContact O-N 3.46Å
525	K	50.6	Low	65.8	Low	101 Å²	101	93.9 Å²	93.9	44%	0.439	47%	0.465	S	S	.	.			trans	-68	87.5	158.6	-75.3	-177.1	-173.6	160.9	0	107.1	E509 D523 A527	E509-K525 WeakPolarHBondContact OE1-CE 3.48Å; E509-K525 IonicContact OE1-NZ 3.99Å; E509-K525 PolarHBondContact OE1-NZ 2.86Å; D523-K525 PolarHBondContact O-N 2.85Å; D523-K525 PolarHBondContact OD1-N 2.65Å; K525-A527 PolarHBondContact O-N 3.4Å
526	V	48.3	Very low	66.2	Low	94 Å²	94	98 Å²	98	57%	0.57	47%	0.474	S	S	*	.			trans	-53.1	100.5	146.6	-171.1	0	0	0	0	104.2	T524 R528 R529	T524-V526 PolarHBondContact O-N 3.46Å; V526-R528 PolarHBondContact O-N 3Å; V526-R529 HydrophobicContact CG1-CG 3.62Å
527	A	46.5	Very low	66.5	Low	79 Å²	79	93.9 Å²	93.9	65%	0.653	46%	0.458	S	S	*	.			trans	-42.1	120.4	173.5	0	0	0	0	0	105.9	K525 R529	K525-A527 PolarHBondContact O-N 3.4Å; A527-R529 VanDerWaalsContact O-CA 3.31Å; A527-R529 WeakPolarHBondContact O-CA 3.5Å; A527-R529 PolarHBondContact O-N 3.16Å
528	R	52.5	Low	67	Low	220 Å²	220	94.9 Å²	94.9	83%	0.83	46%	0.462	S	S	*	.			trans	-35.2	105.3	-171.4	-160.7	-178.4	-155	174.1	4.9	106.6	V526 Y530	V526-R528 PolarHBondContact O-N 3Å; R528-Y530 VanDerWaalsContact C-N 3.26Å; R528-Y530 WeakPolarHBondContact O-CD2 3.14Å; R528-Y530 PolarHBondContact O-N 2.92Å
529	R	58	Low	67.7	Low	148 Å²	148	96.8 Å²	96.8	56%	0.558	47%	0.47	S	S	*	.			trans	-57.4	99.1	-165.6	-76.9	175.1	175.7	-179.6	2.5	106.2	V526 A527 G531 D532 F533	V526-R529 HydrophobicContact CG1-CG 3.62Å; A527-R529 VanDerWaalsContact O-CA 3.31Å; A527-R529 WeakPolarHBondContact O-CA 3.5Å; A527-R529 PolarHBondContact O-N 3.16Å; R529-G531 CarbonylContact O-C 3.59Å; R529-G531 PolarHBondContact O-N 3.37Å; R529-G531 VanDerWaalsContact O-N 3.16Å; R529-D532 HydrophobicContact CB-CB 3.83Å; R529-D532 VanDerWaalsContact CD-CG 3.46Å; R529-D532 WeakPolarHBondContact CD-OD2 3.18Å; R529-D532 IonicContact NE-OD2 3.75Å; R529-D532 IonicContact NH1-OD1 2.9Å; R529-D532 IonicContact NH1-OD2 3.33Å; R529-D532 PolarHBondContact NH1-OD2 2.88Å; R529-D532 PolarHBondContact O-N 3.25Å; R529-F533 PolarHBondContact O-N 2.95Å
530	Y	56.3	Low	68.1	Low	180 Å²	180	102.8 Å²	102.8	71%	0.706	50%	0.496	S	S	*	.	H	α-helix	trans	-55.3	-35.7	176	-84	-90.2	0	0	0	107	R528 F533 F534	R528-Y530 VanDerWaalsContact C-N 3.26Å; R528-Y530 WeakPolarHBondContact O-CD2 3.14Å; R528-Y530 PolarHBondContact O-N 2.92Å; Y530-F533 PolarHBondContact O-N 3.46Å; Y530-F534 WeakPolarHBondContact O-CB 3.28Å; Y530-F534 VanDerWaalsContact O-CD2 3.31Å; Y530-F534 WeakPolarHBondContact O-CD2 3.41Å; Y530-F534 PolarHBondContact O-N 2.88Å
531	G	66.1	Low	68.6	Low	41 Å²	41	107.6 Å²	107.6	42%	0.423	52%	0.516	S	S	.	.	H	α-helix	trans	-46.3	-59.2	164.8	0	0	0	0	0	114.2	R529 F533 F534 I535	R529-G531 CarbonylContact O-C 3.59Å; R529-G531 PolarHBondContact O-N 3.37Å; R529-G531 VanDerWaalsContact O-N 3.16Å; G531-F533 PolarHBondContact O-N 2.71Å; G531-F534 CarbonylContact O-C 3.59Å; G531-F534 PolarHBondContact O-N 3.37Å; G531-I535 VanDerWaalsContact O-CB 3.3Å; G531-I535 WeakPolarHBondContact O-CB 3.15Å; G531-I535 WeakPolarHBondContact O-CD1 3.31Å; G531-I535 WeakPolarHBondContact O-CG1 3.28Å; G531-I535 PolarHBondContact O-N 2.88Å
532	D	68.6	Low	69.4	Low	62 Å²	62	111 Å²	111	33%	0.332	53%	0.532	S	S	.	.	H	α-helix	trans	-68.8	-34.2	-176.5	-67.7	0	0	0	0	113	R529 R536	R529-D532 HydrophobicContact CB-CB 3.83Å; R529-D532 VanDerWaalsContact CD-CG 3.46Å; R529-D532 WeakPolarHBondContact CD-OD2 3.18Å; R529-D532 IonicContact NE-OD2 3.75Å; R529-D532 IonicContact NH1-OD1 2.9Å; R529-D532 IonicContact NH1-OD2 3.33Å; R529-D532 PolarHBondContact NH1-OD2 2.88Å; R529-D532 PolarHBondContact O-N 3.25Å; D532-R536 WeakPolarHBondContact O-CB 3.1Å; D532-R536 VanDerWaalsContact O-CG 3.31Å; D532-R536 WeakPolarHBondContact O-CG 3.27Å; D532-R536 PolarHBondContact O-N 3.36Å
533	F	73.3	Confident	70.5	Confident	131 Å²	131	115 Å²	115	58%	0.575	54%	0.543	S	S	*	.	H	α-helix	trans	-67.9	-44.3	173.6	-175.9	-94.7	0	0	0	111.2	R529 Y530 G531 R536 Q537	R529-F533 PolarHBondContact O-N 2.95Å; Y530-F533 PolarHBondContact O-N 3.46Å; G531-F533 PolarHBondContact O-N 2.71Å; F533-R536 PolarHBondContact O-N 2.98Å; F533-Q537 WeakPolarHBondContact O-CB 3.43Å; F533-Q537 PolarHBondContact O-N 3.08Å
534	F	77.5	Confident	71.7	Confident	128 Å²	128	114.9 Å²	114.9	56%	0.561	54%	0.542	S	S	*	.	H	α-helix	trans	-63.1	-44	173.6	-96.9	-88.4	0	0	0	111.4	Y530 G531 R536 Q537 I538	Y530-F534 WeakPolarHBondContact O-CB 3.28Å; Y530-F534 VanDerWaalsContact O-CD2 3.31Å; Y530-F534 WeakPolarHBondContact O-CD2 3.41Å; Y530-F534 PolarHBondContact O-N 2.88Å; G531-F534 CarbonylContact O-C 3.59Å; G531-F534 PolarHBondContact O-N 3.37Å; F534-R536 PolarHBondContact O-N 3.41Å; F534-Q537 CarbonylContact O-C 3.53Å; F534-Q537 PolarHBondContact O-N 3.46Å; F534-Q537 VanDerWaalsContact O-N 3.15Å; F534-I538 WeakPolarHBondContact O-CB 3.36Å; F534-I538 WeakPolarHBondContact O-CD1 3.36Å; F534-I538 WeakPolarHBondContact O-CG1 3.33Å; F534-I538 PolarHBondContact O-N 2.8Å
535	I	81.6	Confident	73.1	Confident	82 Å²	82	115.5 Å²	115.5	42%	0.421	54%	0.542	S	S	.	.	H	α-helix	trans	-62.2	-45	178.1	-71.4	165.6	0	0	0	110.1	G531 Q537 I538 H539	G531-I535 VanDerWaalsContact O-CB 3.3Å; G531-I535 WeakPolarHBondContact O-CB 3.15Å; G531-I535 WeakPolarHBondContact O-CD1 3.31Å; G531-I535 WeakPolarHBondContact O-CG1 3.28Å; G531-I535 PolarHBondContact O-N 2.88Å; I535-Q537 VanDerWaalsContact C-N 3.31Å; I535-Q537 PolarHBondContact O-N 3.3Å; I535-I538 PolarHBondContact O-N 3.48Å; I535-H539 WeakPolarHBondContact O-CB 3.45Å; I535-H539 PolarHBondContact O-CD2 2.91Å; I535-H539 VanDerWaalsContact O-CD2 3.29Å; I535-H539 VanDerWaalsContact O-CG 3.3Å; I535-H539 PolarHBondContact O-N 2.84Å
536	R	82.4	Confident	74.6	Confident	172 Å²	172	118.8 Å²	118.8	65%	0.649	55%	0.552	S	S	*	*	H	α-helix	trans	-62	-39.8	174.1	-75.4	-178	-151.2	-172	5	112.1	D532 F533 F534 K540	D532-R536 WeakPolarHBondContact O-CB 3.1Å; D532-R536 VanDerWaalsContact O-CG 3.31Å; D532-R536 WeakPolarHBondContact O-CG 3.27Å; D532-R536 PolarHBondContact O-N 3.36Å; F533-R536 PolarHBondContact O-N 2.98Å; F534-R536 PolarHBondContact O-N 3.41Å; R536-K540 WeakPolarHBondContact O-CB 3.41Å; R536-K540 WeakPolarHBondContact O-CG 3.31Å; R536-K540 PolarHBondContact O-N 3.18Å
537	Q	82.3	Confident	76.2	Confident	101 Å²	101	117.4 Å²	117.4	47%	0.472	54%	0.544	S	S	.	.	H	α-helix	trans	-70.7	-37.1	178.9	-157.8	67.8	2.3	0	0	111.7	F533 F534 I535 K540 F541	F533-Q537 WeakPolarHBondContact O-CB 3.43Å; F533-Q537 PolarHBondContact O-N 3.08Å; F534-Q537 CarbonylContact O-C 3.53Å; F534-Q537 PolarHBondContact O-N 3.46Å; F534-Q537 VanDerWaalsContact O-N 3.15Å; I535-Q537 VanDerWaalsContact C-N 3.31Å; I535-Q537 PolarHBondContact O-N 3.3Å; Q537-K540 PolarHBondContact O-N 3.08Å; Q537-F541 VanDerWaalsContact O-CB 3.29Å; Q537-F541 WeakPolarHBondContact O-CB 3.13Å; Q537-F541 PolarHBondContact O-N 3.41Å
538	I	85.3	Confident	77.6	Confident	83 Å²	83	119 Å²	119	43%	0.426	54%	0.541	S	S	.	.	H	α-helix	trans	-64	-47.4	172.9	-70.9	163.4	0	0	0	109.7	F534 I535 K540 F541 E542	F534-I538 WeakPolarHBondContact O-CB 3.36Å; F534-I538 WeakPolarHBondContact O-CD1 3.36Å; F534-I538 WeakPolarHBondContact O-CG1 3.33Å; F534-I538 PolarHBondContact O-N 2.8Å; I535-I538 PolarHBondContact O-N 3.48Å; I538-K540 VanDerWaalsContact C-N 3.34Å; I538-K540 PolarHBondContact O-N 2.95Å; I538-F541 CarbonylContact O-C 3.59Å; I538-F541 WeakPolarHBondContact O-CB 2.74Å; I538-F541 PolarHBondContact O-N 2.72Å; I538-F541 VanDerWaalsContact O-N 3.07Å; I538-E542 HydrophobicContact CG2-CG 4.37Å; I538-E542 WeakPolarHBondContact O-CB 3.11Å; I538-E542 WeakPolarHBondContact O-CG 3.26Å; I538-E542 PolarHBondContact O-N 3.02Å
539	H	88.7	Confident	78.8	Confident	114 Å²	114	114.8 Å²	114.8	53%	0.528	53%	0.529	S	S	.	.	H	α-helix	trans	-59.3	-45.1	176.5	-74.1	-166	0	0	0	111.3	I535 F541 E542 E543	I535-H539 WeakPolarHBondContact O-CB 3.45Å; I535-H539 PolarHBondContact O-CD2 2.91Å; I535-H539 VanDerWaalsContact O-CD2 3.29Å; I535-H539 VanDerWaalsContact O-CG 3.3Å; I535-H539 PolarHBondContact O-N 2.84Å; H539-F541 VanDerWaalsContact C-N 3.3Å; H539-F541 PolarHBondContact O-N 3.3Å; H539-E542 PolarHBondContact O-N 3.06Å; H539-E543 VanDerWaalsContact O-CB 3.27Å; H539-E543 WeakPolarHBondContact O-CB 3.32Å; H539-E543 PolarHBondContact O-N 2.85Å
540	K	86.8	Confident	79.6	Confident	126 Å²	126	115 Å²	115	55%	0.548	53%	0.534	S	S	.	.	H	α-helix	trans	-61.5	-38.2	173.8	-76.8	-177.8	178	-173.2	0	112.4	R536 Q537 I538 E543 L544	R536-K540 WeakPolarHBondContact O-CB 3.41Å; R536-K540 WeakPolarHBondContact O-CG 3.31Å; R536-K540 PolarHBondContact O-N 3.18Å; Q537-K540 PolarHBondContact O-N 3.08Å; I538-K540 VanDerWaalsContact C-N 3.34Å; I538-K540 PolarHBondContact O-N 2.95Å; K540-E543 PolarHBondContact O-N 3.49Å; K540-L544 WeakPolarHBondContact O-CB 3.2Å; K540-L544 PolarHBondContact O-N 3.38Å
541	F	87.3	Confident	80.1	Confident	147 Å²	147	112.6 Å²	112.6	65%	0.645	53%	0.53	S	S	*	.	H	α-helix	trans	-71.1	-39.8	179.1	-155.7	-90.2	0	0	0	111.8	Q537 I538 H539 L544 N545	Q537-F541 VanDerWaalsContact O-CB 3.29Å; Q537-F541 WeakPolarHBondContact O-CB 3.13Å; Q537-F541 PolarHBondContact O-N 3.41Å; I538-F541 CarbonylContact O-C 3.59Å; I538-F541 WeakPolarHBondContact O-CB 2.74Å; I538-F541 PolarHBondContact O-N 2.72Å; I538-F541 VanDerWaalsContact O-N 3.07Å; H539-F541 VanDerWaalsContact C-N 3.3Å; H539-F541 PolarHBondContact O-N 3.3Å; F541-L544 PolarHBondContact O-N 3.01Å; F541-N545 VanDerWaalsContact O-CB 3.26Å; F541-N545 WeakPolarHBondContact O-CB 3.35Å; F541-N545 PolarHBondContact O-N 3.04Å
542	E	87.6	Confident	79.9	Confident	100 Å²	100	113.5 Å²	113.5	47%	0.467	53%	0.534	S	S	.	.	H	α-helix	trans	-64.8	-39.4	172.8	-76.5	-172.6	167.5	0	0	111.8	I538 H539 N545 R546	I538-E542 HydrophobicContact CG2-CG 4.37Å; I538-E542 WeakPolarHBondContact O-CB 3.11Å; I538-E542 WeakPolarHBondContact O-CG 3.26Å; I538-E542 PolarHBondContact O-N 3.02Å; H539-E542 PolarHBondContact O-N 3.06Å; E542-N545 PolarHBondContact O-N 2.74Å; E542-R546 WeakPolarHBondContact O-CB 3.28Å; E542-R546 WeakPolarHBondContact O-CG 3.25Å; E542-R546 PolarHBondContact O-N 2.72Å
543	E	87.3	Confident	79.5	Confident	130 Å²	130	116 Å²	116	61%	0.607	55%	0.546	S	S	*	.	H	α-helix	trans	-67.5	-43.1	176.7	-164.4	169.4	-151.9	0	0	111.1	H539 K540 N545 R546 T547	H539-E543 VanDerWaalsContact O-CB 3.27Å; H539-E543 WeakPolarHBondContact O-CB 3.32Å; H539-E543 PolarHBondContact O-N 2.85Å; K540-E543 PolarHBondContact O-N 3.49Å; E543-N545 PolarHBondContact O-N 2.75Å; E543-R546 PolarHBondContact O-N 2.97Å; E543-T547 WeakPolarHBondContact O-CB 3.34Å; E543-T547 PolarHBondContact O-N 3.28Å; E543-T547 PolarHBondContact O-OG1 2.79Å
544	L	84.1	Confident	78.7	Confident	110 Å²	110	114 Å²	114	58%	0.576	55%	0.545	S	S	*	.	H	α-helix	trans	-57.8	-46.5	169	-93.3	160.7	0	0	0	111.5	K540 F541 R546 T547 L548	K540-L544 WeakPolarHBondContact O-CB 3.2Å; K540-L544 PolarHBondContact O-N 3.38Å; F541-L544 PolarHBondContact O-N 3.01Å; L544-R546 PolarHBondContact O-N 3.43Å; L544-T547 CarbonylContact O-C 3.56Å; L544-T547 WeakPolarHBondContact O-CB 3.27Å; L544-T547 PolarHBondContact O-N 3.44Å; L544-T547 VanDerWaalsContact O-N 3.14Å; L544-L548 WeakPolarHBondContact O-CB 3.42Å; L544-L548 PolarHBondContact O-N 3.3Å
545	N	83.4	Confident	77.5	Confident	76 Å²	76	109.8 Å²	109.8	41%	0.406	54%	0.538	S	S	.	.	H	α-helix	trans	-67	-37.3	-179.6	-162	6.8	0	0	0	112	F541 E542 E543 T547 L548 K549	F541-N545 VanDerWaalsContact O-CB 3.26Å; F541-N545 WeakPolarHBondContact O-CB 3.35Å; F541-N545 PolarHBondContact O-N 3.04Å; E542-N545 PolarHBondContact O-N 2.74Å; E543-N545 PolarHBondContact O-N 2.75Å; N545-T547 VanDerWaalsContact C-N 3.32Å; N545-L548 PolarHBondContact O-N 3.4Å; N545-K549 WeakPolarHBondContact O-CB 3.26Å; N545-K549 WeakPolarHBondContact O-CG 3.27Å; N545-K549 PolarHBondContact O-N 2.77Å
546	R	83.9	Confident	75.9	Confident	171 Å²	171	110.3 Å²	110.3	65%	0.645	55%	0.545	S	S	*	.	H	α-helix	trans	-62.5	-40.8	170.3	-77.3	178.8	-172.6	-171.8	4	111.2	E542 E543 L544 K549 K550	E542-R546 WeakPolarHBondContact O-CB 3.28Å; E542-R546 WeakPolarHBondContact O-CG 3.25Å; E542-R546 PolarHBondContact O-N 2.72Å; E543-R546 PolarHBondContact O-N 2.97Å; L544-R546 PolarHBondContact O-N 3.43Å; R546-K549 PolarHBondContact O-N 2.72Å; R546-K550 WeakPolarHBondContact O-CB 3.38Å; R546-K550 WeakPolarHBondContact O-CG 3.5Å; R546-K550 PolarHBondContact O-N 3Å
547	T	81.1	Confident	74.2	Confident	65 Å²	65	106.7 Å²	106.7	40%	0.399	54%	0.542	S	S	.	.	H	α-helix	trans	-67.1	-41.9	177.9	-50.4	0	0	0	0	111.2	E543 L544 N545 K550 M551	E543-T547 WeakPolarHBondContact O-CB 3.34Å; E543-T547 PolarHBondContact O-N 3.28Å; E543-T547 PolarHBondContact O-OG1 2.79Å; L544-T547 CarbonylContact O-C 3.56Å; L544-T547 WeakPolarHBondContact O-CB 3.27Å; L544-T547 PolarHBondContact O-N 3.44Å; L544-T547 VanDerWaalsContact O-N 3.14Å; N545-T547 VanDerWaalsContact C-N 3.32Å; T547-K550 WeakPolarHBondContact O-CB 3.32Å; T547-K550 PolarHBondContact O-N 3.45Å; T547-M551 HydrophobicContact CG2-CE 4.5Å; T547-M551 WeakPolarHBondContact O-CG 3.44Å; T547-M551 PolarHBondContact O-N 3.12Å
548	L	76.4	Confident	72.4	Confident	112 Å²	112	107 Å²	107	59%	0.586	55%	0.551	S	S	*	*	H	α-helix	trans	-64.3	-42.5	175.6	-123.8	153.3	0	0	0	111.8	L544 N545 M551 A552	L544-L548 WeakPolarHBondContact O-CB 3.42Å; L544-L548 PolarHBondContact O-N 3.3Å; N545-L548 PolarHBondContact O-N 3.4Å; L548-M551 PolarHBondContact O-N 2.85Å; L548-A552 WeakPolarHBondContact O-CB 3.46Å; L548-A552 PolarHBondContact O-N 3.3Å
549	K	77.1	Confident	70.3	Confident	131 Å²	131	106.9 Å²	106.9	57%	0.57	56%	0.562	S	S	*	*	H	α-helix	trans	-63	-41.8	172.6	-76.2	-178.7	-179.5	-176.5	0	111.9	N545 R546 M551 A552 I553	N545-K549 WeakPolarHBondContact O-CB 3.26Å; N545-K549 WeakPolarHBondContact O-CG 3.27Å; N545-K549 PolarHBondContact O-N 2.77Å; R546-K549 PolarHBondContact O-N 2.72Å; K549-M551 VanDerWaalsContact C-N 3.34Å; K549-M551 PolarHBondContact O-N 3.01Å; K549-A552 PolarHBondContact O-N 3.38Å; K549-I553 WeakPolarHBondContact O-CD1 3.36Å; K549-I553 WeakPolarHBondContact O-CG1 3.45Å; K549-I553 PolarHBondContact O-N 3.49Å; K549-I553 VanDerWaalsContact O-N 3.1Å
550	K	75.1	Confident	68.1	Low	153 Å²	153	107 Å²	107	67%	0.665	57%	0.571	S	S	*	*	H	α-helix	trans	-60.9	-42.7	173.5	-75.9	-179.3	-177.5	-175.9	0	111.6	R546 T547 I553 T554	R546-K550 WeakPolarHBondContact O-CB 3.38Å; R546-K550 WeakPolarHBondContact O-CG 3.5Å; R546-K550 PolarHBondContact O-N 3Å; T547-K550 WeakPolarHBondContact O-CB 3.32Å; T547-K550 PolarHBondContact O-N 3.45Å; K550-I553 PolarHBondContact O-N 2.79Å; K550-T554 PolarHBondContact O-N 3.09Å; K550-T554 VanDerWaalsContact O-N 3.14Å; K550-T554 PolarHBondContact O-OG1 3.2Å
551	M	66.7	Low	65.9	Low	129 Å²	129	104.1 Å²	104.1	64%	0.635	58%	0.577	S	S	*	*	H	α-helix	trans	-65.6	-37.7	175.7	-76.9	-180	169.8	0	0	113.3	T547 L548 K549 I553 T554 G555	T547-M551 HydrophobicContact CG2-CE 4.5Å; T547-M551 WeakPolarHBondContact O-CG 3.44Å; T547-M551 PolarHBondContact O-N 3.12Å; L548-M551 PolarHBondContact O-N 2.85Å; K549-M551 VanDerWaalsContact C-N 3.34Å; K549-M551 PolarHBondContact O-N 3.01Å; M551-I553 VanDerWaalsContact C-N 3.29Å; M551-I553 PolarHBondContact O-N 3.13Å; M551-T554 WeakPolarHBondContact CA-OG1 3.26Å; M551-T554 PolarHBondContact O-N 2.81Å; M551-T554 PolarHBondContact O-OG1 3.15Å; M551-G555 PolarHBondContact O-N 3.32Å
552	A	61.8	Low	63.7	Low	60 Å²	60	103.4 Å²	103.4	50%	0.496	59%	0.585	S	S	.	*	H	α-helix	trans	-66.2	-32.8	175.9	0	0	0	0	0	112.3	L548 K549 T556	L548-A552 WeakPolarHBondContact O-CB 3.46Å; L548-A552 PolarHBondContact O-N 3.3Å; K549-A552 PolarHBondContact O-N 3.38Å; A552-T556 PolarHBondContact O-N 3.31Å; A552-T556 PolarHBondContact O-OG1 2.91Å
553	I	59.8	Low	61.6	Low	116 Å²	116	102.7 Å²	102.7	60%	0.595	60%	0.596	S	S	*	*	H	α-helix	trans	-72.3	-36.9	175.4	-64.5	162.4	0	0	0	111.1	K549 K550 M551 T556 T557	K549-I553 WeakPolarHBondContact O-CD1 3.36Å; K549-I553 WeakPolarHBondContact O-CG1 3.45Å; K549-I553 PolarHBondContact O-N 3.49Å; K549-I553 VanDerWaalsContact O-N 3.1Å; K550-I553 PolarHBondContact O-N 2.79Å; M551-I553 VanDerWaalsContact C-N 3.29Å; M551-I553 PolarHBondContact O-N 3.13Å; I553-T556 PolarHBondContact O-OG1 3.42Å; I553-T557 PolarHBondContact O-OG1 2.67Å
554	T	55.8	Low	59.2	Low	88 Å²	88	103.2 Å²	103.2	54%	0.54	61%	0.608	S	S	.	*	H	α-helix	trans	-74.3	-29.1	173	20.1	0	0	0	0	113.7	K550 M551 T557 T558	K550-T554 PolarHBondContact O-N 3.09Å; K550-T554 VanDerWaalsContact O-N 3.14Å; K550-T554 PolarHBondContact O-OG1 3.2Å; M551-T554 WeakPolarHBondContact CA-OG1 3.26Å; M551-T554 PolarHBondContact O-N 2.81Å; M551-T554 PolarHBondContact O-OG1 3.15Å; T554-T557 PolarHBondContact O-OG1 3.19Å; T554-T558 PolarHBondContact O-OG1 2.98Å
555	G	52.3	Low	56.7	Low	40 Å²	40	103.8 Å²	103.8	41%	0.412	62%	0.621	S	S	.	*	H	α-helix	trans	-74	-25.1	175.8	0	0	0	0	0	114.5	M551 T558	M551-G555 PolarHBondContact O-N 3.32Å; G555-T558 PolarHBondContact O-OG1 2.95Å
556	T	48.3	Very low	54.4	Low	93 Å²	93	115.5 Å²	115.5	57%	0.571	66%	0.66	S	S	*	*	H	α-helix	trans	-83.2	-23.3	175.9	30.4	0	0	0	0	113.1	A552 I553 T560	A552-T556 PolarHBondContact O-N 3.31Å; A552-T556 PolarHBondContact O-OG1 2.91Å; I553-T556 PolarHBondContact O-OG1 3.42Å; T556-T560 PolarHBondContact O-OG1 3.15Å; T556-T560 VanDerWaalsContact O-OG1 3.08Å
557	T	47.2	Very low	53	Low	95 Å²	95	112.8 Å²	112.8	58%	0.583	66%	0.661	S	S	*	*	H	α-helix	trans	-78.2	-27	174.3	14.4	0	0	0	0	113.1	I553 T554	I553-T557 PolarHBondContact O-OG1 2.67Å; T554-T557 PolarHBondContact O-OG1 3.19Å
558	T	44.1	Very low	51.5	Low	109 Å²	109	115.3 Å²	115.3	67%	0.669	67%	0.674	S	S	*	*	H	α-helix	trans	-81.8	-26.3	177	49.1	0	0	0	0	113.8	T554 G555	T554-T558 PolarHBondContact O-OG1 2.98Å; G555-T558 PolarHBondContact O-OG1 2.95Å
559	A	42.3	Very low	50.1	Low	79 Å²	79	115.4 Å²	115.4	65%	0.653	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-14.2	179.6	0	0	0	0	0	114.5
560	T	42.1	Very low	48.5	Very low	117 Å²	117	114.5 Å²	114.5	72%	0.718	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	0.7	-177.4	43.1	0	0	0	0	114.1	T556	T556-T560 PolarHBondContact O-OG1 3.15Å; T556-T560 VanDerWaalsContact O-OG1 3.08Å
561	G	41.2	Very low	46.8	Very low	65 Å²	65	112.1 Å²	112.1	67%	0.67	69%	0.687	S	S	*	*	S	Bend	trans	-97.1	-4.2	-174.3	0	0	0	0	0	117.6
562	T	39.9	Very low	45.5	Very low	133 Å²	133	111 Å²	111	82%	0.816	69%	0.69	S	S	*	*	S	Bend	trans	-117.7	25.2	-173.5	52.2	0	0	0	0	115.1
563	A	42.9	Very low	44.4	Very low	84 Å²	84	114.6 Å²	114.6	69%	0.694	70%	0.704	S	S	*	*	S	Bend	trans	-136.2	73.5	170.7	0	0	0	0	0	110.4
564	T	37.3	Very low	43.2	Very low	142 Å²	142	114.5 Å²	114.5	87%	0.871	71%	0.713	S	S	*	*			trans	168	96.6	145.6	30.3	0	0	0	0	110.9
565	S	33.1	Very low	42.1	Very low	122 Å²	122	116.8 Å²	116.8	85%	0.853	73%	0.727	S	S	*	*				174.2	115.4	129.7	43	0	0	0	0	112.3
566	R	34.7	Very low	41.2	Very low	322 Å²	322	123.7 Å²	123.7	100%	1.215	76%	0.756	S	S	*	*			trans	70.3	0	161.6	-74.2	-176.5	174.6	170.8	-0.7	119.8

Retrieved 566 of 566 residues in 1573.2 ms (Link to these results)

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