A0A087Y6F5_POEFO Loading...

Mitochondrial import inner membrane translocase subunit TIM44

Essential component of the PAM complex, a complex required for the translocation of transit peptide-containing proteins from the inner membrane into the mitochondrial matrix in an ATP-dependent manner. Recruits mitochondrial HSP70 to drive protein translocation into the matrix using ATP as an energy source.

AlphaFold DB , UniProt , Accession A0A087Y6F5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 458 aa.

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(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	C	33.5	Very low	32.1	Very low	172 Å²	172	139.7 Å²	139.7	100%	1.162	82%	0.824	S	S	*	*				0	100.2	0	-63.9	0	0	0	0	109.6
2	T	31.3	Very low	31.8	Very low	132 Å²	132	142.4 Å²	142.4	81%	0.81	82%	0.822	S	S	*	*				31	126.7	129.5	54.9	0	0	0	0	116.9
3	V	29.1	Very low	31.5	Very low	142 Å²	142	139.7 Å²	139.7	86%	0.861	81%	0.814	S	S	*	*				-165.9	148	50.9	170.7	0	0	0	0	111.4
4	F	31.2	Very low	31.5	Very low	176 Å²	176	143.9 Å²	143.9	77%	0.772	81%	0.812	S	S	*	*			trans	-70.2	154.3	171.5	-103.3	-101.3	0	0	0	116.9
5	K	28	Very low	31.4	Very low	182 Å²	182	144.6 Å²	144.6	79%	0.791	81%	0.806	S	S	*	*				161.4	118.1	123.6	-93.7	177.1	173.2	175.9	0	111.4
6	M	28.9	Very low	31.6	Very low	165 Å²	165	146.4 Å²	146.4	81%	0.813	81%	0.811	S	S	*	*				62.7	134.2	91.7	-74.6	-173.1	-169.1	0	0	113.5
7	A	26.8	Very low	31.5	Very low	97 Å²	97	144.8 Å²	144.8	80%	0.802	81%	0.811	S	S	*	*			cis	-164.7	163.6	21.3	0	0	0	0	0	112
8	A	33.6	Very low	31.4	Very low	92 Å²	92	146.2 Å²	146.2	76%	0.76	82%	0.815	S	S	*	*			trans	-83.1	-159.6	163.3	0	0	0	0	0	110.6
9	P	53.8	Low	31.3	Very low	111 Å²	111	151.7 Å²	151.7	72%	0.721	82%	0.822	S	S	*	*			cis	-144.1	-171.9	-5.7	37.8	-14.8	0	0	0	115.5
10	L	29.5	Very low	31.3	Very low	160 Å²	160	156.8 Å²	156.8	84%	0.838	83%	0.829	S	S	*	*			trans	160.7	111.1	137.8	-83.8	165	0	0	0	111.2
11	C	27	Very low	31.1	Very low	108 Å²	108	153.3 Å²	153.3	73%	0.73	83%	0.83	S	S	*	*				69.4	120.8	97	-119.7	0	0	0	0	113.9
12	Q	29.3	Very low	31	Very low	172 Å²	172	153.1 Å²	153.1	80%	0.804	82%	0.817	S	S	*	*				-175.7	135.7	63.7	-101.9	169.4	-26	0	0	108.7
13	C	28.1	Very low	31	Very low	107 Å²	107	153.2 Å²	153.2	72%	0.723	82%	0.817	S	S	*	*				58.6	139.5	102.8	-61.5	0	0	0	0	115.8
14	Y	30.5	Very low	31	Very low	198 Å²	198	150.7 Å²	150.7	78%	0.776	81%	0.811	S	S	*	*			cis	-168.7	171.7	6.7	-136.3	-106.2	0	0	0	109.8
15	Q	31.2	Very low	31.1	Very low	155 Å²	155	147.8 Å²	147.8	72%	0.724	81%	0.813	S	S	*	*			trans	-38.2	149.9	179.5	-69.6	166.4	-36.5	0	0	120.4
16	I	33.8	Very low	31.8	Very low	174 Å²	174	145.2 Å²	145.2	89%	0.892	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-99.1	125.4	161.7	-69.9	168.9	0	0	0	109.6
17	C	29.2	Very low	31.9	Very low	119 Å²	119	142 Å²	142	80%	0.804	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-87.7	142.7	-178.3	-96.9	0	0	0	0	113.7
18	L	31.3	Very low	31.9	Very low	170 Å²	170	142.6 Å²	142.6	89%	0.89	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-67.3	140.4	158.4	-83.3	140.3	0	0	0	111.9
19	R	29	Very low	31.8	Very low	251 Å²	251	147 Å²	147	95%	0.947	80%	0.804	S	S	*	*			trans	-166.6	143.4	135	-117.1	-178.4	-176.6	-160.8	1.9	115.3
20	R	31.1	Very low	30.8	Very low	252 Å²	252	148.5 Å²	148.5	95%	0.951	81%	0.805	S	S	*	*			trans	-53.8	153.5	171.1	-77.1	165.8	163.2	176.8	-5.1	114.9
21	G	27.2	Very low	30.9	Very low	84 Å²	84	149 Å²	149	87%	0.866	81%	0.807	S	S	*	*			trans	-168.2	125.6	155.1	0	0	0	0	0	111.4
22	L	31	Very low	31.2	Very low	168 Å²	168	151.5 Å²	151.5	88%	0.88	81%	0.813	S	S	*	*			trans	-109.6	160.3	-171.1	-118.4	158.3	0	0	0	109.1
23	V	31.1	Very low	32.1	Very low	134 Å²	134	148.1 Å²	148.1	81%	0.812	81%	0.806	S	S	*	*			trans	102.1	127.6	151.7	-166.3	0	0	0	0	119.9
24	A	30.1	Very low	32.1	Very low	90 Å²	90	150.1 Å²	150.1	74%	0.744	81%	0.809	S	S	*	*			trans	88.8	107.9	146	0	0	0	0	0	121.9
25	S	32.6	Very low	32	Very low	114 Å²	114	151.9 Å²	151.9	80%	0.797	82%	0.815	S	S	*	*			trans	-73.4	163.4	137.3	-42.8	0	0	0	0	110.4
26	P	43.7	Very low	32.1	Very low	129 Å²	129	150.2 Å²	150.2	84%	0.838	82%	0.815	S	S	*	*				-144.8	166.1	91.2	33.8	-14.7	0	0	0	116.6
27	S	29.3	Very low	32.2	Very low	96 Å²	96	149.2 Å²	149.2	67%	0.671	81%	0.806	S	S	*	*			trans	-46.1	151.7	171.8	-178.7	0	0	0	0	117.2
28	C	26.6	Very low	32.4	Very low	111 Å²	111	149.4 Å²	149.4	75%	0.75	80%	0.804	S	S	*	*			trans	-172.9	115.5	130.9	-102	0	0	0	0	114.1
29	Y	31.6	Very low	32.6	Very low	184 Å²	184	151.1 Å²	151.1	72%	0.722	80%	0.8	S	S	*	*			trans	44.1	121.8	139.7	-55.9	-75	0	0	0	125.5
30	L	33.4	Very low	32.6	Very low	143 Å²	143	150 Å²	150	75%	0.749	80%	0.795	S	S	*	*				42.4	126.2	122.7	-58.3	170	0	0	0	121.4
31	L	31.3	Very low	32.7	Very low	169 Å²	169	145.9 Å²	145.9	89%	0.885	79%	0.791	S	S	*	*				154.9	125	112.3	-77.7	177.9	0	0	0	112.8
32	L	33	Very low	32.8	Very low	162 Å²	162	148 Å²	148	85%	0.848	79%	0.791	S	S	*	*			trans	-81.2	178.7	157.5	-86.9	159.6	0	0	0	109.6
33	P	48.3	Very low	32.6	Very low	100 Å²	100	143.8 Å²	143.8	65%	0.649	79%	0.788	S	S	*	*			cis	-139.5	-168.8	-11.9	26	-0.3	0	0	0	114.7
34	N	28.2	Very low	32.6	Very low	150 Å²	150	145.3 Å²	145.3	80%	0.802	79%	0.79	S	S	*	*			trans	85.1	111.7	151.1	-84.9	-16.7	0	0	0	120.9
35	R	29.8	Very low	33.3	Very low	235 Å²	235	146.3 Å²	146.3	89%	0.887	79%	0.79	S	S	*	*				-169.3	136	110.6	-121.3	-179.2	175.4	-177.2	-1	114.3
36	T	33.1	Very low	33.3	Very low	120 Å²	120	146.1 Å²	146.1	74%	0.736	79%	0.788	S	S	*	*			trans	-68.1	144.4	167.3	46.7	0	0	0	0	113
37	H	34.4	Very low	32.6	Very low	153 Å²	153	151.2 Å²	151.2	71%	0.708	79%	0.791	S	S	*	*			trans	-150.1	119.5	148.7	-114.6	-78.2	0	0	0	111.8	Y39	H37-Y39 AromaticContact CE1-CE2 3.82Å; H37-Y39 AromaticContact ND1-CD2 3.95Å; H37-Y39 AromaticContact ND1-CE2 3.45Å; H37-Y39 WeakPolarHBondContact ND1-CE2 3.5Å
38	V	34.1	Very low	32.7	Very low	123 Å²	123	152.5 Å²	152.5	75%	0.745	80%	0.8	S	S	*	*			trans	-89.6	134.9	168.1	169.8	0	0	0	0	107.6
39	Y	35.7	Very low	33.2	Very low	205 Å²	205	152 Å²	152	80%	0.804	80%	0.798	S	S	*	*			trans	-143	133.1	148.8	-84.3	-74.4	0	0	0	110.7	H37	H37-Y39 AromaticContact CE1-CE2 3.82Å; H37-Y39 AromaticContact ND1-CD2 3.95Å; H37-Y39 AromaticContact ND1-CE2 3.45Å; H37-Y39 WeakPolarHBondContact ND1-CE2 3.5Å
40	R	29.3	Very low	33.1	Very low	228 Å²	228	152.6 Å²	152.6	86%	0.86	81%	0.807	S	S	*	*			trans	-108.3	141	176.3	-176.5	-167.2	-120.2	-170.6	1.5	106
41	I	33.1	Very low	33.1	Very low	166 Å²	166	151.5 Å²	151.5	85%	0.851	81%	0.806	S	S	*	*			trans	-170.3	121.2	139.5	-89	145.7	0	0	0	110.7
42	C	28.3	Very low	32.9	Very low	129 Å²	129	154.4 Å²	154.4	87%	0.872	81%	0.805	S	S	*	*			trans	16.8	133.8	141.1	-128.2	0	0	0	0	123.3
43	G	28	Very low	32.9	Very low	79 Å²	79	157 Å²	157	81%	0.814	81%	0.805	S	S	*	*			trans	177.4	106.1	152.9	0	0	0	0	0	113.5
44	L	30.7	Very low	32.3	Very low	165 Å²	165	160.5 Å²	160.5	86%	0.864	82%	0.815	S	S	*	*			trans	-102.7	168.6	160.8	-104.7	115.2	0	0	0	108
45	P	45.6	Very low	32.5	Very low	112 Å²	112	159 Å²	159	73%	0.727	82%	0.816	S	S	*	*			cis	-140.5	164.9	27.7	33.9	-10.1	0	0	0	116.1
46	S	30.8	Very low	32.7	Very low	110 Å²	110	151.6 Å²	151.6	77%	0.769	81%	0.813	S	S	*	*				-177.4	118.9	97.7	40.8	0	0	0	0	113.1
47	R	30.7	Very low	32.6	Very low	235 Å²	235	152 Å²	152	89%	0.887	81%	0.81	S	S	*	*			trans	37.5	109.8	132.3	-137.5	177.1	-171.3	-169.7	2.4	119.8
48	S	30.7	Very low	32.6	Very low	123 Å²	123	153.1 Å²	153.1	86%	0.86	81%	0.813	S	S	*	*			trans	-146.7	131.5	130.2	63.6	0	0	0	0	110.3
49	S	36.2	Very low	33	Very low	102 Å²	102	151 Å²	151	71%	0.713	82%	0.816	S	S	*	*			trans	-80.8	127	-174.1	-50	0	0	0	0	110.4
50	Q	29.7	Very low	33.1	Very low	196 Å²	196	152 Å²	152	92%	0.916	82%	0.819	S	S	*	*			trans	-140	135.1	152.2	-86.8	-169	-8.1	0	0	111.9
51	V	33.7	Very low	33.5	Very low	119 Å²	119	144.6 Å²	144.6	72%	0.721	81%	0.813	S	S	*	*			trans	-70.9	136.2	-169.7	172.2	0	0	0	0	110.4	Y53	V51-Y53 HydrophobicContact CG1-CD2 3.59Å; V51-Y53 HydrophobicContact CG1-CE2 3.62Å
52	R	28.6	Very low	34.2	Very low	230 Å²	230	148.7 Å²	148.7	87%	0.868	82%	0.818	S	S	*	*			trans	-98.6	113.9	173	-150.5	-174.1	-71.4	170.4	-3.8	107.8
53	Y	31.1	Very low	35.3	Very low	217 Å²	217	150.4 Å²	150.4	85%	0.851	81%	0.81	S	S	*	*			trans	-109	124.2	160.7	-88.4	-80.3	0	0	0	108.7	V51	V51-Y53 HydrophobicContact CG1-CD2 3.59Å; V51-Y53 HydrophobicContact CG1-CE2 3.62Å
54	M	36.1	Very low	36.4	Very low	174 Å²	174	149 Å²	149	86%	0.857	80%	0.796	S	S	*	*			trans	-114.9	122	164	-76.1	-148.1	76.4	0	0	109.6
55	S	33.5	Very low	37.5	Very low	118 Å²	118	150.1 Å²	150.1	83%	0.825	79%	0.794	S	S	*	*			trans	175.5	121.2	145.9	62.5	0	0	0	0	105.2
56	G	33.5	Very low	38.2	Very low	79 Å²	79	151.5 Å²	151.5	81%	0.814	79%	0.794	S	S	*	*			cis	111	102.3	47.3	0	0	0	0	0	107.2
57	D	30.7	Very low	39.7	Very low	129 Å²	129	147.5 Å²	147.5	69%	0.69	77%	0.771	S	S	*	*			trans	142	132.3	141.5	-153.7	21.2	0	0	0	115.4
58	K	33.9	Very low	41.3	Very low	176 Å²	176	143.3 Å²	143.3	77%	0.765	76%	0.761	S	S	*	*			trans	56.8	103	161.3	-79.1	154.8	-162.7	147	0	122.8
59	G	43.3	Very low	43.1	Very low	79 Å²	79	144 Å²	144	81%	0.814	75%	0.749	S	S	*	*				69.6	85.1	114.4	0	0	0	0	0	118.8
60	R	37.2	Very low	44.9	Very low	227 Å²	227	144.8 Å²	144.8	86%	0.857	74%	0.744	S	S	*	*			trans	-157.8	111.5	148.6	-127.3	175.8	-169.7	-145.8	3.5	110.7
61	G	38.6	Very low	46.7	Very low	71 Å²	71	139.5 Å²	139.5	73%	0.732	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-58.1	139.3	172.7	0	0	0	0	0	111	K63	G61-K63 PolarHBondContact O-N 3.34Å
62	R	46.6	Very low	48.6	Very low	253 Å²	253	138.2 Å²	138.2	96%	0.955	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-46.8	120.7	166.1	-92.2	174.2	161.3	172.3	-6.1	109.3	G64	R62-G64 PolarHBondContact O-N 3.37Å
63	K	51.3	Low	50.5	Low	165 Å²	165	131.1 Å²	131.1	72%	0.717	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-66.8	122.1	167	-70.6	-176.5	171.7	-167.8	0	108.1	G61	G61-K63 PolarHBondContact O-N 3.34Å
64	G	51.5	Low	52.1	Low	49 Å²	49	127.5 Å²	127.5	51%	0.505	68%	0.679	S	S	.	*	P	Polyproline II helix	trans	-86.3	165.7	174.8	0	0	0	0	0	112.6	R62 L66 G67	R62-G64 PolarHBondContact O-N 3.37Å; G64-L66 PolarHBondContact O-N 3.45Å; G64-G67 PolarHBondContact O-N 3.01Å
65	F	54	Low	53.4	Low	188 Å²	188	124.6 Å²	124.6	83%	0.825	66%	0.663	S	S	*	*	H	α-helix	trans	-44.9	-31.1	-178.3	-94	-98.4	0	0	0	115.8	G67 F69	F65-G67 VanDerWaalsContact C-N 3.32Å; F65-G67 PolarHBondContact O-N 3.4Å; F65-F69 PolarHBondContact O-N 3.49Å
66	L	61.3	Low	54.4	Low	141 Å²	141	125 Å²	125	74%	0.738	65%	0.652	S	S	*	*	H	α-helix	trans	-71.4	-26.1	178.1	-64.2	174.4	0	0	0	113.2	G64 F69 L70	G64-L66 PolarHBondContact O-N 3.45Å; L66-F69 PolarHBondContact O-N 3.42Å; L66-L70 WeakPolarHBondContact O-CB 3.39Å; L66-L70 PolarHBondContact O-N 3.42Å
67	G	61.9	Low	55.6	Low	27 Å²	27	126 Å²	126	28%	0.278	64%	0.638	S	S	.	*	H	α-helix	trans	-70.7	-39.4	177.2	0	0	0	0	0	112.3	G64 F65 L70 D71	G64-G67 PolarHBondContact O-N 3.01Å; F65-G67 VanDerWaalsContact C-N 3.32Å; F65-G67 PolarHBondContact O-N 3.4Å; G67-L70 PolarHBondContact O-N 3.41Å; G67-D71 WeakPolarHBondContact O-CB 3.15Å; G67-D71 PolarHBondContact O-N 3.46Å
68	E	64.8	Low	57	Low	146 Å²	146	125.8 Å²	125.8	68%	0.682	64%	0.638	S	S	*	*	H	α-helix	trans	-67.1	-37.4	173.3	-97	176.2	158.3	0	0	111.8	D71 N72	E68-D71 PolarHBondContact O-N 3.48Å; E68-N72 WeakPolarHBondContact O-CB 3.19Å; E68-N72 PolarHBondContact O-N 3.36Å
69	F	68	Low	58.1	Low	139 Å²	139	124.2 Å²	124.2	61%	0.61	63%	0.631	S	S	*	*	H	α-helix	trans	-66.3	-44	175.6	-161.5	-97.7	0	0	0	112.1	F65 L66 N72 L73	F65-F69 PolarHBondContact O-N 3.49Å; L66-F69 PolarHBondContact O-N 3.42Å; F69-N72 PolarHBondContact O-N 3.43Å; F69-L73 HydrophobicContact CD1-CD1 4.31Å; F69-L73 HydrophobicContact CE1-CD1 3.92Å; F69-L73 WeakPolarHBondContact O-CB 3.24Å; F69-L73 PolarHBondContact O-N 3.42Å
70	L	73.4	Confident	58.7	Low	117 Å²	117	124.8 Å²	124.8	61%	0.613	62%	0.615	S	S	*	*	H	α-helix	trans	-63.2	-40.7	174.8	-90.1	164.1	0	0	0	112.4	L66 G67 N72 L73 K74	L66-L70 WeakPolarHBondContact O-CB 3.39Å; L66-L70 PolarHBondContact O-N 3.42Å; G67-L70 PolarHBondContact O-N 3.41Å; L70-N72 VanDerWaalsContact C-N 3.31Å; L70-L73 PolarHBondContact O-N 3.42Å; L70-K74 WeakPolarHBondContact O-CB 3.47Å; L70-K74 PolarHBondContact O-N 3.43Å
71	D	67.7	Low	60	Low	86 Å²	86	121.7 Å²	121.7	46%	0.46	61%	0.608	S	S	.	*	H	α-helix	trans	-67.6	-34.6	177.9	-77.2	-22.5	0	0	0	111.2	G67 E68 Q75	G67-D71 WeakPolarHBondContact O-CB 3.15Å; G67-D71 PolarHBondContact O-N 3.46Å; E68-D71 PolarHBondContact O-N 3.48Å; D71-Q75 WeakPolarHBondContact O-CB 3.24Å; D71-Q75 WeakPolarHBondContact O-CG 3.39Å; D71-Q75 PolarHBondContact O-N 3.42Å
72	N	74.2	Confident	60.9	Low	91 Å²	91	125.1 Å²	125.1	49%	0.487	61%	0.605	S	S	.	*	H	α-helix	trans	-71.7	-43.7	175.7	-148.2	-11.7	0	0	0	111.9	E68 F69 L70 K74 Q75 E76	E68-N72 WeakPolarHBondContact O-CB 3.19Å; E68-N72 PolarHBondContact O-N 3.36Å; F69-N72 PolarHBondContact O-N 3.43Å; L70-N72 VanDerWaalsContact C-N 3.31Å; N72-K74 VanDerWaalsContact C-N 3.33Å; N72-K74 PolarHBondContact O-N 3.26Å; N72-Q75 WeakPolarHBondContact O-CB 3.44Å; N72-Q75 PolarHBondContact O-N 3.19Å; N72-Q75 VanDerWaalsContact O-N 3.13Å; N72-E76 WeakPolarHBondContact O-CG 3.43Å; N72-E76 PolarHBondContact O-N 2.81Å
73	L	67.6	Low	61.4	Low	82 Å²	82	117.2 Å²	117.2	43%	0.429	58%	0.58	S	S	.	*	H	α-helix	trans	-64.2	-38	175.8	-138.3	166.8	0	0	0	111.6	F69 L70 Q75 E76 L77	F69-L73 HydrophobicContact CD1-CD1 4.31Å; F69-L73 HydrophobicContact CE1-CD1 3.92Å; F69-L73 WeakPolarHBondContact O-CB 3.24Å; F69-L73 PolarHBondContact O-N 3.42Å; L70-L73 PolarHBondContact O-N 3.42Å; L73-Q75 VanDerWaalsContact C-N 3.34Å; L73-E76 PolarHBondContact O-N 3.36Å; L73-L77 HydrophobicContact CD2-CD1 4.03Å; L73-L77 HydrophobicContact CD2-CG 4.22Å; L73-L77 WeakPolarHBondContact O-CB 3.17Å; L73-L77 WeakPolarHBondContact O-CG 3.32Å; L73-L77 PolarHBondContact O-N 3.49Å
74	K	64.7	Low	62	Low	140 Å²	140	116.3 Å²	116.3	61%	0.609	58%	0.576	S	S	*	*	H	α-helix	trans	-70.1	-31.2	174.8	-164.6	174.6	-173.3	177.8	0	112.2	L70 N72 N78	L70-K74 WeakPolarHBondContact O-CB 3.47Å; L70-K74 PolarHBondContact O-N 3.43Å; N72-K74 VanDerWaalsContact C-N 3.33Å; N72-K74 PolarHBondContact O-N 3.26Å; K74-N78 PolarHBondContact O-N 2.66Å; K74-N78 PolarHBondContact O-ND2 2.88Å
75	Q	64.3	Low	63.3	Low	113 Å²	113	119.3 Å²	119.3	53%	0.528	58%	0.577	S	S	.	*	H	α-helix	trans	-72.2	-38.7	171.2	-84	-172	0.9	0	0	112.3	D71 N72 L73 N78 K79	D71-Q75 WeakPolarHBondContact O-CB 3.24Å; D71-Q75 WeakPolarHBondContact O-CG 3.39Å; D71-Q75 PolarHBondContact O-N 3.42Å; N72-Q75 WeakPolarHBondContact O-CB 3.44Å; N72-Q75 PolarHBondContact O-N 3.19Å; N72-Q75 VanDerWaalsContact O-N 3.13Å; L73-Q75 VanDerWaalsContact C-N 3.34Å; Q75-N78 PolarHBondContact O-N 2.97Å; Q75-K79 WeakPolarHBondContact O-CD 3.22Å; Q75-K79 WeakPolarHBondContact O-CG 3.47Å; Q75-K79 PolarHBondContact O-N 3.41Å; Q75-K79 VanDerWaalsContact O-N 3.13Å
76	E	54.2	Low	64.3	Low	127 Å²	127	114.2 Å²	114.2	59%	0.593	56%	0.558	S	S	*	*	H	α-helix	trans	-69.3	-38.8	176.3	-69.7	-146.9	151.9	0	0	112.6	N72 L73 N78 K79 N80	N72-E76 WeakPolarHBondContact O-CG 3.43Å; N72-E76 PolarHBondContact O-N 2.81Å; L73-E76 PolarHBondContact O-N 3.36Å; E76-N78 VanDerWaalsContact C-N 3.28Å; E76-N78 PolarHBondContact O-N 3Å; E76-K79 PolarHBondContact O-N 3.4Å; E76-N80 PolarHBondContact O-N 3.4Å
77	L	57.8	Low	64.5	Low	99 Å²	99	111.6 Å²	111.6	52%	0.518	54%	0.544	S	S	.	.	H	α-helix	trans	-62.3	-34.1	173.2	-82.5	172.4	0	0	0	113.1	L73 M83	L73-L77 HydrophobicContact CD2-CD1 4.03Å; L73-L77 HydrophobicContact CD2-CG 4.22Å; L73-L77 WeakPolarHBondContact O-CB 3.17Å; L73-L77 WeakPolarHBondContact O-CG 3.32Å; L73-L77 PolarHBondContact O-N 3.49Å; L77-M83 HydrophobicContact CD2-CE 3.86Å
78	N	60.7	Low	65.2	Low	126 Å²	126	116.1 Å²	116.1	67%	0.674	56%	0.556	S	S	*	*	H	α-helix	trans	-80.3	-20.2	177.3	-78	-39.2	0	0	0	113.4	K74 Q75 E76	K74-N78 PolarHBondContact O-N 2.66Å; K74-N78 PolarHBondContact O-ND2 2.88Å; Q75-N78 PolarHBondContact O-N 2.97Å; E76-N78 VanDerWaalsContact C-N 3.28Å; E76-N78 PolarHBondContact O-N 3Å
79	K	57.9	Low	65.8	Low	143 Å²	143	114.7 Å²	114.7	62%	0.622	55%	0.547	S	S	*	.	H	α-helix	trans	-83	-27.1	178.8	-74.9	168.7	-173	172.4	0	112.8	Q75 E76 K81	Q75-K79 WeakPolarHBondContact O-CD 3.22Å; Q75-K79 WeakPolarHBondContact O-CG 3.47Å; Q75-K79 PolarHBondContact O-N 3.41Å; Q75-K79 VanDerWaalsContact O-N 3.13Å; E76-K79 PolarHBondContact O-N 3.4Å; K79-K81 VanDerWaalsContact C-N 3.34Å; K79-K81 PolarHBondContact O-N 3.09Å
80	N	55.7	Low	66.1	Low	90 Å²	90	115.1 Å²	115.1	48%	0.481	55%	0.549	S	S	.	.			trans	-77.7	76.4	177.5	-92.4	-15.2	0	0	0	113.1	E76 E82 M83	E76-N80 PolarHBondContact O-N 3.4Å; N80-E82 PolarHBondContact O-N 3.33Å; N80-M83 HydrophobicContact CB-CB 4.2Å; N80-M83 PolarHBondContact O-N 3.29Å
81	K	64.2	Low	65.9	Low	162 Å²	162	118.1 Å²	118.1	70%	0.704	55%	0.552	S	S	*	*	H	α-helix	trans	-60.2	-32.5	171.3	-69.9	179.4	-179.9	176.2	0	112.3	K79 M83 K84 E85	K79-K81 VanDerWaalsContact C-N 3.34Å; K79-K81 PolarHBondContact O-N 3.09Å; K81-M83 PolarHBondContact O-N 3.24Å; K81-K84 PolarHBondContact O-N 3.42Å; K81-E85 PolarHBondContact O-N 3.47Å; K81-E85 VanDerWaalsContact O-N 3.13Å
82	E	56.7	Low	66.4	Low	144 Å²	144	120.3 Å²	120.3	67%	0.673	56%	0.56	S	S	*	*	H	α-helix	trans	-65.3	-38.2	179.8	-62.6	179.2	178.9	0	0	112.6	N80 K84 E85 N86	N80-E82 PolarHBondContact O-N 3.33Å; E82-K84 PolarHBondContact O-N 2.87Å; E82-E85 PolarHBondContact O-N 2.95Å; E82-N86 PolarHBondContact O-N 2.76Å; E82-N86 PolarHBondContact O-ND2 2.82Å
83	M	57.5	Low	66.3	Low	87 Å²	87	121.5 Å²	121.5	43%	0.429	56%	0.563	S	S	.	*	H	α-helix	trans	-70.1	-35.1	178.2	-169.6	156.5	77.1	0	0	111.8	L77 N80 K81 E85 N86 I87	L77-M83 HydrophobicContact CD2-CE 3.86Å; N80-M83 HydrophobicContact CB-CB 4.2Å; N80-M83 PolarHBondContact O-N 3.29Å; K81-M83 PolarHBondContact O-N 3.24Å; M83-E85 VanDerWaalsContact C-N 3.31Å; M83-E85 PolarHBondContact O-N 3.2Å; M83-N86 PolarHBondContact O-N 3.34Å; M83-I87 HydrophobicContact CG-CD1 4.16Å; M83-I87 VanDerWaalsContact O-CG1 3.26Å; M83-I87 WeakPolarHBondContact O-CG1 3.37Å; M83-I87 PolarHBondContact O-N 2.98Å
84	K	64.4	Low	66.1	Low	145 Å²	145	120.1 Å²	120.1	63%	0.63	56%	0.563	S	S	*	*	H	α-helix	trans	-67.6	-33.9	174.8	-166.5	173.6	-176.8	174.9	0	111.8	K81 E82 K88	K81-K84 PolarHBondContact O-N 3.42Å; E82-K84 PolarHBondContact O-N 2.87Å; K84-K88 WeakPolarHBondContact O-CG 3.4Å; K84-K88 PolarHBondContact O-N 3.27Å; K84-K88 VanDerWaalsContact O-N 3.16Å
85	E	78	Confident	66.2	Low	113 Å²	113	119.9 Å²	119.9	53%	0.528	56%	0.562	S	S	.	*	H	α-helix	trans	-71.2	-39.9	173.3	-72.4	178.4	-173.5	0	0	111.8	K81 E82 M83 K88 K89	K81-E85 PolarHBondContact O-N 3.47Å; K81-E85 VanDerWaalsContact O-N 3.13Å; E82-E85 PolarHBondContact O-N 2.95Å; M83-E85 VanDerWaalsContact C-N 3.31Å; M83-E85 PolarHBondContact O-N 3.2Å; E85-K88 PolarHBondContact O-N 3.02Å; E85-K89 WeakPolarHBondContact O-CG 3.28Å; E85-K89 PolarHBondContact O-N 3.07Å
86	N	74.6	Confident	66.6	Low	81 Å²	81	122.2 Å²	122.2	43%	0.433	57%	0.57	S	S	.	*	H	α-helix	trans	-65.2	-40.4	175.3	-67.4	-17.1	0	0	0	111.9	E82 M83 K88 K89 F90	E82-N86 PolarHBondContact O-N 2.76Å; E82-N86 PolarHBondContact O-ND2 2.82Å; M83-N86 PolarHBondContact O-N 3.34Å; N86-K88 VanDerWaalsContact C-N 3.3Å; N86-K88 PolarHBondContact O-N 2.93Å; N86-K89 PolarHBondContact O-N 3.22Å; N86-F90 VanDerWaalsContact O-CD2 3.25Å; N86-F90 WeakPolarHBondContact O-CD2 3.45Å; N86-F90 PolarHBondContact O-N 3.34Å
87	I	66.6	Low	67.1	Low	85 Å²	85	121.7 Å²	121.7	44%	0.436	57%	0.571	S	S	.	*	H	α-helix	trans	-64.8	-35.3	174.6	-69.2	165.6	0	0	0	111.5	M83 R91	M83-I87 HydrophobicContact CG-CD1 4.16Å; M83-I87 VanDerWaalsContact O-CG1 3.26Å; M83-I87 WeakPolarHBondContact O-CG1 3.37Å; M83-I87 PolarHBondContact O-N 2.98Å; I87-R91 WeakPolarHBondContact O-CG 3.19Å; I87-R91 PolarHBondContact O-N 3.44Å
88	K	76.8	Confident	67.1	Low	122 Å²	122	123.3 Å²	123.3	53%	0.53	58%	0.576	S	S	.	*	H	α-helix	trans	-67.7	-44.2	174.2	-77.5	178.2	178.1	-173.9	0	111.7	K84 E85 N86 F90 R91 E92	K84-K88 WeakPolarHBondContact O-CG 3.4Å; K84-K88 PolarHBondContact O-N 3.27Å; K84-K88 VanDerWaalsContact O-N 3.16Å; E85-K88 PolarHBondContact O-N 3.02Å; N86-K88 VanDerWaalsContact C-N 3.3Å; N86-K88 PolarHBondContact O-N 2.93Å; K88-F90 PolarHBondContact O-N 2.83Å; K88-R91 PolarHBondContact O-N 2.86Å; K88-R91 VanDerWaalsContact O-N 3.14Å; K88-E92 WeakPolarHBondContact O-CG 3.47Å; K88-E92 PolarHBondContact O-N 3.46Å
89	K	77.2	Confident	67	Low	117 Å²	117	123.6 Å²	123.6	51%	0.509	57%	0.573	S	S	.	*	H	α-helix	trans	-60.1	-43.3	174.7	-72.7	176	-179.3	175.1	0	111.9	E85 N86 R91 E92 E93	E85-K89 WeakPolarHBondContact O-CG 3.28Å; E85-K89 PolarHBondContact O-N 3.07Å; N86-K89 PolarHBondContact O-N 3.22Å; K89-R91 VanDerWaalsContact C-N 3.33Å; K89-R91 PolarHBondContact O-N 3.41Å; K89-E92 PolarHBondContact O-N 3.29Å; K89-E93 WeakPolarHBondContact O-CB 3.37Å; K89-E93 PolarHBondContact O-N 3.32Å
90	F	74.5	Confident	67.9	Low	148 Å²	148	119.3 Å²	119.3	65%	0.649	56%	0.561	S	S	*	*	H	α-helix	trans	-62.2	-38	174	-90.4	-69.9	0	0	0	112.9	N86 K88 A94	N86-F90 VanDerWaalsContact O-CD2 3.25Å; N86-F90 WeakPolarHBondContact O-CD2 3.45Å; N86-F90 PolarHBondContact O-N 3.34Å; K88-F90 PolarHBondContact O-N 2.83Å; F90-A94 WeakPolarHBondContact O-CB 3.25Å; F90-A94 PolarHBondContact O-N 3.34Å
91	R	69.3	Low	68.2	Low	180 Å²	180	120.5 Å²	120.5	68%	0.679	57%	0.568	S	S	*	*	H	α-helix	trans	-70	-33.8	175.3	-76.7	-178.5	179	-169.4	-0.2	112.6	I87 K88 K89 K95	I87-R91 WeakPolarHBondContact O-CG 3.19Å; I87-R91 PolarHBondContact O-N 3.44Å; K88-R91 PolarHBondContact O-N 2.86Å; K88-R91 VanDerWaalsContact O-N 3.14Å; K89-R91 VanDerWaalsContact C-N 3.33Å; K89-R91 PolarHBondContact O-N 3.41Å; R91-K95 WeakPolarHBondContact O-CG 3.18Å; R91-K95 PolarHBondContact O-N 3.27Å; R91-K95 VanDerWaalsContact O-N 3.12Å
92	E	77.5	Confident	68.4	Low	131 Å²	131	116 Å²	116	61%	0.612	56%	0.56	S	S	*	*	H	α-helix	trans	-73	-41.3	175.9	-75.2	172	-174.4	0	0	111.6	K88 K89 K95 K96	K88-E92 WeakPolarHBondContact O-CG 3.47Å; K88-E92 PolarHBondContact O-N 3.46Å; K89-E92 PolarHBondContact O-N 3.29Å; E92-K95 PolarHBondContact O-N 2.85Å; E92-K96 WeakPolarHBondContact O-CB 3.14Å; E92-K96 PolarHBondContact O-N 2.9Å
93	E	72.3	Confident	68.6	Low	117 Å²	117	113 Å²	113	55%	0.547	55%	0.549	S	S	.	.	H	α-helix	trans	-66.3	-39.3	173	-76.1	-177.7	163.3	0	0	112.1	K89 K96 L97	K89-E93 WeakPolarHBondContact O-CB 3.37Å; K89-E93 PolarHBondContact O-N 3.32Å; E93-K96 WeakPolarHBondContact O-CB 3.14Å; E93-K96 PolarHBondContact O-N 3.14Å; E93-L97 VanDerWaalsContact O-CG 3.3Å; E93-L97 WeakPolarHBondContact O-CG 3.38Å; E93-L97 PolarHBondContact O-N 3.12Å
94	A	63.6	Low	68.9	Low	52 Å²	52	113.3 Å²	113.3	43%	0.43	55%	0.548	S	S	.	.	H	α-helix	trans	-62.9	-42.7	174.5	0	0	0	0	0	112.1	F90 K96 L97 E98	F90-A94 WeakPolarHBondContact O-CB 3.25Å; F90-A94 PolarHBondContact O-N 3.34Å; A94-K96 VanDerWaalsContact C-N 3.35Å; A94-L97 PolarHBondContact O-N 2.82Å; A94-E98 PolarHBondContact O-N 3.2Å
95	K	66.1	Low	69.2	Low	135 Å²	135	111.7 Å²	111.7	59%	0.587	54%	0.542	S	S	*	.	H	α-helix	trans	-64	-39.7	174.1	-76.8	178.9	176.9	-172.3	0	112.2	R91 E92 L97 E98 E99	R91-K95 WeakPolarHBondContact O-CG 3.18Å; R91-K95 PolarHBondContact O-N 3.27Å; R91-K95 VanDerWaalsContact O-N 3.12Å; E92-K95 PolarHBondContact O-N 2.85Å; K95-L97 VanDerWaalsContact C-N 3.26Å; K95-L97 PolarHBondContact O-N 3.02Å; K95-E98 PolarHBondContact O-N 3.02Å; K95-E99 WeakPolarHBondContact O-CG 3.45Å; K95-E99 PolarHBondContact O-N 3.33Å
96	K	73.3	Confident	68.3	Low	162 Å²	162	108.3 Å²	108.3	70%	0.704	53%	0.534	S	S	*	.	H	α-helix	trans	-64.4	-31.6	176	-162.8	177.7	-177.8	-177.1	0	112.2	E92 E93 A94	E92-K96 WeakPolarHBondContact O-CB 3.14Å; E92-K96 PolarHBondContact O-N 2.9Å; E93-K96 WeakPolarHBondContact O-CB 3.14Å; E93-K96 PolarHBondContact O-N 3.14Å; A94-K96 VanDerWaalsContact C-N 3.35Å
97	L	63.7	Low	67.8	Low	116 Å²	116	112.8 Å²	112.8	61%	0.607	54%	0.544	S	S	*	.	H	α-helix	trans	-77.6	-35.1	174	-70.8	171.2	0	0	0	112.7	E93 A94 K95 E99 S100 L103	E93-L97 VanDerWaalsContact O-CG 3.3Å; E93-L97 WeakPolarHBondContact O-CG 3.38Å; E93-L97 PolarHBondContact O-N 3.12Å; A94-L97 PolarHBondContact O-N 2.82Å; K95-L97 VanDerWaalsContact C-N 3.26Å; K95-L97 PolarHBondContact O-N 3.02Å; L97-E99 VanDerWaalsContact C-N 3.29Å; L97-E99 PolarHBondContact O-N 3.37Å; L97-S100 VanDerWaalsContact O-CB 3.31Å; L97-S100 WeakPolarHBondContact O-CB 3.5Å; L97-S100 PolarHBondContact O-N 2.92Å; L97-L103 WeakPolarHBondContact O-CD1 3.41Å
98	E	58.5	Low	67.8	Low	134 Å²	134	117 Å²	117	63%	0.626	56%	0.555	S	S	*	*	H	α-helix	trans	-64.4	-32.4	172.4	-76.8	-171.3	147.9	0	0	112.9	A94 K95 S100	A94-E98 PolarHBondContact O-N 3.2Å; K95-E98 PolarHBondContact O-N 3.02Å; E98-S100 VanDerWaalsContact C-N 3.33Å
99	E	59.1	Low	67.3	Low	131 Å²	131	117.8 Å²	117.8	61%	0.612	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-11.8	179.8	-72.1	177.4	-179	0	0	114	K95 L97 K104	K95-E99 WeakPolarHBondContact O-CG 3.45Å; K95-E99 PolarHBondContact O-N 3.33Å; L97-E99 VanDerWaalsContact C-N 3.29Å; L97-E99 PolarHBondContact O-N 3.37Å; E99-K104 PolarHBondContact O-NZ 3.44Å
100	S	76.5	Confident	66.5	Low	54 Å²	54	120.3 Å²	120.3	38%	0.378	57%	0.566	S	S	.	*			trans	-59.7	135.5	-177.9	-172.7	0	0	0	0	112.4	L97 E98 A102 L103 K104	L97-S100 VanDerWaalsContact O-CB 3.31Å; L97-S100 WeakPolarHBondContact O-CB 3.5Å; L97-S100 PolarHBondContact O-N 2.92Å; E98-S100 VanDerWaalsContact C-N 3.33Å; S100-A102 PolarHBondContact O-N 2.82Å; S100-A102 VanDerWaalsContact O-N 3.11Å; S100-L103 PolarHBondContact O-N 3.1Å; S100-K104 PolarHBondContact O-N 3.4Å
101	D	62.4	Low	65.6	Low	115 Å²	115	120.6 Å²	120.6	62%	0.615	57%	0.567	S	S	*	*	H	α-helix	trans	-60.8	-24.9	-174.6	-72.3	-36.6	0	0	0	113.3	K104 Q105	D101-K104 PolarHBondContact O-N 2.94Å; D101-Q105 WeakPolarHBondContact O-CB 3.41Å; D101-Q105 VanDerWaalsContact O-CG 3.27Å; D101-Q105 WeakPolarHBondContact O-CG 3.45Å; D101-Q105 PolarHBondContact O-N 2.83Å
102	A	67	Low	65.4	Low	67 Å²	67	115.3 Å²	115.3	55%	0.554	56%	0.555	S	S	*	*	H	α-helix	trans	-64.2	-41.1	174.8	0	0	0	0	0	112.5	S100 Q105 A106	S100-A102 PolarHBondContact O-N 2.82Å; S100-A102 VanDerWaalsContact O-N 3.11Å; A102-Q105 PolarHBondContact O-N 2.78Å; A102-A106 PolarHBondContact O-N 3.4Å
103	L	60.8	Low	64.4	Low	81 Å²	81	113.5 Å²	113.5	42%	0.424	55%	0.548	S	S	.	.	H	α-helix	trans	-74	-34.8	-179.9	-113.1	162	0	0	0	111.6	L97 S100 A106 R107	L97-L103 WeakPolarHBondContact O-CD1 3.41Å; S100-L103 PolarHBondContact O-N 3.1Å; L103-A106 PolarHBondContact O-N 3.06Å; L103-R107 PolarHBondContact O-N 2.92Å
104	K	65.6	Low	63.4	Low	94 Å²	94	114.3 Å²	114.3	41%	0.409	55%	0.552	S	S	.	*	H	α-helix	trans	-65.9	-40	171.2	-73.8	173.3	-176	149.4	0	111.9	E99 S100 D101 R107 R108	E99-K104 PolarHBondContact O-NZ 3.44Å; S100-K104 PolarHBondContact O-N 3.4Å; D101-K104 PolarHBondContact O-N 2.94Å; K104-R107 PolarHBondContact O-N 3.09Å; K104-R108 VanDerWaalsContact O-CG 3.29Å; K104-R108 WeakPolarHBondContact O-CG 3.33Å; K104-R108 PolarHBondContact O-N 3.45Å
105	Q	69.8	Low	63.3	Low	110 Å²	110	114.7 Å²	114.7	51%	0.514	55%	0.552	S	S	.	*	H	α-helix	trans	-66	-40.3	174.9	-76.2	178.5	6.2	0	0	111.9	D101 A102 R108 K109	D101-Q105 WeakPolarHBondContact O-CB 3.41Å; D101-Q105 VanDerWaalsContact O-CG 3.27Å; D101-Q105 WeakPolarHBondContact O-CG 3.45Å; D101-Q105 PolarHBondContact O-N 2.83Å; A102-Q105 PolarHBondContact O-N 2.78Å; Q105-R108 PolarHBondContact O-N 3.34Å; Q105-K109 WeakPolarHBondContact O-CG 3.42Å; Q105-K109 PolarHBondContact O-N 3.48Å
106	A	58.9	Low	62.4	Low	43 Å²	43	113.7 Å²	113.7	36%	0.355	55%	0.549	S	S	.	.	H	α-helix	trans	-61.6	-45.4	174.9	0	0	0	0	0	111.8	A102 L103 R108 K109 Y110	A102-A106 PolarHBondContact O-N 3.4Å; L103-A106 PolarHBondContact O-N 3.06Å; A106-R108 PolarHBondContact O-N 2.93Å; A106-K109 PolarHBondContact O-N 3.29Å; A106-Y110 WeakPolarHBondContact O-CD2 3.22Å; A106-Y110 PolarHBondContact O-N 3.29Å
107	R	64.1	Low	61.2	Low	174 Å²	174	109.8 Å²	109.8	66%	0.657	54%	0.539	S	S	*	.	H	α-helix	trans	-64.1	-36.6	175.9	-76.7	-175.4	176.3	174.9	2	113.3	L103 K104 Y110 K111	L103-R107 PolarHBondContact O-N 2.92Å; K104-R107 PolarHBondContact O-N 3.09Å; R107-Y110 PolarHBondContact O-N 3.43Å; R107-K111 PolarHBondContact O-N 3.01Å
108	R	67.5	Low	60.7	Low	174 Å²	174	106.9 Å²	106.9	66%	0.657	53%	0.531	S	S	*	.	H	α-helix	trans	-64	-45.5	174.6	-74.2	173.7	-175	-179.6	2.7	110.9	K104 Q105 A106 Y110 K111 T112	K104-R108 VanDerWaalsContact O-CG 3.29Å; K104-R108 WeakPolarHBondContact O-CG 3.33Å; K104-R108 PolarHBondContact O-N 3.45Å; Q105-R108 PolarHBondContact O-N 3.34Å; A106-R108 PolarHBondContact O-N 2.93Å; R108-Y110 PolarHBondContact O-N 3.18Å; R108-K111 PolarHBondContact O-N 3.31Å; R108-T112 PolarHBondContact O-N 3.06Å; R108-T112 PolarHBondContact O-OG1 3.42Å
109	K	65.6	Low	60.5	Low	139 Å²	139	107.2 Å²	107.2	60%	0.604	53%	0.531	S	S	*	.	H	α-helix	trans	-61.4	-41.9	176.3	-70.9	177.5	-179.6	-176.3	0	112	Q105 A106 T112 I113	Q105-K109 WeakPolarHBondContact O-CG 3.42Å; Q105-K109 PolarHBondContact O-N 3.48Å; A106-K109 PolarHBondContact O-N 3.29Å; K109-T112 PolarHBondContact O-N 3.13Å; K109-I113 WeakPolarHBondContact O-CD1 3.21Å; K109-I113 VanDerWaalsContact O-CG1 3.24Å; K109-I113 WeakPolarHBondContact O-CG1 3.39Å; K109-I113 PolarHBondContact O-N 3.13Å
110	Y	61.2	Low	59.8	Low	169 Å²	169	104.8 Å²	104.8	66%	0.663	53%	0.525	S	S	*	.	H	α-helix	trans	-62	-45	174.5	-97.6	-80.8	0	0	0	112.8	A106 R107 R108 T112 I113 E114	A106-Y110 WeakPolarHBondContact O-CD2 3.22Å; A106-Y110 PolarHBondContact O-N 3.29Å; R107-Y110 PolarHBondContact O-N 3.43Å; R108-Y110 PolarHBondContact O-N 3.18Å; Y110-T112 VanDerWaalsContact C-N 3.33Å; Y110-T112 PolarHBondContact O-N 3.22Å; Y110-I113 PolarHBondContact O-N 3.32Å; Y110-E114 PolarHBondContact O-N 2.79Å
111	K	54.9	Low	58.1	Low	154 Å²	154	105.1 Å²	105.1	67%	0.67	53%	0.527	S	S	*	.	H	α-helix	trans	-64.6	-35.4	177	-77.8	-172.4	174.2	-171.3	0	113.1	R107 R108 S115	R107-K111 PolarHBondContact O-N 3.01Å; R108-K111 PolarHBondContact O-N 3.31Å; K111-S115 PolarHBondContact O-N 3.07Å; K111-S115 VanDerWaalsContact O-N 3.14Å
112	T	66	Low	57.6	Low	69 Å²	69	105.7 Å²	105.7	42%	0.423	53%	0.526	S	S	.	.	H	α-helix	trans	-64.3	-44.9	174.5	-54.7	0	0	0	0	110.4	R108 K109 Y110 S115 E116	R108-T112 PolarHBondContact O-N 3.06Å; R108-T112 PolarHBondContact O-OG1 3.42Å; K109-T112 PolarHBondContact O-N 3.13Å; Y110-T112 VanDerWaalsContact C-N 3.33Å; Y110-T112 PolarHBondContact O-N 3.22Å; T112-S115 PolarHBondContact O-N 3.45Å; T112-S115 PolarHBondContact O-OG 3.22Å; T112-E116 WeakPolarHBondContact O-CG 3.39Å; T112-E116 PolarHBondContact O-N 3.42Å
113	I	56.6	Low	56.7	Low	93 Å²	93	106.5 Å²	106.5	48%	0.477	52%	0.524	S	S	.	.	H	α-helix	trans	-65.4	-40	178.3	-66.6	165.1	0	0	0	111.8	K109 Y110 S115 E116 T117	K109-I113 WeakPolarHBondContact O-CD1 3.21Å; K109-I113 VanDerWaalsContact O-CG1 3.24Å; K109-I113 WeakPolarHBondContact O-CG1 3.39Å; K109-I113 PolarHBondContact O-N 3.13Å; Y110-I113 PolarHBondContact O-N 3.32Å; I113-S115 VanDerWaalsContact C-N 3.33Å; I113-S115 PolarHBondContact O-N 3.44Å; I113-E116 PolarHBondContact O-N 3.36Å; I113-T117 WeakPolarHBondContact O-CB 3.32Å; I113-T117 PolarHBondContact O-N 2.84Å; I113-T117 PolarHBondContact O-OG1 3.3Å
114	E	50.3	Low	56.1	Low	135 Å²	135	108.3 Å²	108.3	63%	0.631	53%	0.534	S	S	*	.	H	α-helix	trans	-61.5	-41	174.2	-80.8	-175.4	152.9	0	0	112	Y110 E116 T117 A118	Y110-E114 PolarHBondContact O-N 2.79Å; E114-E116 VanDerWaalsContact C-N 3.31Å; E114-E116 PolarHBondContact O-N 2.85Å; E114-T117 PolarHBondContact O-N 3.41Å; E114-A118 PolarHBondContact O-N 3.5Å
115	S	61.6	Low	55.5	Low	60 Å²	60	111.6 Å²	111.6	42%	0.42	55%	0.548	S	S	.	.	H	α-helix	trans	-70.1	-28.4	179.2	78.9	0	0	0	0	113.2	K111 T112 I113	K111-S115 PolarHBondContact O-N 3.07Å; K111-S115 VanDerWaalsContact O-N 3.14Å; T112-S115 PolarHBondContact O-N 3.45Å; T112-S115 PolarHBondContact O-OG 3.22Å; I113-S115 VanDerWaalsContact C-N 3.33Å; I113-S115 PolarHBondContact O-N 3.44Å
116	E	48	Very low	54.9	Low	113 Å²	113	114 Å²	114	53%	0.528	56%	0.557	S	S	.	*	H	α-helix	trans	-80.1	-32.8	174.6	-71.1	173.6	178.1	0	0	111.6	T112 I113 E114 K119 T120	T112-E116 WeakPolarHBondContact O-CG 3.39Å; T112-E116 PolarHBondContact O-N 3.42Å; I113-E116 PolarHBondContact O-N 3.36Å; E114-E116 VanDerWaalsContact C-N 3.31Å; E114-E116 PolarHBondContact O-N 2.85Å; E116-K119 PolarHBondContact O-N 3.36Å; E116-T120 PolarHBondContact O-N 3.42Å
117	T	46.8	Very low	54.4	Low	81 Å²	81	118.6 Å²	118.6	50%	0.497	57%	0.569	S	S	.	*	H	α-helix	trans	-74	-29	175.6	-54	0	0	0	0	112.3	I113 E114 K119 T120 S121	I113-T117 WeakPolarHBondContact O-CB 3.32Å; I113-T117 PolarHBondContact O-N 2.84Å; I113-T117 PolarHBondContact O-OG1 3.3Å; E114-T117 PolarHBondContact O-N 3.41Å; T117-K119 VanDerWaalsContact C-N 3.27Å; T117-K119 PolarHBondContact O-N 3.32Å; T117-T120 WeakPolarHBondContact CA-OG1 3.31Å; T117-T120 PolarHBondContact O-N 3.42Å; T117-T120 PolarHBondContact O-OG1 3.38Å; T117-S121 PolarHBondContact O-N 3.42Å
118	A	53.7	Low	53.6	Low	54 Å²	54	116.2 Å²	116.2	45%	0.446	57%	0.569	S	S	.	*	H	α-helix	trans	-62.9	-36.2	171.5	0	0	0	0	0	111.8	E114 S121	E114-A118 PolarHBondContact O-N 3.5Å; A118-S121 PolarHBondContact O-N 3.4Å; A118-S121 PolarHBondContact O-OG 2.84Å
119	K	53.1	Low	52.7	Low	141 Å²	141	109.4 Å²	109.4	61%	0.613	55%	0.552	S	S	*	*	H	α-helix	trans	-73	-29.7	179.3	-64.8	174.6	-175	174.8	0	113.1	E116 T117 S121	E116-K119 PolarHBondContact O-N 3.36Å; T117-K119 VanDerWaalsContact C-N 3.27Å; T117-K119 PolarHBondContact O-N 3.32Å; K119-S121 VanDerWaalsContact C-N 3.31Å
120	T	45.2	Very low	52	Low	81 Å²	81	106.7 Å²	106.7	50%	0.497	55%	0.548	S	S	.	.	H	α-helix	trans	-72.3	-25.6	175.1	52.1	0	0	0	0	112.6	E116 T117 E122 V123 L124	E116-T120 PolarHBondContact O-N 3.42Å; T117-T120 WeakPolarHBondContact CA-OG1 3.31Å; T117-T120 PolarHBondContact O-N 3.42Å; T117-T120 PolarHBondContact O-OG1 3.38Å; T120-E122 PolarHBondContact O-N 3.47Å; T120-V123 PolarHBondContact O-N 2.69Å; T120-L124 PolarHBondContact O-N 3.04Å
121	S	42	Very low	51.5	Low	60 Å²	60	103.7 Å²	103.7	42%	0.42	54%	0.542	S	S	.	.	H	α-helix	trans	-68	-29.9	176.1	80.7	0	0	0	0	114	T117 A118 K119 K125	T117-S121 PolarHBondContact O-N 3.42Å; A118-S121 PolarHBondContact O-N 3.4Å; A118-S121 PolarHBondContact O-OG 2.84Å; K119-S121 VanDerWaalsContact C-N 3.31Å; S121-K125 PolarHBondContact O-N 3.29Å; S121-K125 VanDerWaalsContact O-N 3.13Å
122	E	50.6	Low	51.3	Low	127 Å²	127	99.6 Å²	99.6	59%	0.593	53%	0.532	S	S	*	.	H	α-helix	trans	-73.9	-33.4	177.3	-67.2	-175.4	168.4	0	0	112.4	T120 K126	T120-E122 PolarHBondContact O-N 3.47Å; E122-K126 WeakPolarHBondContact O-CG 3.37Å; E122-K126 PolarHBondContact O-N 3.27Å; E122-K126 VanDerWaalsContact O-N 3.13Å
123	V	48.8	Very low	50.4	Low	85 Å²	85	102.3 Å²	102.3	52%	0.515	54%	0.54	S	S	.	.	H	α-helix	trans	-73.1	-36.3	177.1	-179.5	0	0	0	0	111	T120 K126 K127	T120-V123 PolarHBondContact O-N 2.69Å; V123-K126 PolarHBondContact O-N 2.76Å; V123-K127 PolarHBondContact O-N 2.93Å
124	L	47.4	Very low	50.1	Low	118 Å²	118	102 Å²	102	62%	0.618	54%	0.543	S	S	*	.	H	α-helix	trans	-64.7	-43.1	172.6	-96.5	153	0	0	0	112.2	T120 K126 K127 L128	T120-L124 PolarHBondContact O-N 3.04Å; L124-K126 VanDerWaalsContact C-N 3.34Å; L124-K126 PolarHBondContact O-N 3.3Å; L124-K127 PolarHBondContact O-N 3.29Å; L124-L128 WeakPolarHBondContact O-CB 3.42Å; L124-L128 PolarHBondContact O-N 3.46Å
125	K	53.4	Low	50	Low	163 Å²	163	100.3 Å²	100.3	71%	0.709	54%	0.542	S	S	*	.	H	α-helix	trans	-61.3	-40.5	174.3	-83.5	-178.6	176.2	177.2	0	112.7	S121 L128 G129	S121-K125 PolarHBondContact O-N 3.29Å; S121-K125 VanDerWaalsContact O-N 3.13Å; K125-L128 PolarHBondContact O-N 2.89Å; K125-G129 PolarHBondContact O-N 3.37Å; K125-G129 VanDerWaalsContact O-N 3.09Å
126	K	56.6	Low	49.2	Very low	161 Å²	161	104.7 Å²	104.7	70%	0.7	55%	0.553	S	S	*	*	H	α-helix	trans	-65.5	-40.1	177.1	-74.3	179.6	-178	179.6	0	112.2	E122 V123 L124 T130	E122-K126 WeakPolarHBondContact O-CG 3.37Å; E122-K126 PolarHBondContact O-N 3.27Å; E122-K126 VanDerWaalsContact O-N 3.13Å; V123-K126 PolarHBondContact O-N 2.76Å; L124-K126 VanDerWaalsContact C-N 3.34Å; L124-K126 PolarHBondContact O-N 3.3Å; K126-T130 PolarHBondContact O-OG1 2.79Å; K126-T130 VanDerWaalsContact O-OG1 3.06Å
127	K	49	Very low	49.2	Very low	139 Å²	139	106 Å²	106	60%	0.604	56%	0.559	S	S	*	*	H	α-helix	trans	-71.3	-35.2	176.5	-71.6	-163.3	180	-164.1	0	113.2	V123 L124 T130 I131	V123-K127 PolarHBondContact O-N 2.93Å; L124-K127 PolarHBondContact O-N 3.29Å; K127-T130 PolarHBondContact O-OG1 2.85Å; K127-I131 WeakPolarHBondContact O-CG1 3.27Å; K127-I131 PolarHBondContact O-N 2.88Å
128	L	47.3	Very low	49.1	Very low	125 Å²	125	104.1 Å²	104.1	65%	0.654	56%	0.556	S	S	*	*	H	α-helix	trans	-69.1	-34.9	178	-148.8	88.2	0	0	0	112.2	L124 K125 I131 S132	L124-L128 WeakPolarHBondContact O-CB 3.42Å; L124-L128 PolarHBondContact O-N 3.46Å; K125-L128 PolarHBondContact O-N 2.89Å; L128-I131 PolarHBondContact O-N 2.88Å; L128-S132 PolarHBondContact O-N 2.89Å; L128-S132 VanDerWaalsContact O-N 3.14Å
129	G	48.7	Very low	48.4	Very low	31 Å²	31	107.8 Å²	107.8	32%	0.32	57%	0.568	S	S	.	*	H	α-helix	trans	-60.6	-48.8	176.4	0	0	0	0	0	112.8	K125 I131 S132 E133	K125-G129 PolarHBondContact O-N 3.37Å; K125-G129 VanDerWaalsContact O-N 3.09Å; G129-I131 VanDerWaalsContact C-N 3.28Å; G129-I131 PolarHBondContact O-N 2.89Å; G129-S132 PolarHBondContact O-N 3.32Å; G129-S132 VanDerWaalsContact O-N 3.12Å; G129-S132 PolarHBondContact O-OG 2.85Å; G129-E133 PolarHBondContact O-N 2.81Å
130	T	50.6	Low	47.8	Very low	82 Å²	82	108.2 Å²	108.2	50%	0.503	57%	0.572	S	S	.	*	H	α-helix	trans	-62	-30.5	176.6	23.6	0	0	0	0	114	K126 K127 T134	K126-T130 PolarHBondContact O-OG1 2.79Å; K126-T130 VanDerWaalsContact O-OG1 3.06Å; K127-T130 PolarHBondContact O-OG1 2.85Å; T130-T134 PolarHBondContact O-N 2.79Å; T130-T134 PolarHBondContact O-OG1 2.79Å
131	I	51.3	Low	47.6	Very low	106 Å²	106	112.2 Å²	112.2	54%	0.544	59%	0.585	S	S	.	*	H	α-helix	trans	-77	-31.4	177.1	-64.8	167.1	0	0	0	110.7	K127 L128 G129 T134 V135	K127-I131 WeakPolarHBondContact O-CG1 3.27Å; K127-I131 PolarHBondContact O-N 2.88Å; L128-I131 PolarHBondContact O-N 2.88Å; G129-I131 VanDerWaalsContact C-N 3.28Å; G129-I131 PolarHBondContact O-N 2.89Å; I131-T134 WeakPolarHBondContact CA-OG1 3.19Å; I131-T134 PolarHBondContact O-OG1 2.88Å; I131-V135 VanDerWaalsContact O-CG2 3.28Å; I131-V135 WeakPolarHBondContact O-CG2 3.32Å; I131-V135 PolarHBondContact O-N 3.08Å
132	S	50	Low	47.7	Very low	67 Å²	67	114.3 Å²	114.3	47%	0.469	60%	0.595	S	S	.	*	H	α-helix	trans	-74.5	-30.7	177.3	86.1	0	0	0	0	113.4	L128 G129 K136	L128-S132 PolarHBondContact O-N 2.89Å; L128-S132 VanDerWaalsContact O-N 3.14Å; G129-S132 PolarHBondContact O-N 3.32Å; G129-S132 VanDerWaalsContact O-N 3.12Å; G129-S132 PolarHBondContact O-OG 2.85Å; S132-K136 PolarHBondContact O-N 2.83Å
133	E	48.3	Very low	47.5	Very low	127 Å²	127	112.7 Å²	112.7	59%	0.593	60%	0.597	S	S	*	*	H	α-helix	trans	-71.3	-42.4	175.6	-80.7	-178.4	153	0	0	111.6	G129 V135 K136 E137	G129-E133 PolarHBondContact O-N 2.81Å; E133-V135 VanDerWaalsContact C-N 3.27Å; E133-V135 PolarHBondContact O-N 3.11Å; E133-K136 PolarHBondContact O-N 3.39Å; E133-E137 PolarHBondContact O-N 3.41Å
134	T	48.6	Very low	47.4	Very low	87 Å²	87	119.6 Å²	119.6	53%	0.534	61%	0.614	S	S	.	*	H	α-helix	trans	-64.8	-29.4	176.7	41.7	0	0	0	0	113.2	T130 I131 G138	T130-T134 PolarHBondContact O-N 2.79Å; T130-T134 PolarHBondContact O-OG1 2.79Å; I131-T134 WeakPolarHBondContact CA-OG1 3.19Å; I131-T134 PolarHBondContact O-OG1 2.88Å; T134-G138 PolarHBondContact O-N 3.41Å
135	V	48.5	Very low	48	Very low	99 Å²	99	117 Å²	117	60%	0.6	61%	0.606	S	S	*	*	H	α-helix	trans	-76.3	-29.8	173.3	173.7	0	0	0	0	112.2	I131 E133 L139	I131-V135 VanDerWaalsContact O-CG2 3.28Å; I131-V135 WeakPolarHBondContact O-CG2 3.32Å; I131-V135 PolarHBondContact O-N 3.08Å; E133-V135 VanDerWaalsContact C-N 3.27Å; E133-V135 PolarHBondContact O-N 3.11Å; V135-L139 PolarHBondContact O-N 3.33Å
136	K	45.3	Very low	47.5	Very low	151 Å²	151	117.7 Å²	117.7	66%	0.657	61%	0.612	S	S	*	*	H	α-helix	trans	-73.1	-41.2	175.3	-85.7	-178.6	173.8	-179.8	0	112.3	S132 E133 G138 L139 E140	S132-K136 PolarHBondContact O-N 2.83Å; E133-K136 PolarHBondContact O-N 3.39Å; K136-G138 VanDerWaalsContact C-N 3.35Å; K136-L139 PolarHBondContact O-N 2.95Å; K136-E140 PolarHBondContact O-N 3.33Å
137	E	48.7	Very low	47.1	Very low	140 Å²	140	116.5 Å²	116.5	65%	0.654	61%	0.612	S	S	*	*	H	α-helix	trans	-65.5	-39	176.3	-72.1	179	159.1	0	0	111.6	E133 L139 E140	E133-E137 PolarHBondContact O-N 3.41Å; E137-L139 VanDerWaalsContact C-N 3.26Å; E137-L139 PolarHBondContact O-N 2.86Å; E137-E140 PolarHBondContact O-N 3.45Å
138	G	43.4	Very low	47	Very low	42 Å²	42	112.2 Å²	112.2	43%	0.433	61%	0.607	S	S	.	*	H	α-helix	trans	-67.1	-20.2	175.2	0	0	0	0	0	115	T134 K136 V142	T134-G138 PolarHBondContact O-N 3.41Å; K136-G138 VanDerWaalsContact C-N 3.35Å; G138-V142 WeakPolarHBondContact O-CG2 3.18Å
139	L	38.8	Very low	47.1	Very low	132 Å²	132	114.4 Å²	114.4	69%	0.691	61%	0.611	S	S	*	*	H	α-helix	trans	-89.3	-25.2	179.2	-166.4	68.1	0	0	0	112.7	V135 K136 E137	V135-L139 PolarHBondContact O-N 3.33Å; K136-L139 PolarHBondContact O-N 2.95Å; E137-L139 VanDerWaalsContact C-N 3.26Å; E137-L139 PolarHBondContact O-N 2.86Å
140	E	40.9	Very low	47.1	Very low	149 Å²	149	121 Å²	121	70%	0.696	63%	0.631	S	S	*	*	H	α-helix	trans	-77.6	-29.6	176.6	-71.3	-168	168.1	0	0	112.4	K136 E137 S143	K136-E140 PolarHBondContact O-N 3.33Å; E137-E140 PolarHBondContact O-N 3.45Å; E140-S143 PolarHBondContact O-OG 2.89Å
141	E	41.6	Very low	46.8	Very low	166 Å²	166	124.6 Å²	124.6	78%	0.776	64%	0.64	S	S	*	*	H	α-helix	trans	-77.8	-26.5	-179	-125.7	169.8	-172.9	0	0	113.9	S143	E141-S143 VanDerWaalsContact C-N 3.31Å; E141-S143 PolarHBondContact O-N 2.82Å
142	V	44.3	Very low	46.4	Very low	104 Å²	104	127.4 Å²	127.4	63%	0.63	65%	0.648	S	S	*	*	H	α-helix	trans	-79	-17.2	177.6	179.5	0	0	0	0	112.2	G138 R144	G138-V142 WeakPolarHBondContact O-CG2 3.18Å; V142-R144 PolarHBondContact O-N 3.32Å
143	S	45	Very low	46.2	Very low	92 Å²	92	130.9 Å²	130.9	64%	0.643	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-9.2	-179.6	73	0	0	0	0	114.8	E140 E141	E140-S143 PolarHBondContact O-OG 2.89Å; E141-S143 VanDerWaalsContact C-N 3.31Å; E141-S143 PolarHBondContact O-N 2.82Å
144	R	46.5	Very low	45.9	Very low	230 Å²	230	127.1 Å²	127.1	87%	0.868	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-2.4	-175.5	-70.2	-175	178.9	166	2.7	115.9	V142	V142-R144 PolarHBondContact O-N 3.32Å
145	S	60.3	Low	45.3	Very low	63 Å²	63	129.2 Å²	129.2	44%	0.441	66%	0.657	S	S	.	*	S	Bend	trans	-94.8	143.8	176.9	74.1	0	0	0	0	112.3	I147 G148	S145-I147 PolarHBondContact O-N 3.38Å; S145-G148 PolarHBondContact O-N 3.5Å
146	E	43.4	Very low	45	Very low	179 Å²	179	130.5 Å²	130.5	84%	0.836	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-1.8	-169.8	-63.4	-178.6	153.5	0	0	115.7
147	I	48.2	Very low	44.8	Very low	136 Å²	136	130.3 Å²	130.3	70%	0.697	66%	0.658	S	S	*	*	H	α-helix	trans	-81.9	-25.2	178.9	-63.3	166.8	0	0	0	111.7	S145 K149	S145-I147 PolarHBondContact O-N 3.38Å; I147-K149 PolarHBondContact O-N 3.46Å
148	G	46.2	Very low	44.3	Very low	49 Å²	49	126.7 Å²	126.7	51%	0.505	65%	0.652	S	S	.	*	H	α-helix	trans	-69.9	-26.3	178.2	0	0	0	0	0	114.6	S145	S145-G148 PolarHBondContact O-N 3.5Å
149	K	50.4	Low	44	Very low	170 Å²	170	127.7 Å²	127.7	74%	0.739	66%	0.656	S	S	*	*	H	α-helix	trans	-72.5	-38.2	179.4	-77.5	-177	178.1	176.6	0	112.5	I147 F151 K152	I147-K149 PolarHBondContact O-N 3.46Å; K149-F151 VanDerWaalsContact C-N 3.35Å; K149-F151 PolarHBondContact O-N 2.99Å; K149-K152 PolarHBondContact O-N 3.49Å
150	K	48.4	Very low	44.3	Very low	169 Å²	169	128.8 Å²	128.8	74%	0.735	66%	0.655	S	S	*	*	H	α-helix	trans	-71	-28.7	179.3	-73.3	-176.5	175.9	178.6	0	113.4	G154	K150-G154 PolarHBondContact O-N 2.77Å
151	F	43.8	Very low	44	Very low	158 Å²	158	126 Å²	126	69%	0.693	65%	0.649	S	S	*	*	H	α-helix	trans	-75	-28.2	179.7	-153.5	-94.1	0	0	0	112.7	K149 M155	K149-F151 VanDerWaalsContact C-N 3.35Å; K149-F151 PolarHBondContact O-N 2.99Å; F151-M155 HydrophobicContact CE1-SD 4.48Å; F151-M155 WeakPolarHBondContact O-CB 3.28Å; F151-M155 PolarHBondContact O-N 3.45Å
152	K	43	Very low	43.6	Very low	165 Å²	165	121.9 Å²	121.9	72%	0.717	64%	0.643	S	S	*	*	H	α-helix	trans	-73.6	-35.7	178.8	-161.8	175.1	-179.8	-177.9	0	112.5	K149 E156	K149-K152 PolarHBondContact O-N 3.49Å; K152-E156 PolarHBondContact O-N 3.14Å
153	E	46.6	Very low	43.1	Very low	141 Å²	141	125.9 Å²	125.9	66%	0.659	65%	0.652	S	S	*	*	H	α-helix	trans	-71.3	-40.3	177.2	-70	174.3	170.4	0	0	111.9	M155 E156	E153-M155 VanDerWaalsContact C-N 3.28Å; E153-M155 PolarHBondContact O-N 3.32Å; E153-E156 PolarHBondContact O-N 3.15Å
154	G	42.3	Very low	42.6	Very low	47 Å²	47	127.1 Å²	127.1	49%	0.485	66%	0.656	S	S	.	*	H	α-helix	trans	-67.9	-24.3	177	0	0	0	0	0	114.6	K150	K150-G154 PolarHBondContact O-N 2.77Å
155	M	35.5	Very low	41.8	Very low	132 Å²	132	120.5 Å²	120.5	65%	0.65	65%	0.645	S	S	*	*	H	α-helix	trans	-85	-23	179.6	-168.7	153.4	147.1	0	0	112.8	F151 E153 A159	F151-M155 HydrophobicContact CE1-SD 4.48Å; F151-M155 WeakPolarHBondContact O-CB 3.28Å; F151-M155 PolarHBondContact O-N 3.45Å; E153-M155 VanDerWaalsContact C-N 3.28Å; E153-M155 PolarHBondContact O-N 3.32Å; M155-A159 PolarHBondContact O-N 3.47Å
156	E	41.1	Very low	40.2	Very low	126 Å²	126	121.7 Å²	121.7	59%	0.589	66%	0.659	S	S	*	*	H	α-helix	trans	-80	-24.1	177.9	-136.6	175.3	171.9	0	0	112.7	K152 E153	K152-E156 PolarHBondContact O-N 3.14Å; E153-E156 PolarHBondContact O-N 3.15Å
157	E	42.3	Very low	39.7	Very low	147 Å²	147	122.1 Å²	122.1	69%	0.687	66%	0.66	S	S	*	*	H	α-helix	trans	-84	-35.1	177.6	-137	170.1	-165.7	0	0	112.5	K160 T161	E157-K160 PolarHBondContact O-N 2.67Å; E157-T161 PolarHBondContact O-N 2.86Å; E157-T161 PolarHBondContact O-OG1 2.83Å
158	A	38.9	Very low	38.9	Very low	63 Å²	63	122 Å²	122	52%	0.521	67%	0.667	S	S	.	*	H	α-helix	trans	-68.5	-32.9	173.5	0	0	0	0	0	112.6	K160 T161 A162	A158-K160 VanDerWaalsContact C-N 3.35Å; A158-K160 PolarHBondContact O-N 3.22Å; A158-T161 PolarHBondContact O-N 3.36Å; A158-A162 PolarHBondContact O-N 2.95Å
159	A	36.7	Very low	38.5	Very low	63 Å²	63	125.7 Å²	125.7	52%	0.521	68%	0.679	S	S	.	*	H	α-helix	trans	-71.3	-26.9	177.6	0	0	0	0	0	113.5	M155	M155-A159 PolarHBondContact O-N 3.47Å
160	K	44.3	Very low	37.7	Very low	155 Å²	155	123.1 Å²	123.1	67%	0.674	68%	0.682	S	S	*	*	H	α-helix	trans	-79.2	-26.4	175.5	-70.6	176.7	-175.4	172.1	0	112.6	E157 A158	E157-K160 PolarHBondContact O-N 2.67Å; A158-K160 VanDerWaalsContact C-N 3.35Å; A158-K160 PolarHBondContact O-N 3.22Å
161	T	34.6	Very low	37.3	Very low	91 Å²	91	125 Å²	125	56%	0.558	69%	0.69	S	S	*	*	H	α-helix	trans	-78.5	-21.9	178.7	-51.3	0	0	0	0	112.8	E157 A158 K163	E157-T161 PolarHBondContact O-N 2.86Å; E157-T161 PolarHBondContact O-OG1 2.83Å; A158-T161 PolarHBondContact O-N 3.36Å; T161-K163 PolarHBondContact O-N 2.83Å
162	A	32.8	Very low	36.8	Very low	79 Å²	79	121.2 Å²	121.2	65%	0.653	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-12.5	-178.1	0	0	0	0	0	115	A158	A158-A162 PolarHBondContact O-N 2.95Å
163	K	33.8	Very low	36.6	Very low	188 Å²	188	116.6 Å²	116.6	82%	0.817	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-10.5	-176.9	-77.2	-174.3	176.2	-179.2	0	115.4	T161	T161-K163 PolarHBondContact O-N 2.83Å
164	T	35.1	Very low	36.3	Very low	118 Å²	118	118.9 Å²	118.9	72%	0.724	69%	0.694	S	S	*	*	S	Bend	trans	-109.2	10	-176.3	49.8	0	0	0	0	114.3
165	S	30.2	Very low	36.4	Very low	91 Å²	91	124.8 Å²	124.8	64%	0.636	71%	0.711	S	S	*	*	S	Bend	trans	-108.6	26.8	-175.4	-58.4	0	0	0	0	113.7
166	A	27.1	Very low	36.7	Very low	89 Å²	89	123.5 Å²	123.5	74%	0.736	71%	0.706	S	S	*	*	S	Bend	trans	-108.7	-11.2	-175.7	0	0	0	0	0	115.4
167	E	33.2	Very low	37	Very low	187 Å²	187	120.3 Å²	120.3	87%	0.874	71%	0.707	S	S	*	*	S	Bend	trans	-124.2	12.4	-170.8	-71.6	-168.7	161	0	0	117
168	T	30.9	Very low	37.4	Very low	135 Å²	135	122.6 Å²	122.6	83%	0.828	72%	0.715	S	S	*	*	S	Bend	trans	-141.8	48.8	178.4	-23.2	0	0	0	0	115.4
169	V	36.5	Very low	38.5	Very low	125 Å²	125	123.6 Å²	123.6	76%	0.758	71%	0.714	S	S	*	*			trans	-117.3	2.2	-178.4	-176.7	0	0	0	0	114.7
170	S	34.6	Very low	39.4	Very low	117 Å²	117	123.3 Å²	123.3	82%	0.818	72%	0.718	S	S	*	*	S	Bend	trans	-90.5	0.9	-174.7	60.4	0	0	0	0	117.1
171	K	39.1	Very low	39.5	Very low	207 Å²	207	119 Å²	119	90%	0.9	71%	0.711	S	S	*	*	S	Bend	trans	-126.2	8.9	-173.9	-83.7	-174.5	176.9	177.3	0	118
172	S	34.9	Very low	40.4	Very low	79 Å²	79	120.5 Å²	120.5	55%	0.552	71%	0.71	S	S	*	*	S	Bend	trans	-125.3	6.2	178.1	-142.4	0	0	0	0	114.8	E174	S172-E174 VanDerWaalsContact C-N 3.33Å; S172-E174 PolarHBondContact O-N 3.15Å
173	G	37.8	Very low	41.4	Very low	68 Å²	68	124.9 Å²	124.9	70%	0.701	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-18	-175.6	0	0	0	0	0	115.6
174	E	41.6	Very low	42.4	Very low	190 Å²	190	118.2 Å²	118.2	89%	0.888	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-12.3	-174.1	-66.1	-175.6	162.4	0	0	114.1	S172	S172-E174 VanDerWaalsContact C-N 3.33Å; S172-E174 PolarHBondContact O-N 3.15Å
175	M	42.8	Very low	43.1	Very low	170 Å²	170	117.2 Å²	117.2	84%	0.837	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-16.2	-175.4	-68.3	-101.5	-151.4	0	0	114
176	L	42.2	Very low	44.8	Very low	106 Å²	106	115.8 Å²	115.8	56%	0.555	67%	0.669	S	S	*	*	S	Bend	trans	-91.5	-8.8	-179.2	-74.4	167	0	0	0	114.2	K178 T179	L176-K178 PolarHBondContact O-N 3.16Å; L176-K178 VanDerWaalsContact O-N 3.09Å; L176-T179 PolarHBondContact O-OG1 2.99Å
177	G	46.8	Very low	46.4	Very low	59 Å²	59	116.3 Å²	116.3	61%	0.608	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	5.7	-177.7	0	0	0	0	0	116.4
178	K	50.8	Low	47.3	Very low	195 Å²	195	110.9 Å²	110.9	85%	0.848	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	-2.2	-174.7	-64.3	-174.8	-178	176	0	115.3	L176	L176-K178 PolarHBondContact O-N 3.16Å; L176-K178 VanDerWaalsContact O-N 3.09Å
179	T	62.8	Low	48.7	Very low	83 Å²	83	108.9 Å²	108.9	51%	0.509	63%	0.626	S	S	.	*	S	Bend	trans	-79.2	134.8	-179.6	-18.7	0	0	0	0	110.5	L176 A181 F182 R183	L176-T179 PolarHBondContact O-OG1 2.99Å; T179-A181 PolarHBondContact O-N 2.91Å; T179-F182 PolarHBondContact O-N 3.24Å; T179-R183 PolarHBondContact O-N 3.41Å
180	G	54.9	Low	49.7	Very low	58 Å²	58	108.2 Å²	108.2	60%	0.598	62%	0.615	S	S	*	*	H	α-helix	trans	-53.7	-25.9	-170.9	0	0	0	0	0	115.8	R183 A184	G180-R183 PolarHBondContact O-N 3.45Å; G180-A184 PolarHBondContact O-N 3.37Å
181	A	47.6	Very low	50.6	Low	64 Å²	64	105.3 Å²	105.3	53%	0.529	60%	0.595	S	S	.	*	H	α-helix	trans	-68.5	-37.7	174	0	0	0	0	0	113.1	T179 A184 I185	T179-A181 PolarHBondContact O-N 2.91Å; A181-A184 PolarHBondContact O-N 2.98Å; A181-I185 WeakPolarHBondContact O-CB 3.13Å; A181-I185 WeakPolarHBondContact O-CD1 3.28Å; A181-I185 WeakPolarHBondContact O-CG1 3.41Å; A181-I185 PolarHBondContact O-N 3.41Å
182	F	51.9	Low	51.4	Low	122 Å²	122	98.9 Å²	98.9	54%	0.535	57%	0.573	S	S	.	*	H	α-helix	trans	-72	-30.4	174.4	-92	-80.8	0	0	0	112.2	T179 S186	T179-F182 PolarHBondContact O-N 3.24Å; F182-S186 VanDerWaalsContact O-CB 3.24Å; F182-S186 WeakPolarHBondContact O-CB 3.41Å; F182-S186 PolarHBondContact O-N 3.44Å; F182-S186 PolarHBondContact O-OG 3.27Å
183	R	53.9	Low	52.4	Low	172 Å²	172	101.4 Å²	101.4	65%	0.649	57%	0.574	S	S	*	*	H	α-helix	trans	-68.9	-40.5	172.4	-169.8	178.4	-178.3	-177	1.2	111.7	T179 G180 S186 Q187	T179-R183 PolarHBondContact O-N 3.41Å; G180-R183 PolarHBondContact O-N 3.45Å; R183-S186 WeakPolarHBondContact CA-OG 3.32Å; R183-S186 PolarHBondContact O-N 3.3Å; R183-S186 PolarHBondContact O-OG 2.89Å; R183-Q187 VanDerWaalsContact O-CB 3.24Å; R183-Q187 WeakPolarHBondContact O-CB 3.32Å; R183-Q187 WeakPolarHBondContact O-CG 3.49Å; R183-Q187 PolarHBondContact O-N 2.9Å
184	A	56	Low	53.4	Low	48 Å²	48	105.2 Å²	105.2	40%	0.397	57%	0.571	S	S	.	*	H	α-helix	trans	-64	-44.9	174	0	0	0	0	0	110.8	G180 A181 Q187 S188	G180-A184 PolarHBondContact O-N 3.37Å; A181-A184 PolarHBondContact O-N 2.98Å; A184-Q187 PolarHBondContact O-N 2.97Å; A184-S188 WeakPolarHBondContact O-CB 3.44Å; A184-S188 PolarHBondContact O-N 3.4Å; A184-S188 PolarHBondContact O-OG 2.91Å
185	I	49.9	Very low	53.6	Low	97 Å²	97	102.1 Å²	102.1	50%	0.497	56%	0.556	S	S	.	*	H	α-helix	trans	-66.7	-39.7	176.9	-66.4	163.5	0	0	0	111.3	A181 S188 V189	A181-I185 WeakPolarHBondContact O-CB 3.13Å; A181-I185 WeakPolarHBondContact O-CD1 3.28Å; A181-I185 WeakPolarHBondContact O-CG1 3.41Å; A181-I185 PolarHBondContact O-N 3.41Å; I185-S188 PolarHBondContact O-N 2.97Å; I185-V189 HydrophobicContact CG2-CG2 4.34Å; I185-V189 WeakPolarHBondContact O-CB 3.34Å; I185-V189 VanDerWaalsContact O-CG2 3.22Å; I185-V189 WeakPolarHBondContact O-CG2 3.43Å; I185-V189 PolarHBondContact O-N 3.34Å
186	S	65.3	Low	54	Low	61 Å²	61	99.4 Å²	99.4	43%	0.427	54%	0.544	S	S	.	.	H	α-helix	trans	-66.7	-39.2	175.9	69.7	0	0	0	0	111.5	F182 R183 V189 E190	F182-S186 VanDerWaalsContact O-CB 3.24Å; F182-S186 WeakPolarHBondContact O-CB 3.41Å; F182-S186 PolarHBondContact O-N 3.44Å; F182-S186 PolarHBondContact O-OG 3.27Å; R183-S186 WeakPolarHBondContact CA-OG 3.32Å; R183-S186 PolarHBondContact O-N 3.3Å; R183-S186 PolarHBondContact O-OG 2.89Å; S186-V189 PolarHBondContact O-N 2.88Å; S186-E190 WeakPolarHBondContact O-CB 3.45Å; S186-E190 PolarHBondContact O-N 2.98Å
187	Q	60.3	Low	54.4	Low	99 Å²	99	97.6 Å²	97.6	46%	0.463	55%	0.551	S	S	.	*	H	α-helix	trans	-65.3	-42.2	174.1	-76.1	173.6	-26	0	0	110.9	R183 A184 E190 S191	R183-Q187 VanDerWaalsContact O-CB 3.24Å; R183-Q187 WeakPolarHBondContact O-CB 3.32Å; R183-Q187 WeakPolarHBondContact O-CG 3.49Å; R183-Q187 PolarHBondContact O-N 2.9Å; A184-Q187 PolarHBondContact O-N 2.97Å; Q187-E190 PolarHBondContact O-N 3.07Å; Q187-S191 WeakPolarHBondContact O-CB 3.45Å; Q187-S191 PolarHBondContact O-N 3.47Å; Q187-S191 PolarHBondContact O-OG 2.88Å
188	S	53.3	Low	54.5	Low	74 Å²	74	102 Å²	102	52%	0.517	56%	0.56	S	S	.	*	H	α-helix	trans	-63.8	-42.7	174.4	-62.4	0	0	0	0	112.2	A184 I185 E190 S191 V192	A184-S188 WeakPolarHBondContact O-CB 3.44Å; A184-S188 PolarHBondContact O-N 3.4Å; A184-S188 PolarHBondContact O-OG 2.91Å; I185-S188 PolarHBondContact O-N 2.97Å; S188-E190 VanDerWaalsContact C-N 3.3Å; S188-E190 PolarHBondContact O-N 3.49Å; S188-S191 PolarHBondContact O-N 3.33Å; S188-V192 VanDerWaalsContact O-CB 3.32Å; S188-V192 WeakPolarHBondContact O-CB 3.38Å; S188-V192 WeakPolarHBondContact O-CG2 3.29Å; S188-V192 PolarHBondContact O-N 3.01Å
189	V	59.7	Low	54	Low	93 Å²	93	99 Å²	99	56%	0.564	55%	0.553	S	S	*	*	H	α-helix	trans	-66.1	-34.4	175.4	170.4	0	0	0	0	111.1	I185 S186 K193	I185-V189 HydrophobicContact CG2-CG2 4.34Å; I185-V189 WeakPolarHBondContact O-CB 3.34Å; I185-V189 VanDerWaalsContact O-CG2 3.22Å; I185-V189 WeakPolarHBondContact O-CG2 3.43Å; I185-V189 PolarHBondContact O-N 3.34Å; S186-V189 PolarHBondContact O-N 2.88Å; V189-K193 WeakPolarHBondContact O-CB 3.33Å; V189-K193 PolarHBondContact O-N 3.34Å
190	E	57.6	Low	53.3	Low	110 Å²	110	98 Å²	98	51%	0.514	56%	0.559	S	S	.	*	H	α-helix	trans	-74.7	-36.4	177.4	-164.9	162.5	-142.8	0	0	112.3	S186 Q187 S188 K193 K194	S186-E190 WeakPolarHBondContact O-CB 3.45Å; S186-E190 PolarHBondContact O-N 2.98Å; Q187-E190 PolarHBondContact O-N 3.07Å; S188-E190 VanDerWaalsContact C-N 3.3Å; S188-E190 PolarHBondContact O-N 3.49Å; E190-K193 PolarHBondContact O-N 2.91Å; E190-K194 WeakPolarHBondContact O-CB 3.36Å; E190-K194 VanDerWaalsContact O-CG 3.25Å; E190-K194 WeakPolarHBondContact O-CG 3.36Å; E190-K194 PolarHBondContact O-N 3.07Å
191	S	54.4	Low	53.1	Low	57 Å²	57	100.3 Å²	100.3	40%	0.399	55%	0.554	S	S	.	*	H	α-helix	trans	-63.8	-47.1	169.4	-57.8	0	0	0	0	111.1	Q187 S188 K193 K194 E195	Q187-S191 WeakPolarHBondContact O-CB 3.45Å; Q187-S191 PolarHBondContact O-N 3.47Å; Q187-S191 PolarHBondContact O-OG 2.88Å; S188-S191 PolarHBondContact O-N 3.33Å; S191-K193 VanDerWaalsContact C-N 3.31Å; S191-K193 PolarHBondContact O-N 2.92Å; S191-K194 WeakPolarHBondContact O-CB 3.18Å; S191-K194 PolarHBondContact O-N 2.81Å; S191-K194 VanDerWaalsContact O-N 3.1Å; S191-E195 WeakPolarHBondContact O-CB 3.49Å; S191-E195 WeakPolarHBondContact O-CG 3.08Å; S191-E195 PolarHBondContact O-N 2.88Å
192	V	54.5	Low	53.1	Low	72 Å²	72	104.8 Å²	104.8	44%	0.436	58%	0.575	S	S	.	*	H	α-helix	trans	-64.3	-35.9	176.6	170	0	0	0	0	111	S188 E195 I196	S188-V192 VanDerWaalsContact O-CB 3.32Å; S188-V192 WeakPolarHBondContact O-CB 3.38Å; S188-V192 WeakPolarHBondContact O-CG2 3.29Å; S188-V192 PolarHBondContact O-N 3.01Å; V192-E195 PolarHBondContact O-N 3.28Å; V192-I196 HydrophobicContact CG1-CD1 3.44Å; V192-I196 VanDerWaalsContact CG1-CD1 3.44Å; V192-I196 HydrophobicContact CG1-CG1 4.15Å; V192-I196 WeakPolarHBondContact O-CB 3.36Å; V192-I196 WeakPolarHBondContact O-CD1 3.23Å; V192-I196 WeakPolarHBondContact O-CG1 3.44Å; V192-I196 PolarHBondContact O-N 2.81Å
193	K	55.5	Low	53.2	Low	132 Å²	132	101.1 Å²	101.1	57%	0.574	57%	0.572	S	S	*	*	H	α-helix	trans	-68.7	-32.8	173.4	-176.5	179	-179.3	-178.6	0	112.8	V189 E190 S191 G197	V189-K193 WeakPolarHBondContact O-CB 3.33Å; V189-K193 PolarHBondContact O-N 3.34Å; E190-K193 PolarHBondContact O-N 2.91Å; S191-K193 VanDerWaalsContact C-N 3.31Å; S191-K193 PolarHBondContact O-N 2.92Å; K193-G197 PolarHBondContact O-N 3.01Å
194	K	59.2	Low	53.7	Low	147 Å²	147	98.8 Å²	98.8	64%	0.639	58%	0.579	S	S	*	*	H	α-helix	trans	-72.4	-42.2	174.2	-75.9	172.1	-177.5	177	0	111.1	E190 S191 G197 D198	E190-K194 WeakPolarHBondContact O-CB 3.36Å; E190-K194 VanDerWaalsContact O-CG 3.25Å; E190-K194 WeakPolarHBondContact O-CG 3.36Å; E190-K194 PolarHBondContact O-N 3.07Å; S191-K194 WeakPolarHBondContact O-CB 3.18Å; S191-K194 PolarHBondContact O-N 2.81Å; S191-K194 VanDerWaalsContact O-N 3.1Å; K194-G197 PolarHBondContact O-N 2.8Å; K194-D198 PolarHBondContact O-N 2.81Å
195	E	47.4	Very low	54.5	Low	126 Å²	126	97.9 Å²	97.9	59%	0.589	57%	0.565	S	S	*	*	H	α-helix	trans	-71.6	-37.3	177.5	-70.7	174.2	-175.2	0	0	112.3	S191 V192 G197 D198 L199	S191-E195 WeakPolarHBondContact O-CB 3.49Å; S191-E195 WeakPolarHBondContact O-CG 3.08Å; S191-E195 PolarHBondContact O-N 2.88Å; V192-E195 PolarHBondContact O-N 3.28Å; E195-G197 VanDerWaalsContact C-N 3.3Å; E195-D198 PolarHBondContact O-N 3.33Å; E195-L199 PolarHBondContact O-N 3.33Å
196	I	50.8	Low	55.4	Low	113 Å²	113	102.4 Å²	102.4	58%	0.579	58%	0.576	S	S	*	*	H	α-helix	trans	-69.7	-28.6	170.8	-72.4	170.3	0	0	0	111.5	V192 D198	V192-I196 HydrophobicContact CG1-CD1 3.44Å; V192-I196 VanDerWaalsContact CG1-CD1 3.44Å; V192-I196 HydrophobicContact CG1-CG1 4.15Å; V192-I196 WeakPolarHBondContact O-CB 3.36Å; V192-I196 WeakPolarHBondContact O-CD1 3.23Å; V192-I196 WeakPolarHBondContact O-CG1 3.44Å; V192-I196 PolarHBondContact O-N 2.81Å; I196-D198 PolarHBondContact O-N 3.49Å
197	G	50.2	Low	55.6	Low	67 Å²	67	102.2 Å²	102.2	69%	0.691	57%	0.573	S	S	*	*	H	α-helix	trans	-69	-20.3	172.4	0	0	0	0	0	113.7	K193 K194 E195	K193-G197 PolarHBondContact O-N 3.01Å; K194-G197 PolarHBondContact O-N 2.8Å; E195-G197 VanDerWaalsContact C-N 3.3Å
198	D	49.5	Very low	55.9	Low	152 Å²	152	99.3 Å²	99.3	81%	0.813	56%	0.563	S	S	*	*	H	α-helix	trans	-99.6	-16	-177.6	-149.1	35.9	0	0	0	112.5	K194 E195 I196	K194-D198 PolarHBondContact O-N 2.81Å; E195-D198 PolarHBondContact O-N 3.33Å; I196-D198 PolarHBondContact O-N 3.49Å
199	L	40.5	Very low	56.3	Low	133 Å²	133	100.7 Å²	100.7	70%	0.696	58%	0.579	S	S	*	*	S	Bend	trans	-87.5	111.5	172.2	-88.7	149.3	0	0	0	109.9	E195 Q201	E195-L199 PolarHBondContact O-N 3.33Å; L199-Q201 PolarHBondContact O-N 3.1Å
200	G	46.9	Very low	56.7	Low	61 Å²	61	106.5 Å²	106.5	63%	0.629	59%	0.591	S	S	*	*			trans	-16.3	121.5	175.2	0	0	0	0	0	117.2	T202	G200-T202 PolarHBondContact O-N 3.4Å
201	Q	50.9	Low	57.4	Low	107 Å²	107	102.1 Å²	102.1	50%	0.5	57%	0.571	S	S	.	*			trans	-28.4	111.4	176.4	-78.1	146.7	-56.5	0	0	115.7	L199	L199-Q201 PolarHBondContact O-N 3.1Å
202	T	46.8	Very low	58.2	Low	158 Å²	158	105.6 Å²	105.6	97%	0.969	58%	0.575	S	S	*	*			trans	-126.3	45.1	147.7	24.5	0	0	0	0	109.2	G200	G200-T202 PolarHBondContact O-N 3.4Å
203	G	54.9	Low	59	Low	45 Å²	45	104.7 Å²	104.7	46%	0.464	57%	0.565	S	S	.	*	S	Bend	trans	-140.5	157.9	179.1	0	0	0	0	0	111.9
204	P	63.4	Low	59.5	Low	123 Å²	123	98.8 Å²	98.8	80%	0.799	54%	0.54	S	S	*	.			trans	-58.3	146.1	179.5	23.6	-32.6	0	0	0	111.4	R206	P204-R206 PolarHBondContact O-N 3.43Å
205	Y	73.1	Confident	59.5	Low	29 Å²	29	95.6 Å²	95.6	11%	0.114	53%	0.532	C	S	.	.			trans	-49.3	133.1	-178.6	170.8	-92.4	0	0	0	111.5	P207 P331 E335 I375 L376 I378	Y205-P207 HydrophobicContact CE1-CB 4.38Å; Y205-P331 HydrophobicContact CE2-CB 4.21Å; Y205-P331 HydrophobicContact CE2-CG 4.27Å; Y205-E335 PolarHBondContact OH-OE1 2.93Å; Y205-I375 HydrophobicContact CD1-CB 4.13Å; Y205-I375 HydrophobicContact CD1-CG2 4.02Å; Y205-I375 HydrophobicContact CE1-CB 3.61Å; Y205-I375 HydrophobicContact CE1-CD1 4.29Å; Y205-I375 HydrophobicContact CE1-CG1 4.5Å; Y205-I375 HydrophobicContact CE1-CG2 3.78Å; Y205-L376 WeakPolarHBondContact CB-O 3.18Å; Y205-I378 HydrophobicContact CD2-CD1 3.93Å; Y205-I378 HydrophobicContact CD2-CG1 3.98Å; Y205-I378 HydrophobicContact CE2-CD1 3.42Å; Y205-I378 VanDerWaalsContact CE2-CD1 3.42Å; Y205-I378 HydrophobicContact CE2-CG1 3.98Å
206	R	68.5	Low	60.1	Low	192 Å²	192	94.1 Å²	94.1	73%	0.725	53%	0.525	S	S	*	.			trans	-122	122.9	178.8	-170	175.2	-171.5	155.3	7	109.3	P204	P204-R206 PolarHBondContact O-N 3.43Å
207	P	69.9	Low	60.2	Low	57 Å²	57	91.4 Å²	91.4	37%	0.37	51%	0.51	S	S	.	.			trans	-63.3	139.2	178.5	25.9	-34.3	0	0	0	110.4	Y205 A209 E335	Y205-P207 HydrophobicContact CE1-CB 4.38Å; P207-A209 PolarHBondContact O-N 2.82Å; P207-E335 WeakPolarHBondContact CB-OE1 3.4Å
208	P	66.8	Low	60.1	Low	38 Å²	38	90.7 Å²	90.7	25%	0.247	49%	0.494	C	S	.	.			trans	-58.2	136.3	172.8	20.9	-29.9	0	0	0	110.6	R210 L211 P331	P208-R210 VanDerWaalsContact C-N 3.25Å; P208-R210 PolarHBondContact O-N 2.72Å; P208-L211 HydrophobicContact CG-CD2 4.21Å; P208-P331 HydrophobicContact CG-CB 4.3Å
209	A	60.9	Low	59.7	Low	103 Å²	103	87.8 Å²	87.8	85%	0.851	49%	0.485	S	S	*	.	S	Bend	trans	-67.8	-25.5	-173.8	0	0	0	0	0	113.3	P207	P207-A209 PolarHBondContact O-N 2.82Å
210	R	69.4	Low	59.7	Low	214 Å²	214	89.9 Å²	89.9	81%	0.808	49%	0.489	S	S	*	.	S	Bend	trans	-138.6	130.7	171	-70.2	-175.1	176.8	175.4	-1.2	107.9	P208 R212	P208-R210 VanDerWaalsContact C-N 3.25Å; P208-R210 PolarHBondContact O-N 2.72Å; R210-R212 PolarHBondContact O-N 3.29Å
211	L	71.7	Confident	58.9	Low	18 Å²	18	88.4 Å²	88.4	9%	0.094	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-69.5	123.7	171.9	-64.1	177.1	0	0	0	108.2	P208 E335 A336 E341 V344	P208-L211 HydrophobicContact CG-CD2 4.21Å; L211-E335 HydrophobicContact CD1-CB 4.35Å; L211-E335 HydrophobicContact CD2-CB 3.48Å; L211-E335 VanDerWaalsContact CD2-CB 3.48Å; L211-E335 HydrophobicContact CD2-CG 4.33Å; L211-A336 HydrophobicContact CD1-CB 4.12Å; L211-E341 HydrophobicContact CD1-CB 4.34Å; L211-E341 HydrophobicContact CD1-CG 4.28Å; L211-E341 WeakPolarHBondContact CD1-OE2 3.12Å; L211-V344 HydrophobicContact CB-CG1 4.24Å; L211-V344 HydrophobicContact CB-CG2 3.99Å
212	R	71.1	Confident	58.2	Low	131 Å²	131	90.4 Å²	90.4	49%	0.494	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-90.1	138.1	-177.6	-65.1	178.6	-177.3	161.2	-2.1	109.5	R210 D328 N332 W348	R210-R212 PolarHBondContact O-N 3.29Å; R212-D328 IonicContact NH1-OD1 3.81Å; R212-N332 PolarHBondContact N-OD1 3.05Å; R212-W348 PolarHBondContact O-NE1 3.45Å
213	K	72.8	Confident	57.9	Low	52 Å²	52	86.4 Å²	86.4	23%	0.226	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-86.9	145.3	171.4	-69.6	177	174.4	-174.6	0	109.4	T215 E216 E343 V344 D347	K213-T215 PolarHBondContact O-N 2.76Å; K213-E216 HydrophobicContact CB-CG 4.1Å; K213-E216 PolarHBondContact N-OE2 2.91Å; K213-E216 WeakPolarHBondContact O-CB 3.23Å; K213-E216 PolarHBondContact O-N 3.24Å; K213-E343 IonicContact NZ-OE2 3.75Å; K213-E343 PolarHBondContact NZ-OE2 2.94Å; K213-V344 HydrophobicContact CG-CG2 4.2Å; K213-D347 WeakPolarHBondContact CB-OD2 3.48Å; K213-D347 VanDerWaalsContact CD-OD2 3.29Å; K213-D347 WeakPolarHBondContact CD-OD2 3.41Å; K213-D347 WeakPolarHBondContact CG-OD2 3.38Å
214	R	64.7	Low	57.4	Low	9 Å²	9	89.7 Å²	89.7	3%	0.034	49%	0.49	C	S	.	.	H	α-helix	trans	-54.1	-37.9	173.7	177.1	-172.9	149	154.8	-0.4	111.9	E216 F217 S218 D434 E437 A442 R445	R214-E216 PolarHBondContact O-N 3.14Å; R214-F217 WeakPolarHBondContact O-CB 3.08Å; R214-F217 PolarHBondContact O-N 3.24Å; R214-F217 VanDerWaalsContact O-N 3.11Å; R214-S218 PolarHBondContact O-N 3.43Å; R214-D434 IonicContact NH2-OD2 3.66Å; R214-E437 IonicContact CZ-OE2 3.64Å; R214-E437 IonicContact NE-OE2 2.82Å; R214-E437 IonicContact NH2-OE2 3.85Å; R214-E437 PolarHBondContact NH2-OE2 3.43Å; R214-A442 WeakPolarHBondContact CD-O 2.93Å; R214-A442 HydrophobicContact CG-CB 3.88Å; R214-A442 PolarHBondContact NE-O 2.95Å; R214-A442 PolarHBondContact NH1-O 3.29Å; R214-R445 VanDerWaalsContact NH1-CG 3.3Å
215	T	59.1	Low	56.2	Low	79 Å²	79	92.3 Å²	92.3	49%	0.485	50%	0.497	S	S	.	.	H	α-helix	trans	-64.8	-23.3	179.3	49.3	0	0	0	0	113.6	K213 F217 S218 S219	K213-T215 PolarHBondContact O-N 2.76Å; T215-F217 VanDerWaalsContact C-N 3.32Å; T215-S218 PolarHBondContact O-N 3.37Å; T215-S219 PolarHBondContact O-N 3.18Å; T215-S219 PolarHBondContact O-OG 3.46Å
216	E	59.4	Low	54.5	Low	95 Å²	95	94.1 Å²	94.1	44%	0.444	53%	0.525	S	S	.	.	H	α-helix	trans	-73.1	-25.4	175.1	-65.8	175.5	172.8	0	0	112.3	K213 R214 S219 K220	K213-E216 HydrophobicContact CB-CG 4.1Å; K213-E216 PolarHBondContact N-OE2 2.91Å; K213-E216 WeakPolarHBondContact O-CB 3.23Å; K213-E216 PolarHBondContact O-N 3.24Å; R214-E216 PolarHBondContact O-N 3.14Å; E216-S219 WeakPolarHBondContact CA-OG 3.26Å; E216-S219 PolarHBondContact O-OG 3.25Å; E216-K220 PolarHBondContact O-N 3.11Å
217	F	54.3	Low	53	Low	57 Å²	57	92 Å²	92	25%	0.25	52%	0.521	C	S	.	.	H	α-helix	trans	-76.1	-39.7	171.4	-88	-83.1	0	0	0	112.3	R214 T215 S219 K220 D328 N439 A442	R214-F217 WeakPolarHBondContact O-CB 3.08Å; R214-F217 PolarHBondContact O-N 3.24Å; R214-F217 VanDerWaalsContact O-N 3.11Å; T215-F217 VanDerWaalsContact C-N 3.32Å; F217-S219 PolarHBondContact O-N 3.4Å; F217-K220 PolarHBondContact O-N 3.28Å; F217-D328 WeakPolarHBondContact CE2-OD2 3.48Å; F217-D328 WeakPolarHBondContact CZ-OD2 3.25Å; F217-N439 PolarHBondContact O-ND2 3.04Å; F217-A442 HydrophobicContact CB-CB 4.27Å
218	S	48.2	Very low	51.5	Low	51 Å²	51	96.4 Å²	96.4	36%	0.357	55%	0.546	S	S	.	.	H	α-helix	trans	-62.9	-30.8	175.9	179.4	0	0	0	0	111.8	R214 T215	R214-S218 PolarHBondContact O-N 3.43Å; T215-S218 PolarHBondContact O-N 3.37Å
219	S	40	Very low	50.8	Low	91 Å²	91	101.3 Å²	101.3	64%	0.636	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-5.3	-179.7	51	0	0	0	0	115.7	T215 E216 F217	T215-S219 PolarHBondContact O-N 3.18Å; T215-S219 PolarHBondContact O-OG 3.46Å; E216-S219 WeakPolarHBondContact CA-OG 3.26Å; E216-S219 PolarHBondContact O-OG 3.25Å; F217-S219 PolarHBondContact O-N 3.4Å
220	K	40.1	Very low	49.9	Very low	177 Å²	177	105.4 Å²	105.4	77%	0.77	57%	0.566	S	S	*	*			trans	-132.7	42.6	-176	-76.9	-175.5	173.2	175.4	0	113.6	E216 F217	E216-K220 PolarHBondContact O-N 3.11Å; F217-K220 PolarHBondContact O-N 3.28Å
221	G	31.2	Very low	48.4	Very low	31 Å²	31	99.3 Å²	99.3	32%	0.32	56%	0.561	S	S	.	*			trans	-69.3	129.8	162.1	0	0	0	0	0	110.5	G223	G221-G223 PolarHBondContact O-N 3.03Å
222	P	36.4	Very low	47.2	Very low	148 Å²	148	105 Å²	105	96%	0.961	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	58.3	177.7	32.2	-33	0	0	0	111.3
223	G	40.9	Very low	46.4	Very low	75 Å²	75	106.9 Å²	106.9	77%	0.773	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	177.5	12	-178.7	0	0	0	0	0	116.4	G221	G221-G223 PolarHBondContact O-N 3.03Å
224	E	43.6	Very low	45.3	Very low	113 Å²	113	113.4 Å²	113.4	53%	0.528	64%	0.637	S	S	.	*			trans	-110.5	58.8	-171	-139	177.7	-168	0	0	113.7
225	D	38.9	Very low	44.5	Very low	179 Å²	179	116.9 Å²	116.9	96%	0.957	67%	0.668	S	S	*	*	S	Bend	trans	-104.3	19.6	165.4	-82.4	-29.3	0	0	0	112.1
226	G	36.7	Very low	43.7	Very low	67 Å²	67	121.4 Å²	121.4	69%	0.691	69%	0.685	S	S	*	*	S	Bend	trans	-142.3	8.2	-160.3	0	0	0	0	0	120.3
227	K	38.1	Very low	42.9	Very low	147 Å²	147	119.3 Å²	119.3	64%	0.639	69%	0.69	S	S	*	*			trans	-128.9	95.2	167.6	-86.2	-175.8	177.7	174.6	0	111.2	F229	K227-F229 HydrophobicContact CB-CD2 4.03Å; K227-F229 HydrophobicContact CB-CE1 4.49Å; K227-F229 HydrophobicContact CB-CE2 3.52Å; K227-F229 HydrophobicContact CB-CZ 3.8Å; K227-F229 HydrophobicContact CD-CE1 4.1Å; K227-F229 HydrophobicContact CD-CE2 4.17Å; K227-F229 HydrophobicContact CD-CZ 3.57Å; K227-F229 HydrophobicContact CG-CE2 4.47Å; K227-F229 HydrophobicContact CG-CZ 4.29Å; K227-F229 VanDerWaalsContact O-CD2 3.31Å; K227-F229 WeakPolarHBondContact O-CD2 3.14Å; K227-F229 PolarHBondContact O-N 3.22Å; K227-F229 VanDerWaalsContact O-N 3.15Å
228	V	37.2	Very low	42.5	Very low	150 Å²	150	123.3 Å²	123.3	91%	0.909	72%	0.718	S	S	*	*			trans	-66.1	106.1	158.8	179	0	0	0	0	106.2
229	F	52.2	Low	42.7	Very low	141 Å²	141	125.4 Å²	125.4	62%	0.618	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-85.8	119.4	170.7	-69.9	-81.3	0	0	0	108.5	K227 A231	K227-F229 HydrophobicContact CB-CD2 4.03Å; K227-F229 HydrophobicContact CB-CE1 4.49Å; K227-F229 HydrophobicContact CB-CE2 3.52Å; K227-F229 HydrophobicContact CB-CZ 3.8Å; K227-F229 HydrophobicContact CD-CE1 4.1Å; K227-F229 HydrophobicContact CD-CE2 4.17Å; K227-F229 HydrophobicContact CD-CZ 3.57Å; K227-F229 HydrophobicContact CG-CE2 4.47Å; K227-F229 HydrophobicContact CG-CZ 4.29Å; K227-F229 VanDerWaalsContact O-CD2 3.31Å; K227-F229 WeakPolarHBondContact O-CD2 3.14Å; K227-F229 PolarHBondContact O-N 3.22Å; K227-F229 VanDerWaalsContact O-N 3.15Å; F229-A231 PolarHBondContact O-N 3.13Å
230	E	42.2	Very low	43	Very low	189 Å²	189	128 Å²	128	88%	0.883	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-69.1	117.4	172.4	-146	168.3	-162.9	0	0	107.7	N232	E230-N232 PolarHBondContact O-N 3.22Å
231	A	37.7	Very low	43.6	Very low	86 Å²	86	123.4 Å²	123.4	71%	0.711	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-63.8	120	179.1	0	0	0	0	0	109.3	F229 E233	F229-A231 PolarHBondContact O-N 3.13Å; A231-E233 PolarHBondContact O-N 3.17Å
232	N	47.6	Very low	44.6	Very low	136 Å²	136	127.6 Å²	127.6	73%	0.727	73%	0.725	S	S	*	*			trans	-68.2	103.8	170.9	-103.7	-25.4	0	0	0	109.4	E230 E234 A235	E230-N232 PolarHBondContact O-N 3.22Å; N232-E234 PolarHBondContact O-N 3.29Å; N232-A235 PolarHBondContact O-N 3.19Å
233	E	53.4	Low	45.4	Very low	171 Å²	171	123 Å²	123	80%	0.799	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-67.2	-13.9	179.5	-60.5	-169.3	161.2	0	0	113.3	A231 A235	A231-E233 PolarHBondContact O-N 3.17Å; E233-A235 VanDerWaalsContact C-N 3.32Å; E233-A235 PolarHBondContact O-N 3.44Å
234	E	49.8	Very low	46.3	Very low	190 Å²	190	121.7 Å²	121.7	89%	0.888	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-76.9	-15.2	-179.9	-60.7	-173	170.8	0	0	113.8	N232	N232-E234 PolarHBondContact O-N 3.29Å
235	A	48.8	Very low	47.2	Very low	82 Å²	82	122.7 Å²	122.7	68%	0.678	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-97.9	22.4	-176.2	0	0	0	0	0	114	N232 E233 G237	N232-A235 PolarHBondContact O-N 3.19Å; E233-A235 VanDerWaalsContact C-N 3.32Å; E233-A235 PolarHBondContact O-N 3.44Å; A235-G237 PolarHBondContact O-N 3.34Å
236	M	40.7	Very low	48.3	Very low	173 Å²	173	114.9 Å²	114.9	85%	0.852	63%	0.631	S	S	*	*			trans	-78.8	47	169.1	-66	-153.6	-59.6	0	0	112.2
237	G	42.5	Very low	49.4	Very low	52 Å²	52	113.7 Å²	113.7	54%	0.536	61%	0.606	S	S	.	*			trans	-84.9	116.8	165.8	0	0	0	0	0	108.4	A235 V239	A235-G237 PolarHBondContact O-N 3.34Å; G237-V239 WeakPolarHBondContact O-CG2 3.25Å; G237-V239 PolarHBondContact O-N 3.47Å
238	V	47.4	Very low	50.7	Low	141 Å²	141	111.7 Å²	111.7	86%	0.855	60%	0.599	S	S	*	*			trans	-56.6	103.9	170.6	173.2	0	0	0	0	108.6	L240	V238-L240 PolarHBondContact O-N 3.33Å
239	V	50.7	Low	52.2	Low	94 Å²	94	107 Å²	107	57%	0.57	57%	0.567	S	S	*	*			trans	-84.3	102.4	178.2	178.1	0	0	0	0	108.7	G237 H241 K242	G237-V239 WeakPolarHBondContact O-CG2 3.25Å; G237-V239 PolarHBondContact O-N 3.47Å; V239-H241 PolarHBondContact O-N 3.36Å; V239-K242 HydrophobicContact CG1-CB 4.49Å; V239-K242 HydrophobicContact CG1-CD 4.36Å; V239-K242 HydrophobicContact CG1-CG 3.84Å
240	L	47.3	Very low	53	Low	145 Å²	145	100.6 Å²	100.6	76%	0.759	54%	0.539	S	S	*	.			trans	-71.8	104	156	-111.4	99	0	0	0	108.4	V238	V238-L240 PolarHBondContact O-N 3.33Å
241	H	52.1	Low	54.3	Low	82 Å²	82	95.9 Å²	95.9	38%	0.38	52%	0.515	S	S	.	.			trans	55	77.8	158.3	-44.4	-77.5	0	0	0	119.3	V239 D243 E351	V239-H241 PolarHBondContact O-N 3.36Å; H241-D243 VanDerWaalsContact C-N 3.29Å; H241-E351 IonicContact CE1-OE1 2.76Å; H241-E351 IonicContact CE1-OE2 3.72Å; H241-E351 IonicContact ND1-OE1 3.87Å; H241-E351 IonicContact ND1-OE2 3.21Å; H241-E351 PolarHBondContact ND1-OE2 3.42Å
242	K	53.5	Low	55.9	Low	118 Å²	118	96.8 Å²	96.8	51%	0.513	51%	0.509	S	S	.	.	H	α-helix	trans	-59.3	-41	156.8	-80.7	174.2	178.9	-174.2	0	110.9	V239 S244 K245 W246 E436	V239-K242 HydrophobicContact CG1-CB 4.49Å; V239-K242 HydrophobicContact CG1-CD 4.36Å; V239-K242 HydrophobicContact CG1-CG 3.84Å; K242-S244 VanDerWaalsContact C-N 3.35Å; K242-S244 PolarHBondContact O-N 3.3Å; K242-K245 PolarHBondContact O-N 2.95Å; K242-W246 PolarHBondContact O-N 3.41Å; K242-E436 IonicContact NZ-OE1 3.22Å; K242-E436 PolarHBondContact NZ-OE1 3.07Å
243	D	51.5	Low	56.9	Low	53 Å²	53	91.9 Å²	91.9	28%	0.283	48%	0.481	S	S	.	.	H	α-helix	trans	-68.5	-28.3	-176.5	-61.7	-1.5	0	0	0	113.8	H241 W246 Y247 Y350	H241-D243 VanDerWaalsContact C-N 3.29Å; D243-W246 PolarHBondContact O-N 3.08Å; D243-Y247 PolarHBondContact O-N 3.26Å; D243-Y350 HydrophobicContact CB-CD1 4.29Å
244	S	59.8	Low	57.5	Low	46 Å²	46	86.8 Å²	86.8	32%	0.322	46%	0.456	S	S	.	.	H	α-helix	trans	-70.9	-36.8	178.1	-178	0	0	0	0	112.4	K242 W246 Q248	K242-S244 VanDerWaalsContact C-N 3.35Å; K242-S244 PolarHBondContact O-N 3.3Å; S244-W246 VanDerWaalsContact C-N 3.3Å; S244-Q248 WeakPolarHBondContact O-CB 3.48Å; S244-Q248 WeakPolarHBondContact O-CG 3.32Å; S244-Q248 PolarHBondContact O-N 3.04Å; S244-Q248 VanDerWaalsContact O-N 3.07Å; S244-Q248 PolarHBondContact OG-NE2 2.93Å
245	K	64.2	Low	58.2	Low	135 Å²	135	82.3 Å²	82.3	59%	0.587	44%	0.438	S	S	*	.	H	α-helix	trans	-67.6	-37.7	176.6	-69.4	-174.8	178	-178.7	0	110.9	K242 Q248 Q249	K242-K245 PolarHBondContact O-N 2.95Å; K245-Q248 PolarHBondContact O-N 2.81Å; K245-Q249 WeakPolarHBondContact O-CG 3.4Å; K245-Q249 PolarHBondContact O-N 3.4Å
246	W	61	Low	58.8	Low	14 Å²	14	85.1 Å²	85.1	5%	0.053	44%	0.442	C	S	.	.	H	α-helix	trans	-65.7	-50.3	177.2	178.8	6.8	0	0	0	112.3	K242 D243 S244 Q248 Q249 W250 Y350 C432 L447	K242-W246 PolarHBondContact O-N 3.41Å; D243-W246 PolarHBondContact O-N 3.08Å; S244-W246 VanDerWaalsContact C-N 3.3Å; W246-Q248 PolarHBondContact O-N 3.06Å; W246-Q249 PolarHBondContact O-N 3.28Å; W246-W250 WeakPolarHBondContact O-CB 3.42Å; W246-W250 PolarHBondContact O-N 3.01Å; W246-Y350 HydrophobicContact CE3-CD1 4.11Å; W246-Y350 AromaticContact CE3-CE1 3.68Å; W246-Y350 HydrophobicContact CE3-CE1 3.68Å; W246-Y350 HydrophobicContact CE3-CE2 4.38Å; W246-Y350 AromaticContact CE3-CZ 3.89Å; W246-Y350 HydrophobicContact CH2-CD1 4.39Å; W246-Y350 AromaticContact CH2-CD2 3.92Å; W246-Y350 HydrophobicContact CH2-CD2 3.92Å; W246-Y350 AromaticContact CH2-CE1 3.64Å; W246-Y350 HydrophobicContact CH2-CE1 3.64Å; W246-Y350 AromaticContact CH2-CE2 3.04Å; W246-Y350 HydrophobicContact CH2-CE2 3.04Å; W246-Y350 AromaticContact CH2-CZ 2.91Å; W246-Y350 WeakPolarHBondContact CH2-OH 3.4Å; W246-Y350 HydrophobicContact CZ2-CD2 4.12Å; W246-Y350 AromaticContact CZ2-CE2 3.6Å; W246-Y350 HydrophobicContact CZ2-CE2 3.6Å; W246-Y350 AromaticContact CZ2-CZ 3.91Å; W246-Y350 AromaticContact CZ3-CD1 3.94Å; W246-Y350 HydrophobicContact CZ3-CD1 3.94Å; W246-Y350 HydrophobicContact CZ3-CD2 4.29Å; W246-Y350 AromaticContact CZ3-CE1 3.12Å; W246-Y350 HydrophobicContact CZ3-CE1 3.12Å; W246-Y350 AromaticContact CZ3-CE2 3.54Å; W246-Y350 HydrophobicContact CZ3-CE2 3.54Å; W246-Y350 HydrophobicContact CZ3-CG 4.48Å; W246-Y350 AromaticContact CZ3-CZ 2.92Å; W246-Y350 WeakPolarHBondContact CZ3-OH 3.46Å; W246-C432 HydrophobicContact CH2-CB 3.3Å; W246-C432 WeakPolarHBondContact CH2-SG 3.4Å; W246-C432 HydrophobicContact CZ2-CB 3.03Å; W246-C432 WeakPolarHBondContact CZ2-SG 3.17Å; W246-L447 HydrophobicContact CD2-CD1 3.94Å; W246-L447 HydrophobicContact CG-CD1 4.1Å; W246-L447 HydrophobicContact CZ2-CB 4.25Å; W246-L447 HydrophobicContact CZ2-CD1 3.69Å; W246-L447 HydrophobicContact CZ2-CD2 3.96Å; W246-L447 HydrophobicContact CZ2-CG 4.16Å
247	Y	60.3	Low	59.6	Low	43 Å²	43	79.2 Å²	79.2	17%	0.169	41%	0.414	C	S	.	.	H	α-helix	trans	-59.3	-37.5	175	-178.1	-101.1	0	0	0	112.1	D243 W250 K251 A352 Q356	D243-Y247 PolarHBondContact O-N 3.26Å; Y247-W250 PolarHBondContact O-N 3.41Å; Y247-K251 HydrophobicContact CE1-CD 3.95Å; Y247-K251 WeakPolarHBondContact O-CB 3.45Å; Y247-K251 PolarHBondContact O-N 3.36Å; Y247-A352 HydrophobicContact CD1-CB 4.02Å; Y247-A352 HydrophobicContact CD2-CB 3.6Å; Y247-A352 HydrophobicContact CE2-CB 4.25Å; Y247-A352 HydrophobicContact CG-CB 3.48Å; Y247-A352 VanDerWaalsContact CG-CB 3.48Å; Y247-Q356 PolarHBondContact OH-NE2 3.44Å
248	Q	64.1	Low	60.3	Low	104 Å²	104	80.7 Å²	80.7	49%	0.486	41%	0.412	S	S	.	.	H	α-helix	trans	-64.2	-48.1	176.4	-76	170	5.4	0	0	112.3	S244 K245 W246 W250 K251 D252	S244-Q248 WeakPolarHBondContact O-CB 3.48Å; S244-Q248 WeakPolarHBondContact O-CG 3.32Å; S244-Q248 PolarHBondContact O-N 3.04Å; S244-Q248 VanDerWaalsContact O-N 3.07Å; S244-Q248 PolarHBondContact OG-NE2 2.93Å; K245-Q248 PolarHBondContact O-N 2.81Å; W246-Q248 PolarHBondContact O-N 3.06Å; Q248-W250 VanDerWaalsContact C-N 3.28Å; Q248-W250 PolarHBondContact O-N 2.87Å; Q248-K251 PolarHBondContact O-N 3.47Å; Q248-D252 WeakPolarHBondContact O-CB 3.39Å; Q248-D252 PolarHBondContact O-N 2.75Å
249	Q	69.4	Low	60.6	Low	51 Å²	51	79 Å²	79	24%	0.238	40%	0.402	C	S	.	.	H	α-helix	trans	-63.8	-35.1	176.8	-72.3	176.3	-9.7	0	0	112.4	K245 W246 F253 M389 E390 Q391	K245-Q249 WeakPolarHBondContact O-CG 3.4Å; K245-Q249 PolarHBondContact O-N 3.4Å; W246-Q249 PolarHBondContact O-N 3.28Å; Q249-F253 PolarHBondContact O-N 3.44Å; Q249-F253 VanDerWaalsContact O-N 3.08Å; Q249-M389 VanDerWaalsContact C-CE 3.44Å; Q249-M389 HydrophobicContact CB-CE 3.44Å; Q249-M389 VanDerWaalsContact CB-CE 3.44Å; Q249-E390 VanDerWaalsContact NE2-CD 3.29Å; Q249-E390 PolarHBondContact NE2-OE2 3.12Å; Q249-Q391 VanDerWaalsContact OE1-OE1 3.09Å
250	W	68.6	Low	61.1	Low	7 Å²	7	75.6 Å²	75.6	3%	0.027	38%	0.379	C	S	.	.	H	α-helix	trans	-66.2	-46.3	174.4	174.1	-101.8	0	0	0	111	W246 Y247 Q248 F253 K254 M389 V394 I396 A430 L447 D448	W246-W250 WeakPolarHBondContact O-CB 3.42Å; W246-W250 PolarHBondContact O-N 3.01Å; Y247-W250 PolarHBondContact O-N 3.41Å; Q248-W250 VanDerWaalsContact C-N 3.28Å; Q248-W250 PolarHBondContact O-N 2.87Å; W250-F253 HydrophobicContact CE3-CD1 4.44Å; W250-F253 HydrophobicContact CZ3-CD1 4.35Å; W250-F253 WeakPolarHBondContact O-CB 3.49Å; W250-F253 PolarHBondContact O-N 3.21Å; W250-K254 WeakPolarHBondContact O-CB 3.16Å; W250-K254 PolarHBondContact O-N 3.23Å; W250-M389 HydrophobicContact CB-CE 4.07Å; W250-M389 VanDerWaalsContact N-CE 3.28Å; W250-V394 HydrophobicContact CH2-CG1 4.4Å; W250-V394 HydrophobicContact CZ3-CG1 3.92Å; W250-I396 HydrophobicContact CH2-CD1 3.55Å; W250-I396 HydrophobicContact CH2-CG1 4.06Å; W250-I396 HydrophobicContact CZ3-CD1 4.28Å; W250-A430 HydrophobicContact CH2-CB 3.56Å; W250-A430 HydrophobicContact CZ2-CB 3.53Å; W250-A430 HydrophobicContact CZ3-CB 4.33Å; W250-L447 HydrophobicContact CB-CD2 4.1Å; W250-L447 HydrophobicContact CD2-CD2 3.81Å; W250-L447 HydrophobicContact CE3-CD2 3.91Å; W250-L447 HydrophobicContact CG-CD2 3.88Å; W250-L447 HydrophobicContact CG-CG 4.42Å; W250-D448 HydrophobicContact CZ2-CB 4.23Å; W250-D448 VanDerWaalsContact NE1-CB 3.32Å; W250-D448 PolarHBondContact NE1-OD2 3.25Å
251	K	70.6	Confident	62	Low	90 Å²	90	71.5 Å²	71.5	39%	0.391	36%	0.358	S	S	.	.	H	α-helix	trans	-62.1	-44.1	178	-173	170.1	-176.6	176.6	0	111.2	Y247 Q248 F253 K254 D255	Y247-K251 HydrophobicContact CE1-CD 3.95Å; Y247-K251 WeakPolarHBondContact O-CB 3.45Å; Y247-K251 PolarHBondContact O-N 3.36Å; Q248-K251 PolarHBondContact O-N 3.47Å; K251-F253 VanDerWaalsContact C-N 3.28Å; K251-F253 PolarHBondContact O-N 2.97Å; K251-K254 PolarHBondContact O-N 3.42Å; K251-D255 VanDerWaalsContact CG-OD2 3.31Å; K251-D255 WeakPolarHBondContact CG-OD2 3.42Å; K251-D255 VanDerWaalsContact O-CB 3.23Å; K251-D255 WeakPolarHBondContact O-CB 3.46Å; K251-D255 VanDerWaalsContact O-CG 3.24Å; K251-D255 PolarHBondContact O-N 3.49Å
252	D	69.8	Low	62.6	Low	106 Å²	106	75.7 Å²	75.7	57%	0.567	37%	0.371	S	S	*	.	H	α-helix	trans	-61	-37.7	175.3	-68.9	-23.4	0	0	0	111.5	Q248 N256	Q248-D252 WeakPolarHBondContact O-CB 3.39Å; Q248-D252 PolarHBondContact O-N 2.75Å; D252-N256 WeakPolarHBondContact O-CB 3.3Å; D252-N256 PolarHBondContact O-N 3.25Å
253	F	69.9	Low	63.1	Low	33 Å²	33	73.2 Å²	73.2	15%	0.145	36%	0.36	C	S	.	.	H	α-helix	trans	-67.2	-48.7	173.7	170.1	-107.5	0	0	0	113.1	Q249 W250 K251 D255 N257 F260 M385 K387	Q249-F253 PolarHBondContact O-N 3.44Å; Q249-F253 VanDerWaalsContact O-N 3.08Å; W250-F253 HydrophobicContact CE3-CD1 4.44Å; W250-F253 HydrophobicContact CZ3-CD1 4.35Å; W250-F253 WeakPolarHBondContact O-CB 3.49Å; W250-F253 PolarHBondContact O-N 3.21Å; K251-F253 VanDerWaalsContact C-N 3.28Å; K251-F253 PolarHBondContact O-N 2.97Å; F253-D255 VanDerWaalsContact C-N 3.31Å; F253-D255 PolarHBondContact O-N 3.4Å; F253-N257 HydrophobicContact CE2-CB 4.44Å; F253-N257 VanDerWaalsContact O-CB 3.23Å; F253-N257 WeakPolarHBondContact O-CB 3.37Å; F253-N257 PolarHBondContact O-N 2.88Å; F253-F260 AromaticContact CE1-CD2 3.81Å; F253-F260 HydrophobicContact CE1-CD2 3.81Å; F253-F260 AromaticContact CE1-CE2 3.72Å; F253-F260 HydrophobicContact CE1-CE2 3.72Å; F253-F260 HydrophobicContact CE1-CZ 4.44Å; F253-F260 AromaticContact CZ-CD2 3.89Å; F253-F260 HydrophobicContact CZ-CD2 3.89Å; F253-F260 HydrophobicContact CZ-CE2 4.18Å; F253-M385 HydrophobicContact CZ-CE 4.21Å; F253-K387 HydrophobicContact CD1-CD 3.99Å; F253-K387 HydrophobicContact CD2-CD 3.9Å; F253-K387 HydrophobicContact CE1-CD 3.92Å; F253-K387 HydrophobicContact CE2-CD 3.8Å; F253-K387 HydrophobicContact CG-CD 3.97Å; F253-K387 HydrophobicContact CZ-CD 3.81Å
254	K	66.2	Low	63.7	Low	64 Å²	64	72.4 Å²	72.4	28%	0.278	35%	0.354	S	S	.	.	H	α-helix	trans	-59.6	-43.8	178.7	179.8	-165.8	167.9	105.7	0	111	W250 K251 N261 D448	W250-K254 WeakPolarHBondContact O-CB 3.16Å; W250-K254 PolarHBondContact O-N 3.23Å; K251-K254 PolarHBondContact O-N 3.42Å; K254-N261 PolarHBondContact O-ND2 3.07Å; K254-D448 IonicContact NZ-OD2 3.89Å
255	D	65	Low	63.9	Low	96 Å²	96	75.1 Å²	75.1	51%	0.513	36%	0.362	S	S	.	.	H	α-helix	trans	-79.3	-33.4	-174.9	-67.5	-12.7	0	0	0	111.8	K251 F253	K251-D255 VanDerWaalsContact CG-OD2 3.31Å; K251-D255 WeakPolarHBondContact CG-OD2 3.42Å; K251-D255 VanDerWaalsContact O-CB 3.23Å; K251-D255 WeakPolarHBondContact O-CB 3.46Å; K251-D255 VanDerWaalsContact O-CG 3.24Å; K251-D255 PolarHBondContact O-N 3.49Å; F253-D255 VanDerWaalsContact C-N 3.31Å; F253-D255 PolarHBondContact O-N 3.4Å
256	N	60.5	Low	63.9	Low	140 Å²	140	74.5 Å²	74.5	75%	0.749	36%	0.362	S	S	*	.	H	α-helix	trans	-81.4	-24.1	179.6	-165.4	12.1	0	0	0	112.9	D252 V258	D252-N256 WeakPolarHBondContact O-CB 3.3Å; D252-N256 PolarHBondContact O-N 3.25Å; N256-V258 PolarHBondContact O-N 2.95Å; N256-V258 VanDerWaalsContact O-N 3.15Å
257	N	57.8	Low	64.1	Low	50 Å²	50	76.1 Å²	76.1	27%	0.267	37%	0.37	S	S	.	.			trans	-89.2	87.5	-175.9	-160.4	-11.2	0	0	0	112.6	F253 V259 F260 N261	F253-N257 HydrophobicContact CE2-CB 4.44Å; F253-N257 VanDerWaalsContact O-CB 3.23Å; F253-N257 WeakPolarHBondContact O-CB 3.37Å; F253-N257 PolarHBondContact O-N 2.88Å; N257-V259 PolarHBondContact O-N 2.82Å; N257-V259 WeakPolarHBondContact OD1-CB 3.4Å; N257-V259 PolarHBondContact OD1-N 3.48Å; N257-V259 VanDerWaalsContact OD1-N 3.15Å; N257-F260 HydrophobicContact CB-CB 3.6Å; N257-F260 VanDerWaalsContact CG-CB 3.46Å; N257-F260 WeakPolarHBondContact O-CB 3.38Å; N257-F260 PolarHBondContact O-N 2.97Å; N257-F260 VanDerWaalsContact O-N 3.14Å; N257-F260 PolarHBondContact OD1-N 2.9Å; N257-N261 PolarHBondContact O-N 2.72Å; N257-N261 VanDerWaalsContact O-N 3.12Å
258	V	57.1	Low	64.2	Low	83 Å²	83	77.2 Å²	77.2	50%	0.503	38%	0.377	S	S	.	.	H	α-helix	trans	-58.4	-30.9	172.3	-179.7	0	0	0	0	111.7	N256 R262	N256-V258 PolarHBondContact O-N 2.95Å; N256-V258 VanDerWaalsContact O-N 3.15Å; V258-R262 HydrophobicContact CG1-CG 4.38Å; V258-R262 VanDerWaalsContact O-CB 3.29Å; V258-R262 WeakPolarHBondContact O-CB 3.49Å; V258-R262 WeakPolarHBondContact O-CG 3.46Å; V258-R262 PolarHBondContact O-N 2.77Å
259	V	54.2	Low	64.3	Low	106 Å²	106	78.5 Å²	78.5	64%	0.642	38%	0.381	S	S	*	.	H	α-helix	trans	-73.6	-37.3	178.2	-179.7	0	0	0	0	110.9	N257 F263	N257-V259 PolarHBondContact O-N 2.82Å; N257-V259 WeakPolarHBondContact OD1-CB 3.4Å; N257-V259 PolarHBondContact OD1-N 3.48Å; N257-V259 VanDerWaalsContact OD1-N 3.15Å; V259-F263 WeakPolarHBondContact O-CB 3.36Å; V259-F263 PolarHBondContact O-N 3.06Å
260	F	60.5	Low	64	Low	21 Å²	21	78.8 Å²	78.8	9%	0.092	38%	0.381	C	S	.	.	H	α-helix	trans	-59	-59.4	171.9	-173.1	-87.7	0	0	0	109.6	F253 N257 R262 F263 F264 M385 I396	F253-F260 AromaticContact CE1-CD2 3.81Å; F253-F260 HydrophobicContact CE1-CD2 3.81Å; F253-F260 AromaticContact CE1-CE2 3.72Å; F253-F260 HydrophobicContact CE1-CE2 3.72Å; F253-F260 HydrophobicContact CE1-CZ 4.44Å; F253-F260 AromaticContact CZ-CD2 3.89Å; F253-F260 HydrophobicContact CZ-CD2 3.89Å; F253-F260 HydrophobicContact CZ-CE2 4.18Å; N257-F260 HydrophobicContact CB-CB 3.6Å; N257-F260 VanDerWaalsContact CG-CB 3.46Å; N257-F260 WeakPolarHBondContact O-CB 3.38Å; N257-F260 PolarHBondContact O-N 2.97Å; N257-F260 VanDerWaalsContact O-N 3.14Å; N257-F260 PolarHBondContact OD1-N 2.9Å; F260-R262 VanDerWaalsContact C-N 3.27Å; F260-R262 PolarHBondContact O-N 3.06Å; F260-F263 PolarHBondContact O-N 3.3Å; F260-F264 AromaticContact CD1-CD2 3.37Å; F260-F264 HydrophobicContact CD1-CD2 3.37Å; F260-F264 AromaticContact CD1-CE2 3.56Å; F260-F264 HydrophobicContact CD1-CE2 3.56Å; F260-F264 AromaticContact CD2-CD2 3.99Å; F260-F264 HydrophobicContact CD2-CD2 3.99Å; F260-F264 AromaticContact CD2-CE2 3.35Å; F260-F264 HydrophobicContact CD2-CE2 3.35Å; F260-F264 HydrophobicContact CD2-CZ 4.34Å; F260-F264 AromaticContact CE1-CD2 3.36Å; F260-F264 HydrophobicContact CE1-CD2 3.36Å; F260-F264 AromaticContact CE1-CE2 3.32Å; F260-F264 HydrophobicContact CE1-CE2 3.32Å; F260-F264 HydrophobicContact CE1-CG 4.37Å; F260-F264 HydrophobicContact CE1-CZ 4.17Å; F260-F264 HydrophobicContact CE2-CD2 4.01Å; F260-F264 AromaticContact CE2-CE2 3.13Å; F260-F264 HydrophobicContact CE2-CE2 3.13Å; F260-F264 AromaticContact CE2-CZ 3.75Å; F260-F264 HydrophobicContact CE2-CZ 3.75Å; F260-F264 AromaticContact CG-CD2 3.67Å; F260-F264 HydrophobicContact CG-CD2 3.67Å; F260-F264 AromaticContact CG-CE2 3.55Å; F260-F264 HydrophobicContact CG-CE2 3.55Å; F260-F264 AromaticContact CZ-CD2 3.69Å; F260-F264 HydrophobicContact CZ-CD2 3.69Å; F260-F264 AromaticContact CZ-CE2 3.09Å; F260-F264 HydrophobicContact CZ-CE2 3.09Å; F260-F264 AromaticContact CZ-CZ 3.63Å; F260-F264 HydrophobicContact CZ-CZ 3.63Å; F260-F264 WeakPolarHBondContact O-CD2 3.35Å; F260-F264 PolarHBondContact O-N 3.38Å; F260-M385 HydrophobicContact CD2-CE 4.07Å; F260-M385 HydrophobicContact CD2-SD 3.94Å; F260-M385 HydrophobicContact CE2-CE 3.91Å; F260-M385 HydrophobicContact CE2-SD 3.46Å; F260-M385 WeakPolarHBondContact CE2-SD 3.17Å; F260-I396 HydrophobicContact CE2-CD1 3.93Å; F260-I396 HydrophobicContact CZ-CD1 4.07Å
261	N	65.7	Low	63.6	Low	59 Å²	59	79.9 Å²	79.9	32%	0.316	39%	0.387	S	S	.	.	H	α-helix	trans	-56.9	-40.9	-178.7	-66.1	-26.9	0	0	0	112	K254 N257 E265	K254-N261 PolarHBondContact O-ND2 3.07Å; N257-N261 PolarHBondContact O-N 2.72Å; N257-N261 VanDerWaalsContact O-N 3.12Å; N261-E265 WeakPolarHBondContact O-CB 3.45Å; N261-E265 VanDerWaalsContact O-CG 3.27Å; N261-E265 WeakPolarHBondContact O-CG 3.44Å; N261-E265 PolarHBondContact O-N 2.66Å
262	R	64.3	Low	63.2	Low	171 Å²	171	79 Å²	79	65%	0.645	38%	0.384	S	S	*	.	H	α-helix	trans	-68.9	-37.4	175.6	-74.8	179.1	-179	179.7	2.7	114.1	V258 F260 M266	V258-R262 HydrophobicContact CG1-CG 4.38Å; V258-R262 VanDerWaalsContact O-CB 3.29Å; V258-R262 WeakPolarHBondContact O-CB 3.49Å; V258-R262 WeakPolarHBondContact O-CG 3.46Å; V258-R262 PolarHBondContact O-N 2.77Å; F260-R262 VanDerWaalsContact C-N 3.27Å; F260-R262 PolarHBondContact O-N 3.06Å; R262-M266 WeakPolarHBondContact O-CB 3.33Å; R262-M266 PolarHBondContact O-N 2.86Å
263	F	65.4	Low	62.6	Low	66 Å²	66	75.7 Å²	75.7	29%	0.289	37%	0.369	S	S	.	.	H	α-helix	trans	-68.2	-44.3	176.7	177.1	-96.8	0	0	0	110.6	V259 F260 M266 K267 V293 V384	V259-F263 WeakPolarHBondContact O-CB 3.36Å; V259-F263 PolarHBondContact O-N 3.06Å; F260-F263 PolarHBondContact O-N 3.3Å; F263-M266 PolarHBondContact O-N 3.07Å; F263-K267 HydrophobicContact CE1-CD 4.41Å; F263-K267 WeakPolarHBondContact O-CB 3.29Å; F263-K267 PolarHBondContact O-N 3.48Å; F263-V293 HydrophobicContact CE2-CG2 4.23Å; F263-V293 HydrophobicContact CZ-CG1 4.41Å; F263-V293 HydrophobicContact CZ-CG2 3.98Å; F263-V384 HydrophobicContact CE1-CG1 4.47Å
264	F	64.4	Low	61.9	Low	35 Å²	35	80.6 Å²	80.6	15%	0.154	40%	0.397	C	S	.	.	H	α-helix	trans	-62.6	-47.9	174.7	-78.7	-74.1	0	0	0	111.2	F260 M266 K267 M268 M385 V428	F260-F264 AromaticContact CD1-CD2 3.37Å; F260-F264 HydrophobicContact CD1-CD2 3.37Å; F260-F264 AromaticContact CD1-CE2 3.56Å; F260-F264 HydrophobicContact CD1-CE2 3.56Å; F260-F264 AromaticContact CD2-CD2 3.99Å; F260-F264 HydrophobicContact CD2-CD2 3.99Å; F260-F264 AromaticContact CD2-CE2 3.35Å; F260-F264 HydrophobicContact CD2-CE2 3.35Å; F260-F264 HydrophobicContact CD2-CZ 4.34Å; F260-F264 AromaticContact CE1-CD2 3.36Å; F260-F264 HydrophobicContact CE1-CD2 3.36Å; F260-F264 AromaticContact CE1-CE2 3.32Å; F260-F264 HydrophobicContact CE1-CE2 3.32Å; F260-F264 HydrophobicContact CE1-CG 4.37Å; F260-F264 HydrophobicContact CE1-CZ 4.17Å; F260-F264 HydrophobicContact CE2-CD2 4.01Å; F260-F264 AromaticContact CE2-CE2 3.13Å; F260-F264 HydrophobicContact CE2-CE2 3.13Å; F260-F264 AromaticContact CE2-CZ 3.75Å; F260-F264 HydrophobicContact CE2-CZ 3.75Å; F260-F264 AromaticContact CG-CD2 3.67Å; F260-F264 HydrophobicContact CG-CD2 3.67Å; F260-F264 AromaticContact CG-CE2 3.55Å; F260-F264 HydrophobicContact CG-CE2 3.55Å; F260-F264 AromaticContact CZ-CD2 3.69Å; F260-F264 HydrophobicContact CZ-CD2 3.69Å; F260-F264 AromaticContact CZ-CE2 3.09Å; F260-F264 HydrophobicContact CZ-CE2 3.09Å; F260-F264 AromaticContact CZ-CZ 3.63Å; F260-F264 HydrophobicContact CZ-CZ 3.63Å; F260-F264 WeakPolarHBondContact O-CD2 3.35Å; F260-F264 PolarHBondContact O-N 3.38Å; F264-M266 VanDerWaalsContact C-N 3.28Å; F264-M266 PolarHBondContact O-N 3.21Å; F264-K267 PolarHBondContact O-N 2.87Å; F264-M268 WeakPolarHBondContact O-CB 3.24Å; F264-M268 PolarHBondContact O-N 3.09Å; F264-M385 HydrophobicContact CE2-SD 4.17Å; F264-M385 HydrophobicContact CZ-SD 3.98Å; F264-V428 HydrophobicContact CD1-CG2 4.35Å; F264-V428 HydrophobicContact CE1-CG1 3.93Å; F264-V428 HydrophobicContact CE1-CG2 4.41Å
265	E	64	Low	61.7	Low	103 Å²	103	82 Å²	82	48%	0.481	41%	0.408	S	S	.	.	H	α-helix	trans	-60.1	-37.1	175	-78.4	179.1	-166	0	0	112.8	N261 K269	N261-E265 WeakPolarHBondContact O-CB 3.45Å; N261-E265 VanDerWaalsContact O-CG 3.27Å; N261-E265 WeakPolarHBondContact O-CG 3.44Å; N261-E265 PolarHBondContact O-N 2.66Å; E265-K269 WeakPolarHBondContact O-CB 3.35Å; E265-K269 VanDerWaalsContact O-CG 3.28Å; E265-K269 WeakPolarHBondContact O-CG 3.3Å; E265-K269 PolarHBondContact O-N 3.39Å
266	M	63.1	Low	61.1	Low	123 Å²	123	83 Å²	83	61%	0.606	42%	0.417	S	S	*	.	H	α-helix	trans	-74.2	-44.4	-179.9	177.6	168.1	40.9	0	0	112.2	R262 F263 F264 M268 K269 Y270	R262-M266 WeakPolarHBondContact O-CB 3.33Å; R262-M266 PolarHBondContact O-N 2.86Å; F263-M266 PolarHBondContact O-N 3.07Å; F264-M266 VanDerWaalsContact C-N 3.28Å; F264-M266 PolarHBondContact O-N 3.21Å; M266-M268 VanDerWaalsContact C-N 3.27Å; M266-M268 PolarHBondContact O-N 3.05Å; M266-K269 PolarHBondContact O-N 3.08Å; M266-Y270 VanDerWaalsContact O-CB 3.24Å; M266-Y270 WeakPolarHBondContact O-CB 3.25Å; M266-Y270 PolarHBondContact O-N 3.16Å
267	K	65.6	Low	60.9	Low	47 Å²	47	82.4 Å²	82.4	20%	0.204	41%	0.412	C	S	.	.	H	α-helix	trans	-60.6	-42.6	171.9	-176.6	179.7	170.7	82.8	0	109.8	F263 F264 Y270 D271	F263-K267 HydrophobicContact CE1-CD 4.41Å; F263-K267 WeakPolarHBondContact O-CB 3.29Å; F263-K267 PolarHBondContact O-N 3.48Å; F264-K267 PolarHBondContact O-N 2.87Å; K267-Y270 WeakPolarHBondContact O-CB 3.38Å; K267-Y270 PolarHBondContact O-N 3.4Å; K267-D271 WeakPolarHBondContact O-CB 3.46Å; K267-D271 PolarHBondContact O-N 2.87Å
268	M	62.4	Low	60.8	Low	66 Å²	66	82.1 Å²	82.1	33%	0.325	41%	0.41	S	S	.	.	H	α-helix	trans	-60.9	-50.3	176.4	-167.7	178.1	83	0	0	111.3	F264 M266 Y270 D271 E272	F264-M268 WeakPolarHBondContact O-CB 3.24Å; F264-M268 PolarHBondContact O-N 3.09Å; M266-M268 VanDerWaalsContact C-N 3.27Å; M266-M268 PolarHBondContact O-N 3.05Å; M268-Y270 VanDerWaalsContact C-N 3.26Å; M268-Y270 PolarHBondContact O-N 2.88Å; M268-D271 CarbonylContact O-C 3.59Å; M268-D271 PolarHBondContact O-N 2.99Å; M268-E272 HydrophobicContact CG-CG 4.36Å; M268-E272 VanDerWaalsContact CG-OE1 3.24Å; M268-E272 WeakPolarHBondContact CG-OE1 3.48Å; M268-E272 WeakPolarHBondContact O-CB 3.39Å; M268-E272 WeakPolarHBondContact O-CG 3.47Å; M268-E272 PolarHBondContact O-N 3.21Å
269	K	66.2	Low	60.9	Low	131 Å²	131	87.2 Å²	87.2	57%	0.57	42%	0.42	S	S	*	.	H	α-helix	trans	-61.6	-32.7	174.8	-75.9	174.5	-175.7	170.7	0	113.4	E265 M266 S273	E265-K269 WeakPolarHBondContact O-CB 3.35Å; E265-K269 VanDerWaalsContact O-CG 3.28Å; E265-K269 WeakPolarHBondContact O-CG 3.3Å; E265-K269 PolarHBondContact O-N 3.39Å; M266-K269 PolarHBondContact O-N 3.08Å; K269-S273 WeakPolarHBondContact O-CB 3.43Å; K269-S273 PolarHBondContact O-N 3.34Å; K269-S273 VanDerWaalsContact O-N 3.13Å; K269-S273 PolarHBondContact O-OG 3.36Å
270	Y	63.5	Low	60.9	Low	58 Å²	58	85.2 Å²	85.2	23%	0.227	42%	0.415	C	S	.	.	H	α-helix	trans	-70	-45.6	176.9	-177.2	-93.1	0	0	0	111.1	M266 K267 M268 E272 S273 I278 S281 R282 T285	M266-Y270 VanDerWaalsContact O-CB 3.24Å; M266-Y270 WeakPolarHBondContact O-CB 3.25Å; M266-Y270 PolarHBondContact O-N 3.16Å; K267-Y270 WeakPolarHBondContact O-CB 3.38Å; K267-Y270 PolarHBondContact O-N 3.4Å; M268-Y270 VanDerWaalsContact C-N 3.26Å; M268-Y270 PolarHBondContact O-N 2.88Å; Y270-E272 VanDerWaalsContact C-N 3.35Å; Y270-S273 PolarHBondContact O-N 3.48Å; Y270-S273 PolarHBondContact O-OG 3.01Å; Y270-I278 HydrophobicContact CD2-CG2 4.02Å; Y270-I278 HydrophobicContact CE1-CG2 4.42Å; Y270-I278 HydrophobicContact CE2-CD1 4.46Å; Y270-I278 HydrophobicContact CE2-CG2 3.81Å; Y270-I278 HydrophobicContact CG-CG2 4.42Å; Y270-S281 WeakPolarHBondContact OH-CB 3.42Å; Y270-S281 PolarHBondContact OH-OG 3.13Å; Y270-R282 HydrophobicContact CE1-CG 4.16Å; Y270-R282 PolarHBondContact O-NH2 3.5Å; Y270-T285 HydrophobicContact CE1-CG2 3.92Å; Y270-T285 WeakPolarHBondContact OH-CB 3.48Å; Y270-T285 PolarHBondContact OH-OG1 3.4Å
271	D	59.5	Low	60.5	Low	29 Å²	29	85.6 Å²	85.6	16%	0.155	42%	0.421	C	S	.	.	H	α-helix	trans	-72	-26.6	176.2	-69.8	-16	0	0	0	112.7	K267 M268 R282 M426	K267-D271 WeakPolarHBondContact O-CB 3.46Å; K267-D271 PolarHBondContact O-N 2.87Å; M268-D271 CarbonylContact O-C 3.59Å; M268-D271 PolarHBondContact O-N 2.99Å; D271-R282 VanDerWaalsContact C-NH2 3.34Å; D271-R282 VanDerWaalsContact O-CZ 3.3Å; D271-R282 PolarHBondContact O-NH2 3.39Å; D271-M426 HydrophobicContact CB-CE 4.44Å
272	E	61.3	Low	60.3	Low	72 Å²	72	85.5 Å²	85.5	34%	0.336	42%	0.416	S	S	.	.	H	α-helix	trans	-79.5	-22.4	174.8	-77.8	173	179.2	0	0	113.1	M268 Y270 D274 T454	M268-E272 HydrophobicContact CG-CG 4.36Å; M268-E272 VanDerWaalsContact CG-OE1 3.24Å; M268-E272 WeakPolarHBondContact CG-OE1 3.48Å; M268-E272 WeakPolarHBondContact O-CB 3.39Å; M268-E272 WeakPolarHBondContact O-CG 3.47Å; M268-E272 PolarHBondContact O-N 3.21Å; Y270-E272 VanDerWaalsContact C-N 3.35Å; E272-D274 PolarHBondContact O-N 2.99Å; E272-D274 VanDerWaalsContact O-N 3.08Å; E272-T454 HydrophobicContact CG-CG2 3.7Å
273	S	58.1	Low	59.9	Low	37 Å²	37	80.3 Å²	80.3	26%	0.259	41%	0.409	S	S	.	.			trans	-74.7	106.4	-173.7	64.3	0	0	0	0	112.6	K269 Y270 N275 I278 R282	K269-S273 WeakPolarHBondContact O-CB 3.43Å; K269-S273 PolarHBondContact O-N 3.34Å; K269-S273 VanDerWaalsContact O-N 3.13Å; K269-S273 PolarHBondContact O-OG 3.36Å; Y270-S273 PolarHBondContact O-N 3.48Å; Y270-S273 PolarHBondContact O-OG 3.01Å; S273-N275 PolarHBondContact O-N 2.91Å; S273-I278 WeakPolarHBondContact OG-CB 3.37Å; S273-I278 WeakPolarHBondContact OG-CG2 3.42Å; S273-R282 PolarHBondContact O-NH2 2.91Å
274	D	55.1	Low	59.2	Low	135 Å²	135	81.4 Å²	81.4	72%	0.722	42%	0.421	S	S	*	.			trans	-72.3	16.1	177.5	-80.2	-29.5	0	0	0	114.9	E272 V276	E272-D274 PolarHBondContact O-N 2.99Å; E272-D274 VanDerWaalsContact O-N 3.08Å; D274-V276 PolarHBondContact O-N 3.47Å
275	N	61.3	Low	58.6	Low	94 Å²	94	81.7 Å²	81.7	50%	0.503	43%	0.426	S	S	.	.			trans	-73.3	129.6	177.5	-166.8	-27.9	0	0	0	109.8	S273 I277 I278 R279	S273-N275 PolarHBondContact O-N 2.91Å; N275-I277 PolarHBondContact O-N 2.95Å; N275-I277 VanDerWaalsContact O-N 3.1Å; N275-I277 PolarHBondContact OD1-N 3.47Å; N275-I278 HydrophobicContact CB-CB 4.42Å; N275-I278 HydrophobicContact CB-CG1 4.02Å; N275-I278 WeakPolarHBondContact O-CA 3.41Å; N275-I278 PolarHBondContact O-N 3.27Å; N275-R279 PolarHBondContact O-N 3.01Å
276	V	53	Low	58.2	Low	117 Å²	117	80.6 Å²	80.6	71%	0.709	42%	0.423	S	S	*	.	H	α-helix	trans	-53	-35.3	-177.8	177.8	0	0	0	0	112.4	D274 A280	D274-V276 PolarHBondContact O-N 3.47Å; V276-A280 WeakPolarHBondContact O-CB 3.46Å; V276-A280 PolarHBondContact O-N 3.06Å
277	I	55.6	Low	57.8	Low	127 Å²	127	81.8 Å²	81.8	65%	0.651	43%	0.425	S	S	*	.	H	α-helix	trans	-68.7	-37.7	176.6	-61	173.4	0	0	0	110.9	N275 A280 S281	N275-I277 PolarHBondContact O-N 2.95Å; N275-I277 VanDerWaalsContact O-N 3.1Å; N275-I277 PolarHBondContact OD1-N 3.47Å; I277-A280 PolarHBondContact O-N 2.82Å; I277-S281 WeakPolarHBondContact O-CB 3.26Å; I277-S281 PolarHBondContact O-N 3.1Å; I277-S281 PolarHBondContact O-OG 3.16Å
278	I	56.8	Low	56.4	Low	44 Å²	44	84 Å²	84	23%	0.226	44%	0.437	C	S	.	.	H	α-helix	trans	-73.4	-36.9	178	-54.2	-62.5	0	0	0	111.3	Y270 S273 N275 A280 S281 R282	Y270-I278 HydrophobicContact CD2-CG2 4.02Å; Y270-I278 HydrophobicContact CE1-CG2 4.42Å; Y270-I278 HydrophobicContact CE2-CD1 4.46Å; Y270-I278 HydrophobicContact CE2-CG2 3.81Å; Y270-I278 HydrophobicContact CG-CG2 4.42Å; S273-I278 WeakPolarHBondContact OG-CB 3.37Å; S273-I278 WeakPolarHBondContact OG-CG2 3.42Å; N275-I278 HydrophobicContact CB-CB 4.42Å; N275-I278 HydrophobicContact CB-CG1 4.02Å; N275-I278 WeakPolarHBondContact O-CA 3.41Å; N275-I278 PolarHBondContact O-N 3.27Å; I278-A280 PolarHBondContact O-N 2.98Å; I278-S281 VanDerWaalsContact CA-OG 3.22Å; I278-S281 WeakPolarHBondContact CA-OG 3.2Å; I278-S281 CarbonylContact O-C 3.54Å; I278-S281 PolarHBondContact O-N 3.15Å; I278-S281 VanDerWaalsContact O-N 3.16Å; I278-S281 PolarHBondContact O-OG 2.76Å; I278-R282 WeakPolarHBondContact O-CG 3.43Å; I278-R282 PolarHBondContact O-N 2.91Å
279	R	58.1	Low	55.7	Low	190 Å²	190	82.5 Å²	82.5	72%	0.717	43%	0.432	S	S	*	.	H	α-helix	trans	-61.2	-43.2	171.8	-170.6	-179.3	-175.6	-177.9	3.6	112.3	N275 S281 R282	N275-R279 PolarHBondContact O-N 3.01Å; R279-S281 VanDerWaalsContact C-N 3.31Å; R279-R282 WeakPolarHBondContact O-CB 3.39Å; R279-R282 PolarHBondContact O-N 3.14Å
280	A	54.8	Low	55	Low	64 Å²	64	81.3 Å²	81.3	53%	0.529	43%	0.432	S	S	.	.	H	α-helix	trans	-67.5	-34.8	174.7	0	0	0	0	0	111.6	V276 I277 I278	V276-A280 WeakPolarHBondContact O-CB 3.46Å; V276-A280 PolarHBondContact O-N 3.06Å; I277-A280 PolarHBondContact O-N 2.82Å; I278-A280 PolarHBondContact O-N 2.98Å
281	S	53.1	Low	54.1	Low	30 Å²	30	83.8 Å²	83.8	21%	0.21	45%	0.448	C	S	.	.	H	α-helix	trans	-71.9	-24.4	174.5	67.2	0	0	0	0	113.1	Y270 I277 I278 R279 A283 V284 T285	Y270-S281 WeakPolarHBondContact OH-CB 3.42Å; Y270-S281 PolarHBondContact OH-OG 3.13Å; I277-S281 WeakPolarHBondContact O-CB 3.26Å; I277-S281 PolarHBondContact O-N 3.1Å; I277-S281 PolarHBondContact O-OG 3.16Å; I278-S281 VanDerWaalsContact CA-OG 3.22Å; I278-S281 WeakPolarHBondContact CA-OG 3.2Å; I278-S281 CarbonylContact O-C 3.54Å; I278-S281 PolarHBondContact O-N 3.15Å; I278-S281 VanDerWaalsContact O-N 3.16Å; I278-S281 PolarHBondContact O-OG 2.76Å; R279-S281 VanDerWaalsContact C-N 3.31Å; S281-A283 VanDerWaalsContact C-N 3.35Å; S281-A283 PolarHBondContact O-N 2.77Å; S281-V284 CarbonylContact O-C 3.6Å; S281-V284 PolarHBondContact O-N 3.28Å; S281-T285 WeakPolarHBondContact O-CA 3.4Å; S281-T285 WeakPolarHBondContact O-CB 3.15Å; S281-T285 PolarHBondContact O-N 2.62Å; S281-T285 PolarHBondContact O-OG1 2.99Å; S281-T285 VanDerWaalsContact O-OG1 3.09Å
282	R	60.6	Low	53.1	Low	56 Å²	56	88 Å²	88	21%	0.211	47%	0.469	C	S	.	.	H	α-helix	trans	-54.3	-47.5	173	-73.3	178.2	-167	149.6	12	112.2	Y270 D271 S273 I278 R279 V284 T285 D286	Y270-R282 HydrophobicContact CE1-CG 4.16Å; Y270-R282 PolarHBondContact O-NH2 3.5Å; D271-R282 VanDerWaalsContact C-NH2 3.34Å; D271-R282 VanDerWaalsContact O-CZ 3.3Å; D271-R282 PolarHBondContact O-NH2 3.39Å; S273-R282 PolarHBondContact O-NH2 2.91Å; I278-R282 WeakPolarHBondContact O-CG 3.43Å; I278-R282 PolarHBondContact O-N 2.91Å; R279-R282 WeakPolarHBondContact O-CB 3.39Å; R279-R282 PolarHBondContact O-N 3.14Å; R282-V284 PolarHBondContact O-N 3.05Å; R282-T285 PolarHBondContact O-N 2.86Å; R282-D286 VanDerWaalsContact O-CB 3.26Å; R282-D286 WeakPolarHBondContact O-CB 3.11Å; R282-D286 PolarHBondContact O-N 3.02Å; R282-D286 VanDerWaalsContact O-OD2 3.1Å
283	A	56.5	Low	52.4	Low	62 Å²	62	86.7 Å²	86.7	51%	0.512	47%	0.466	S	S	.	.	H	α-helix	trans	-62.4	-23.4	179.4	0	0	0	0	0	114.4	S281 K287	S281-A283 VanDerWaalsContact C-N 3.35Å; S281-A283 PolarHBondContact O-N 2.77Å; A283-K287 WeakPolarHBondContact O-CD 3.22Å; A283-K287 WeakPolarHBondContact O-CG 3.36Å
284	V	49.3	Very low	51.7	Low	89 Å²	89	86 Å²	86	54%	0.539	47%	0.465	S	S	.	.	H	α-helix	trans	-95.1	-39.1	177.6	-179.5	0	0	0	0	110.7	S281 R282 M288	S281-V284 CarbonylContact O-C 3.6Å; S281-V284 PolarHBondContact O-N 3.28Å; R282-V284 PolarHBondContact O-N 3.05Å; V284-M288 WeakPolarHBondContact O-CB 3.48Å; V284-M288 PolarHBondContact O-N 3.2Å
285	T	52.7	Low	51	Low	42 Å²	42	80.6 Å²	80.6	26%	0.258	44%	0.441	S	S	.	.	H	α-helix	trans	-76.5	-33.2	-178.5	-65.7	0	0	0	0	111.5	Y270 S281 R282 K287 M288 T289	Y270-T285 HydrophobicContact CE1-CG2 3.92Å; Y270-T285 WeakPolarHBondContact OH-CB 3.48Å; Y270-T285 PolarHBondContact OH-OG1 3.4Å; S281-T285 WeakPolarHBondContact O-CA 3.4Å; S281-T285 WeakPolarHBondContact O-CB 3.15Å; S281-T285 PolarHBondContact O-N 2.62Å; S281-T285 PolarHBondContact O-OG1 2.99Å; S281-T285 VanDerWaalsContact O-OG1 3.09Å; R282-T285 PolarHBondContact O-N 2.86Å; T285-K287 VanDerWaalsContact C-N 3.3Å; T285-K287 PolarHBondContact O-N 2.82Å; T285-M288 CarbonylContact O-C 3.54Å; T285-M288 VanDerWaalsContact O-C 3.28Å; T285-M288 WeakPolarHBondContact O-CA 3.15Å; T285-M288 PolarHBondContact O-N 3.39Å; T285-T289 HydrophobicContact CG2-CG2 3.95Å; T285-T289 WeakPolarHBondContact O-CB 3.46Å; T285-T289 WeakPolarHBondContact O-CG2 3.44Å; T285-T289 PolarHBondContact O-N 3.42Å; T285-T289 PolarHBondContact O-OG1 3.34Å
286	D	55.9	Low	49.8	Very low	79 Å²	79	83.1 Å²	83.1	42%	0.422	45%	0.454	S	S	.	.	H	α-helix	trans	-60.3	-44.7	172.1	-67.6	-22.6	0	0	0	110.1	R282 M288 T289 D290	R282-D286 VanDerWaalsContact O-CB 3.26Å; R282-D286 WeakPolarHBondContact O-CB 3.11Å; R282-D286 PolarHBondContact O-N 3.02Å; R282-D286 VanDerWaalsContact O-OD2 3.1Å; D286-M288 VanDerWaalsContact C-N 3.28Å; D286-M288 PolarHBondContact O-N 3.35Å; D286-T289 VanDerWaalsContact CA-OG1 3.24Å; D286-T289 WeakPolarHBondContact CA-OG1 3.24Å; D286-T289 PolarHBondContact O-N 3.07Å; D286-T289 PolarHBondContact O-OG1 3.36Å; D286-D290 PolarHBondContact O-N 3.48Å; D286-D290 VanDerWaalsContact O-N 3.16Å
287	K	53.7	Low	49.1	Very low	149 Å²	149	86.3 Å²	86.3	65%	0.648	46%	0.459	S	S	*	.	H	α-helix	trans	-64.8	-34.1	171.9	-61.2	-178.5	-177.6	-174.3	0	112.1	A283 T285 I291	A283-K287 WeakPolarHBondContact O-CD 3.22Å; A283-K287 WeakPolarHBondContact O-CG 3.36Å; T285-K287 VanDerWaalsContact C-N 3.3Å; T285-K287 PolarHBondContact O-N 2.82Å; K287-I291 VanDerWaalsContact O-CD1 3.3Å; K287-I291 WeakPolarHBondContact O-CD1 3.33Å; K287-I291 VanDerWaalsContact O-CG1 3.29Å; K287-I291 WeakPolarHBondContact O-CG1 3.48Å
288	M	37.2	Very low	48.9	Very low	92 Å²	92	81.3 Å²	81.3	45%	0.453	44%	0.435	S	S	.	.	H	α-helix	trans	-82.3	-24.7	177.9	-124.1	83.8	-174.4	0	0	113	V284 T285 D286 I291 I292	V284-M288 WeakPolarHBondContact O-CB 3.48Å; V284-M288 PolarHBondContact O-N 3.2Å; T285-M288 CarbonylContact O-C 3.54Å; T285-M288 VanDerWaalsContact O-C 3.28Å; T285-M288 WeakPolarHBondContact O-CA 3.15Å; T285-M288 PolarHBondContact O-N 3.39Å; D286-M288 VanDerWaalsContact C-N 3.28Å; D286-M288 PolarHBondContact O-N 3.35Å; M288-I291 CarbonylContact O-C 3.41Å; M288-I291 PolarHBondContact O-N 2.9Å; M288-I292 HydrophobicContact CB-CD1 3.91Å; M288-I292 HydrophobicContact CG-CD1 3.48Å; M288-I292 VanDerWaalsContact CG-CD1 3.48Å; M288-I292 HydrophobicContact CG-CG1 4.17Å; M288-I292 WeakPolarHBondContact O-CA 3.1Å; M288-I292 WeakPolarHBondContact O-CB 3.47Å; M288-I292 WeakPolarHBondContact O-CG1 3.45Å; M288-I292 PolarHBondContact O-N 2.94Å
289	T	48.3	Very low	48.8	Very low	36 Å²	36	85.2 Å²	85.2	22%	0.221	45%	0.45	C	S	.	.	H	α-helix	trans	-75.3	-38.3	176.5	36.1	0	0	0	0	109.2	T285 D286 I291 I292 V293 G294	T285-T289 HydrophobicContact CG2-CG2 3.95Å; T285-T289 WeakPolarHBondContact O-CB 3.46Å; T285-T289 WeakPolarHBondContact O-CG2 3.44Å; T285-T289 PolarHBondContact O-N 3.42Å; T285-T289 PolarHBondContact O-OG1 3.34Å; D286-T289 VanDerWaalsContact CA-OG1 3.24Å; D286-T289 WeakPolarHBondContact CA-OG1 3.24Å; D286-T289 PolarHBondContact O-N 3.07Å; D286-T289 PolarHBondContact O-OG1 3.36Å; T289-I291 PolarHBondContact O-N 2.88Å; T289-I291 VanDerWaalsContact O-N 3.16Å; T289-I292 PolarHBondContact O-N 2.85Å; T289-V293 HydrophobicContact CG2-CG2 3.97Å; T289-V293 VanDerWaalsContact O-CA 3.32Å; T289-V293 WeakPolarHBondContact O-CA 3.24Å; T289-V293 WeakPolarHBondContact O-CB 3.41Å; T289-V293 PolarHBondContact O-N 2.97Å; T289-G294 PolarHBondContact O-N 3.16Å
290	D	49.8	Very low	49.1	Very low	106 Å²	106	80.6 Å²	80.6	57%	0.567	44%	0.443	S	S	*	.	H	α-helix	trans	-52.5	-35.7	165.3	-95.6	-20.4	0	0	0	111.9	D286 G294	D286-D290 PolarHBondContact O-N 3.48Å; D286-D290 VanDerWaalsContact O-N 3.16Å; D290-G294 WeakPolarHBondContact O-CA 3.46Å; D290-G294 PolarHBondContact O-N 2.92Å
291	I	45.8	Very low	49.9	Very low	110 Å²	110	82 Å²	82	56%	0.564	44%	0.439	S	S	*	.	H	α-helix	trans	-89.9	-36.7	-177.4	-64.4	169.4	0	0	0	113.2	K287 M288 T289 G295	K287-I291 VanDerWaalsContact O-CD1 3.3Å; K287-I291 WeakPolarHBondContact O-CD1 3.33Å; K287-I291 VanDerWaalsContact O-CG1 3.29Å; K287-I291 WeakPolarHBondContact O-CG1 3.48Å; M288-I291 CarbonylContact O-C 3.41Å; M288-I291 PolarHBondContact O-N 2.9Å; T289-I291 PolarHBondContact O-N 2.88Å; T289-I291 VanDerWaalsContact O-N 3.16Å; I291-G295 WeakPolarHBondContact O-CA 3.31Å; I291-G295 PolarHBondContact O-N 2.93Å; I291-G295 VanDerWaalsContact O-N 3.14Å
292	I	38.5	Very low	51.1	Low	117 Å²	117	81.7 Å²	81.7	60%	0.6	44%	0.435	S	S	*	.	H	α-helix	trans	-95.9	-45	-171.2	-65.2	168.3	0	0	0	110.5	M288 T289 G295	M288-I292 HydrophobicContact CB-CD1 3.91Å; M288-I292 HydrophobicContact CG-CD1 3.48Å; M288-I292 VanDerWaalsContact CG-CD1 3.48Å; M288-I292 HydrophobicContact CG-CG1 4.17Å; M288-I292 WeakPolarHBondContact O-CA 3.1Å; M288-I292 WeakPolarHBondContact O-CB 3.47Å; M288-I292 WeakPolarHBondContact O-CG1 3.45Å; M288-I292 PolarHBondContact O-N 2.94Å; T289-I292 PolarHBondContact O-N 2.85Å; I292-G295 PolarHBondContact O-N 2.86Å
293	V	46.6	Very low	51.9	Low	44 Å²	44	82 Å²	82	27%	0.267	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-38.1	172	-177.3	0	0	0	0	109.4	F263 T289 G295 S298	F263-V293 HydrophobicContact CE2-CG2 4.23Å; F263-V293 HydrophobicContact CZ-CG1 4.41Å; F263-V293 HydrophobicContact CZ-CG2 3.98Å; T289-V293 HydrophobicContact CG2-CG2 3.97Å; T289-V293 VanDerWaalsContact O-CA 3.32Å; T289-V293 WeakPolarHBondContact O-CA 3.24Å; T289-V293 WeakPolarHBondContact O-CB 3.41Å; T289-V293 PolarHBondContact O-N 2.97Å; V293-G295 PolarHBondContact O-N 2.87Å; V293-S298 PolarHBondContact O-OG 3.45Å
294	G	42.8	Very low	53.1	Low	22 Å²	22	84.4 Å²	84.4	23%	0.227	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	2.3	169.9	0	0	0	0	0	115.4	T289 D290 K299	T289-G294 PolarHBondContact O-N 3.16Å; D290-G294 WeakPolarHBondContact O-CA 3.46Å; D290-G294 PolarHBondContact O-N 2.92Å; G294-K299 WeakPolarHBondContact O-CD 3.06Å; G294-K299 WeakPolarHBondContact O-CE 3.36Å; G294-K299 WeakPolarHBondContact O-CG 3.34Å; G294-K299 PolarHBondContact O-NZ 3.42Å
295	G	39.7	Very low	54.8	Low	23 Å²	23	80.2 Å²	80.2	24%	0.237	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-52.4	-167.3	0	0	0	0	0	115.6	I291 I292 V293	I291-G295 WeakPolarHBondContact O-CA 3.31Å; I291-G295 PolarHBondContact O-N 2.93Å; I291-G295 VanDerWaalsContact O-N 3.14Å; I292-G295 PolarHBondContact O-N 2.86Å; V293-G295 PolarHBondContact O-N 2.87Å
296	L	37.3	Very low	56.3	Low	147 Å²	147	80.4 Å²	80.4	77%	0.77	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.3	-15.2	-161.6	-125.6	82.1	0	0	0	117.6
297	F	38.2	Very low	57.6	Low	184 Å²	184	80.1 Å²	80.1	81%	0.807	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.4	-11.7	-178.4	-77.5	-82.6	0	0	0	115.2
298	S	50.5	Low	59.1	Low	21 Å²	21	76 Å²	76	15%	0.147	40%	0.404	C	S	.	.	S	Bend	trans	-107.7	-20.8	177.6	63.4	0	0	0	0	113.6	V293 T300 E301 M302	V293-S298 PolarHBondContact O-OG 3.45Å; S298-T300 VanDerWaalsContact C-N 3.3Å; S298-T300 PolarHBondContact O-N 3.35Å; S298-E301 PolarHBondContact O-N 2.58Å; S298-M302 WeakPolarHBondContact O-CB 3.43Å; S298-M302 WeakPolarHBondContact O-CG 3.36Å; S298-M302 PolarHBondContact O-N 3Å
299	K	55	Low	61.4	Low	127 Å²	127	71.6 Å²	71.6	55%	0.552	38%	0.382	S	S	*	.	H	α-helix	trans	-60.2	-37.6	-173.4	-108.3	173.4	-177.6	155.3	0	113	G294 S303	G294-K299 WeakPolarHBondContact O-CD 3.06Å; G294-K299 WeakPolarHBondContact O-CE 3.36Å; G294-K299 WeakPolarHBondContact O-CG 3.34Å; G294-K299 PolarHBondContact O-NZ 3.42Å; K299-S303 WeakPolarHBondContact O-CB 3.5Å; K299-S303 PolarHBondContact O-N 3.19Å; K299-S303 PolarHBondContact O-OG 3.39Å
300	T	64.8	Low	63.1	Low	93 Å²	93	73.5 Å²	73.5	57%	0.571	39%	0.391	S	S	*	.	H	α-helix	trans	-71.7	-53.1	-179.6	52.4	0	0	0	0	111	S298 M302 S303 E304	S298-T300 VanDerWaalsContact C-N 3.3Å; S298-T300 PolarHBondContact O-N 3.35Å; T300-M302 PolarHBondContact O-N 2.82Å; T300-S303 PolarHBondContact O-N 2.87Å; T300-E304 WeakPolarHBondContact O-CB 3.27Å; T300-E304 VanDerWaalsContact O-CG 3.26Å; T300-E304 WeakPolarHBondContact O-CG 3.32Å; T300-E304 PolarHBondContact O-N 3.29Å
301	E	71.4	Confident	64.8	Low	92 Å²	92	74.8 Å²	74.8	43%	0.43	39%	0.391	S	S	.	.	H	α-helix	trans	-62.6	-43.6	179.4	-61.8	-176.9	174.6	0	0	111.5	S298 E304 V305	S298-E301 PolarHBondContact O-N 2.58Å; E301-E304 PolarHBondContact O-N 2.73Å; E301-V305 WeakPolarHBondContact O-CB 3.23Å; E301-V305 WeakPolarHBondContact O-CG2 3.49Å; E301-V305 PolarHBondContact O-N 2.92Å
302	M	77.9	Confident	66.5	Low	25 Å²	25	72.6 Å²	72.6	12%	0.123	38%	0.383	C	S	.	.	H	α-helix	trans	-63	-44.2	174.7	-71.7	-59.8	-66.6	0	0	112.3	S298 T300 E304 V305 L306 L383 M385 G386 L395	S298-M302 WeakPolarHBondContact O-CB 3.43Å; S298-M302 WeakPolarHBondContact O-CG 3.36Å; S298-M302 PolarHBondContact O-N 3Å; T300-M302 PolarHBondContact O-N 2.82Å; M302-E304 VanDerWaalsContact C-N 3.33Å; M302-V305 PolarHBondContact O-N 2.91Å; M302-L306 WeakPolarHBondContact O-CB 3.25Å; M302-L306 WeakPolarHBondContact O-CG 3.24Å; M302-L306 PolarHBondContact O-N 2.8Å; M302-L383 HydrophobicContact CE-CD2 3.72Å; M302-L383 HydrophobicContact CE-CG 4.07Å; M302-M385 VanDerWaalsContact SD-CA 3.54Å; M302-G386 WeakPolarHBondContact SD-CA 3.48Å; M302-G386 PolarHBondContact SD-N 3.25Å; M302-L395 HydrophobicContact CE-CD2 4.36Å
303	S	77.5	Confident	68.5	Low	63 Å²	63	68 Å²	68	44%	0.441	36%	0.359	S	S	.	.	H	α-helix	trans	-68	-36.7	-179.8	-61.3	0	0	0	0	111.1	K299 T300 T307	K299-S303 WeakPolarHBondContact O-CB 3.5Å; K299-S303 PolarHBondContact O-N 3.19Å; K299-S303 PolarHBondContact O-OG 3.39Å; T300-S303 PolarHBondContact O-N 2.87Å; S303-T307 WeakPolarHBondContact O-CB 3.3Å; S303-T307 PolarHBondContact O-N 2.97Å; S303-T307 PolarHBondContact O-OG1 3.48Å
304	E	81.9	Confident	70.3	Confident	112 Å²	112	71.1 Å²	71.1	52%	0.523	38%	0.381	S	S	.	.	H	α-helix	trans	-60.8	-49.9	173.2	-74.3	169.1	-162.3	0	0	110.7	T300 E301 M302 L306 T307 E308	T300-E304 WeakPolarHBondContact O-CB 3.27Å; T300-E304 VanDerWaalsContact O-CG 3.26Å; T300-E304 WeakPolarHBondContact O-CG 3.32Å; T300-E304 PolarHBondContact O-N 3.29Å; E301-E304 PolarHBondContact O-N 2.73Å; M302-E304 VanDerWaalsContact C-N 3.33Å; E304-L306 PolarHBondContact O-N 3.5Å; E304-T307 PolarHBondContact O-N 3.49Å; E304-E308 WeakPolarHBondContact O-CG 3.26Å; E304-E308 PolarHBondContact O-N 3.45Å
305	V	85.1	Confident	72.2	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-58.3	-49.6	176.9	172.5	0	0	0	0	111.8	E301 M302 T307 E308 I309 M388 P393 L395	E301-V305 WeakPolarHBondContact O-CB 3.23Å; E301-V305 WeakPolarHBondContact O-CG2 3.49Å; E301-V305 PolarHBondContact O-N 2.92Å; M302-V305 PolarHBondContact O-N 2.91Å; V305-T307 VanDerWaalsContact C-N 3.29Å; V305-T307 PolarHBondContact O-N 3.31Å; V305-E308 PolarHBondContact O-N 2.96Å; V305-I309 HydrophobicContact CG1-CD1 3.9Å; V305-I309 VanDerWaalsContact O-CG1 3.28Å; V305-I309 WeakPolarHBondContact O-CG1 3.29Å; V305-I309 PolarHBondContact O-N 3.5Å; V305-M388 HydrophobicContact CB-CG 4.48Å; V305-M388 HydrophobicContact CB-SD 4.24Å; V305-M388 HydrophobicContact CG2-CB 4.32Å; V305-M388 HydrophobicContact CG2-CG 3.58Å; V305-M388 VanDerWaalsContact CG2-N 3.3Å; V305-M388 HydrophobicContact CG2-SD 3.79Å; V305-P393 HydrophobicContact CG1-CB 3.7Å; V305-L395 HydrophobicContact CG1-CD2 3.72Å
306	L	83.4	Confident	74.4	Confident	47 Å²	47	74.9 Å²	74.9	25%	0.246	40%	0.396	C	S	.	.	H	α-helix	trans	-63.9	-36.9	178.5	-70.3	172.5	0	0	0	111.6	M302 E304 I309 L310 F316	M302-L306 WeakPolarHBondContact O-CB 3.25Å; M302-L306 WeakPolarHBondContact O-CG 3.24Å; M302-L306 PolarHBondContact O-N 2.8Å; E304-L306 PolarHBondContact O-N 3.5Å; L306-I309 HydrophobicContact CD2-CD1 4.5Å; L306-I309 PolarHBondContact O-N 3.5Å; L306-L310 WeakPolarHBondContact O-CB 3.24Å; L306-L310 VanDerWaalsContact O-CG 3.23Å; L306-L310 WeakPolarHBondContact O-CG 3.43Å; L306-L310 PolarHBondContact O-N 3.33Å; L306-F316 HydrophobicContact CD2-CD1 4.25Å; L306-F316 HydrophobicContact CD2-CE1 3.54Å; L306-F316 HydrophobicContact CD2-CZ 4.48Å
307	T	84.4	Confident	76.7	Confident	73 Å²	73	71.2 Å²	71.2	45%	0.448	38%	0.377	S	S	.	.	H	α-helix	trans	-64.8	-42.6	176.5	-59	0	0	0	0	110.8	S303 E304 V305 L310 K311	S303-T307 WeakPolarHBondContact O-CB 3.3Å; S303-T307 PolarHBondContact O-N 2.97Å; S303-T307 PolarHBondContact O-OG1 3.48Å; E304-T307 PolarHBondContact O-N 3.49Å; V305-T307 VanDerWaalsContact C-N 3.29Å; V305-T307 PolarHBondContact O-N 3.31Å; T307-L310 PolarHBondContact O-N 3.44Å; T307-K311 WeakPolarHBondContact O-CG 3.39Å; T307-K311 PolarHBondContact O-N 3.03Å
308	E	84.1	Confident	78.9	Confident	62 Å²	62	65.9 Å²	65.9	29%	0.29	35%	0.354	S	S	.	.	H	α-helix	trans	-65.8	-37.7	175.3	-67.2	-61.7	155	0	0	112.3	E304 V305 K311 M388	E304-E308 WeakPolarHBondContact O-CG 3.26Å; E304-E308 PolarHBondContact O-N 3.45Å; V305-E308 PolarHBondContact O-N 2.96Å; E308-K311 PolarHBondContact O-N 3.47Å; E308-K311 IonicContact OE1-NZ 3.91Å; E308-K311 PolarHBondContact OE1-NZ 3.44Å; E308-K311 WeakPolarHBondContact OE2-CD 3.49Å; E308-K311 IonicContact OE2-NZ 2.63Å; E308-K311 PolarHBondContact OE2-NZ 2.91Å; E308-M388 HydrophobicContact CB-CE 4.06Å; E308-M388 HydrophobicContact CB-SD 3.96Å; E308-M388 HydrophobicContact CG-CE 3.65Å; E308-M388 HydrophobicContact CG-SD 3.82Å
309	I	85.9	Confident	80.6	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-62.6	-47	173.3	-65.9	164	0	0	0	110.1	V305 L306 K311 V312 D313 F316 P393 L395 W444	V305-I309 HydrophobicContact CG1-CD1 3.9Å; V305-I309 VanDerWaalsContact O-CG1 3.28Å; V305-I309 WeakPolarHBondContact O-CG1 3.29Å; V305-I309 PolarHBondContact O-N 3.5Å; L306-I309 HydrophobicContact CD2-CD1 4.5Å; L306-I309 PolarHBondContact O-N 3.5Å; I309-K311 VanDerWaalsContact C-N 3.27Å; I309-K311 PolarHBondContact O-N 2.98Å; I309-V312 PolarHBondContact O-N 3.28Å; I309-V312 VanDerWaalsContact O-N 3.09Å; I309-D313 PolarHBondContact O-N 2.97Å; I309-F316 HydrophobicContact CB-CD1 4.49Å; I309-F316 HydrophobicContact CD1-CE1 4.48Å; I309-F316 HydrophobicContact CG2-CB 3.88Å; I309-F316 HydrophobicContact CG2-CD1 3.67Å; I309-F316 HydrophobicContact CG2-CD2 3.75Å; I309-F316 HydrophobicContact CG2-CE1 4.15Å; I309-F316 HydrophobicContact CG2-CE2 4.21Å; I309-F316 HydrophobicContact CG2-CG 3.45Å; I309-F316 VanDerWaalsContact CG2-CG 3.45Å; I309-F316 HydrophobicContact CG2-CZ 4.39Å; I309-P393 HydrophobicContact CD1-CB 4.1Å; I309-P393 HydrophobicContact CD1-CG 4.35Å; I309-P393 HydrophobicContact CG1-CB 3.77Å; I309-P393 HydrophobicContact CG1-CG 3.6Å; I309-L395 HydrophobicContact CD1-CD1 4.16Å; I309-L395 HydrophobicContact CD1-CD2 4.27Å; I309-L395 HydrophobicContact CD1-CG 4.26Å; I309-W444 HydrophobicContact CD1-CH2 4.06Å
310	L	85.3	Confident	82.1	Confident	75 Å²	75	66.8 Å²	66.8	39%	0.393	37%	0.368	S	S	.	.	H	α-helix	trans	-64.6	-28.3	-179.5	-74.8	168.6	0	0	0	113.5	L306 T307 V312 D313 P314 F316	L306-L310 WeakPolarHBondContact O-CB 3.24Å; L306-L310 VanDerWaalsContact O-CG 3.23Å; L306-L310 WeakPolarHBondContact O-CG 3.43Å; L306-L310 PolarHBondContact O-N 3.33Å; T307-L310 PolarHBondContact O-N 3.44Å; L310-V312 VanDerWaalsContact C-N 3.26Å; L310-V312 PolarHBondContact O-N 3.01Å; L310-D313 WeakPolarHBondContact CA-O 3.42Å; L310-D313 CarbonylContact O-C 3.48Å; L310-P314 WeakPolarHBondContact O-CA 3.38Å; L310-F316 HydrophobicContact CD2-CB 4.07Å
311	K	83.8	Confident	83.2	Confident	134 Å²	134	62.5 Å²	62.5	58%	0.583	34%	0.342	S	S	*	.	H	α-helix	trans	-62.7	-35	173.3	-75.5	174.7	-168.2	173.8	0	112.3	T307 E308 I309	T307-K311 WeakPolarHBondContact O-CG 3.39Å; T307-K311 PolarHBondContact O-N 3.03Å; E308-K311 PolarHBondContact O-N 3.47Å; E308-K311 IonicContact OE1-NZ 3.91Å; E308-K311 PolarHBondContact OE1-NZ 3.44Å; E308-K311 WeakPolarHBondContact OE2-CD 3.49Å; E308-K311 IonicContact OE2-NZ 2.63Å; E308-K311 PolarHBondContact OE2-NZ 2.91Å; I309-K311 VanDerWaalsContact C-N 3.27Å; I309-K311 PolarHBondContact O-N 2.98Å
312	V	82.1	Confident	84	Confident	64 Å²	64	59.2 Å²	59.2	39%	0.388	33%	0.327	S	S	.	.	H	α-helix	trans	-92.7	-38.8	-178.9	-174.1	0	0	0	0	111.1	I309 L310 R433	I309-V312 PolarHBondContact O-N 3.28Å; I309-V312 VanDerWaalsContact O-N 3.09Å; L310-V312 VanDerWaalsContact C-N 3.26Å; L310-V312 PolarHBondContact O-N 3.01Å; V312-R433 VanDerWaalsContact CB-NH1 3.28Å; V312-R433 VanDerWaalsContact CG1-NH2 3.32Å
313	D	81.9	Confident	84.5	Confident	20 Å²	20	64.2 Å²	64.2	11%	0.107	35%	0.348	C	S	.	.			trans	-128.3	94.8	176.9	179.6	9.4	0	0	0	111.1	I309 L310 S315 F316 P440	I309-D313 PolarHBondContact O-N 2.97Å; L310-D313 WeakPolarHBondContact CA-O 3.42Å; L310-D313 CarbonylContact O-C 3.48Å; D313-S315 PolarHBondContact O-N 2.82Å; D313-S315 VanDerWaalsContact O-N 3.16Å; D313-S315 WeakPolarHBondContact OD1-CB 3.14Å; D313-S315 PolarHBondContact OD1-N 3.24Å; D313-S315 PolarHBondContact OD1-OG 2.79Å; D313-F316 HydrophobicContact CB-CB 4.46Å; D313-F316 WeakPolarHBondContact O-CB 3.28Å; D313-F316 PolarHBondContact O-N 3.34Å; D313-P440 VanDerWaalsContact OD2-CB 3.24Å; D313-P440 WeakPolarHBondContact OD2-CB 3.26Å
314	P	83.4	Confident	84.9	Confident	110 Å²	110	62.6 Å²	62.6	71%	0.714	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-15	178.7	-22.6	34.2	0	0	0	114.4	L310 F316	L310-P314 WeakPolarHBondContact O-CA 3.38Å; P314-F316 VanDerWaalsContact C-N 3.32Å
315	S	83.6	Confident	85.2	Confident	93 Å²	93	57.2 Å²	57.2	65%	0.65	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	0.2	179.8	71.7	0	0	0	0	113.4	D313 D317	D313-S315 PolarHBondContact O-N 2.82Å; D313-S315 VanDerWaalsContact O-N 3.16Å; D313-S315 WeakPolarHBondContact OD1-CB 3.14Å; D313-S315 PolarHBondContact OD1-N 3.24Å; D313-S315 PolarHBondContact OD1-OG 2.79Å; S315-D317 PolarHBondContact O-N 3.21Å
316	F	85.1	Confident	85.2	Confident	31 Å²	31	60.5 Å²	60.5	14%	0.136	32%	0.324	C	S	.	.			trans	-65.2	125.9	-177	-176.8	-97.8	0	0	0	112.2	L306 I309 L310 D313 P314 F321 L395 W444	L306-F316 HydrophobicContact CD2-CD1 4.25Å; L306-F316 HydrophobicContact CD2-CE1 3.54Å; L306-F316 HydrophobicContact CD2-CZ 4.48Å; I309-F316 HydrophobicContact CB-CD1 4.49Å; I309-F316 HydrophobicContact CD1-CE1 4.48Å; I309-F316 HydrophobicContact CG2-CB 3.88Å; I309-F316 HydrophobicContact CG2-CD1 3.67Å; I309-F316 HydrophobicContact CG2-CD2 3.75Å; I309-F316 HydrophobicContact CG2-CE1 4.15Å; I309-F316 HydrophobicContact CG2-CE2 4.21Å; I309-F316 HydrophobicContact CG2-CG 3.45Å; I309-F316 VanDerWaalsContact CG2-CG 3.45Å; I309-F316 HydrophobicContact CG2-CZ 4.39Å; L310-F316 HydrophobicContact CD2-CB 4.07Å; D313-F316 HydrophobicContact CB-CB 4.46Å; D313-F316 WeakPolarHBondContact O-CB 3.28Å; D313-F316 PolarHBondContact O-N 3.34Å; P314-F316 VanDerWaalsContact C-N 3.32Å; F316-F321 HydrophobicContact CE2-CB 3.72Å; F316-F321 HydrophobicContact CE2-CD2 4.02Å; F316-F321 AromaticContact CE2-CG 3.88Å; F316-F321 HydrophobicContact CE2-CG 3.88Å; F316-F321 HydrophobicContact CZ-CB 3.89Å; F316-F321 HydrophobicContact CZ-CD1 4.38Å; F316-F321 HydrophobicContact CZ-CD2 4.5Å; F316-F321 AromaticContact CZ-CG 4Å; F316-F321 HydrophobicContact CZ-CG 4Å; F316-L395 HydrophobicContact CZ-CD1 4.1Å; F316-W444 HydrophobicContact CD2-CZ2 4.4Å; F316-W444 HydrophobicContact CE2-CH2 4.32Å; F316-W444 AromaticContact CE2-CZ2 3.65Å; F316-W444 HydrophobicContact CE2-CZ2 3.65Å; F316-W444 HydrophobicContact CZ-CZ2 4.27Å
317	D	85.9	Confident	85.2	Confident	70 Å²	70	64.2 Å²	64.2	37%	0.374	34%	0.34	S	S	.	.			trans	-131.3	138.6	176	169.4	52	0	0	0	110.2	S315 D319 S320 F321	S315-D317 PolarHBondContact O-N 3.21Å; D317-D319 PolarHBondContact OD2-N 3.09Å; D317-S320 PolarHBondContact O-N 2.82Å; D317-S320 WeakPolarHBondContact OD2-CB 3.44Å; D317-S320 PolarHBondContact OD2-N 3.32Å; D317-S320 PolarHBondContact OD2-OG 2.59Å; D317-F321 WeakPolarHBondContact O-CB 3.43Å; D317-F321 PolarHBondContact O-N 3.12Å
318	K	84.1	Confident	85.2	Confident	71 Å²	71	61.5 Å²	61.5	31%	0.309	32%	0.323	S	S	.	.	H	α-helix	trans	-62.5	-46.7	-176.2	175.6	-177.3	166.5	177.1	0	110.9	S320 F321 L322 L383	K318-S320 VanDerWaalsContact C-N 3.34Å; K318-F321 WeakPolarHBondContact O-CB 3.17Å; K318-F321 PolarHBondContact O-N 3.17Å; K318-L322 HydrophobicContact CG-CD1 4.28Å; K318-L322 WeakPolarHBondContact O-CG 3.34Å; K318-L322 PolarHBondContact O-N 2.86Å; K318-L383 HydrophobicContact CD-CD2 4.03Å; K318-L383 HydrophobicContact CG-CD2 4.08Å
319	D	85.6	Confident	85.4	Confident	99 Å²	99	58.6 Å²	58.6	53%	0.529	31%	0.309	S	S	.	.	H	α-helix	trans	-69.9	-37.8	-174.9	-64.7	-30.6	0	0	0	110.8	D317 L322 K323	D317-D319 PolarHBondContact OD2-N 3.09Å; D319-L322 PolarHBondContact O-N 2.86Å; D319-K323 WeakPolarHBondContact O-CG 3.29Å; D319-K323 PolarHBondContact O-N 3.28Å
320	S	86.7	Confident	85.7	Confident	68 Å²	68	58.6 Å²	58.6	48%	0.476	31%	0.309	S	S	.	.	H	α-helix	trans	-63.7	-40.5	173.2	-57.9	0	0	0	0	112	D317 K318 K323 Q324	D317-S320 PolarHBondContact O-N 2.82Å; D317-S320 WeakPolarHBondContact OD2-CB 3.44Å; D317-S320 PolarHBondContact OD2-N 3.32Å; D317-S320 PolarHBondContact OD2-OG 2.59Å; K318-S320 VanDerWaalsContact C-N 3.34Å; S320-K323 PolarHBondContact O-N 3.41Å; S320-Q324 PolarHBondContact O-N 3.01Å
321	F	88.1	Confident	85.9	Confident	4 Å²	4	55.4 Å²	55.4	2%	0.018	29%	0.293	C	S	.	.	H	α-helix	trans	-65.1	-41.5	174.5	172.5	-107.7	0	0	0	112.8	F316 D317 K318 K323 Q324 C325 I329 L395 I397 L431 W444	F316-F321 HydrophobicContact CE2-CB 3.72Å; F316-F321 HydrophobicContact CE2-CD2 4.02Å; F316-F321 AromaticContact CE2-CG 3.88Å; F316-F321 HydrophobicContact CE2-CG 3.88Å; F316-F321 HydrophobicContact CZ-CB 3.89Å; F316-F321 HydrophobicContact CZ-CD1 4.38Å; F316-F321 HydrophobicContact CZ-CD2 4.5Å; F316-F321 AromaticContact CZ-CG 4Å; F316-F321 HydrophobicContact CZ-CG 4Å; D317-F321 WeakPolarHBondContact O-CB 3.43Å; D317-F321 PolarHBondContact O-N 3.12Å; K318-F321 WeakPolarHBondContact O-CB 3.17Å; K318-F321 PolarHBondContact O-N 3.17Å; F321-K323 VanDerWaalsContact C-N 3.35Å; F321-K323 PolarHBondContact O-N 3.32Å; F321-Q324 WeakPolarHBondContact O-CB 3.44Å; F321-Q324 PolarHBondContact O-N 2.85Å; F321-C325 WeakPolarHBondContact CZ-SG 3.44Å; F321-C325 PolarHBondContact O-N 2.85Å; F321-C325 PolarHBondContact O-SG 3.33Å; F321-I329 HydrophobicContact CE2-CD1 4.49Å; F321-L395 HydrophobicContact CD1-CD1 4.13Å; F321-L395 HydrophobicContact CE1-CD1 3.67Å; F321-L395 HydrophobicContact CZ-CD1 3.99Å; F321-I397 HydrophobicContact CE1-CG2 4.2Å; F321-L431 HydrophobicContact CZ-CD1 3.92Å; F321-W444 HydrophobicContact CD2-CD2 4.46Å; F321-W444 AromaticContact CD2-CE2 3.81Å; F321-W444 AromaticContact CD2-CZ2 3.9Å; F321-W444 HydrophobicContact CD2-CZ2 3.9Å; F321-W444 AromaticContact CD2-NE1 3.88Å; F321-W444 AromaticContact CE2-CD2 3.57Å; F321-W444 HydrophobicContact CE2-CD2 3.57Å; F321-W444 AromaticContact CE2-CE2 3.35Å; F321-W444 HydrophobicContact CE2-CE3 4Å; F321-W444 HydrophobicContact CE2-CG 4.05Å; F321-W444 HydrophobicContact CE2-CH2 4.07Å; F321-W444 AromaticContact CE2-CZ2 3.64Å; F321-W444 HydrophobicContact CE2-CZ2 3.64Å; F321-W444 HydrophobicContact CE2-CZ3 4.23Å; F321-W444 AromaticContact CE2-NE1 3.67Å; F321-W444 HydrophobicContact CZ-CD2 4.18Å; F321-W444 HydrophobicContact CZ-CE3 4.15Å; F321-W444 HydrophobicContact CZ-CH2 4.24Å; F321-W444 HydrophobicContact CZ-CZ2 4.27Å; F321-W444 HydrophobicContact CZ-CZ3 4.17Å
322	L	88.3	Confident	86.1	Confident	23 Å²	23	49.1 Å²	49.1	12%	0.12	27%	0.266	C	S	.	.	H	α-helix	trans	-63.5	-41	176.5	-72	175.2	0	0	0	111.6	K318 D319 Q324 C325 E326 I381 L383	K318-L322 HydrophobicContact CG-CD1 4.28Å; K318-L322 WeakPolarHBondContact O-CG 3.34Å; K318-L322 PolarHBondContact O-N 2.86Å; D319-L322 PolarHBondContact O-N 2.86Å; L322-Q324 VanDerWaalsContact C-N 3.34Å; L322-Q324 PolarHBondContact O-N 2.81Å; L322-C325 WeakPolarHBondContact O-CB 3.37Å; L322-C325 PolarHBondContact O-N 3.45Å; L322-E326 PolarHBondContact O-N 3.49Å; L322-I381 HydrophobicContact CD2-CG2 4.04Å; L322-L383 HydrophobicContact CD2-CB 4.2Å
323	K	87.7	Confident	86.5	Confident	130 Å²	130	46.1 Å²	46.1	57%	0.565	25%	0.247	S	C	*	.	H	α-helix	trans	-62.4	-40	173.1	-72.3	174.3	-178	173.6	0	112.3	D319 S320 F321 C325 E326 Q327	D319-K323 WeakPolarHBondContact O-CG 3.29Å; D319-K323 PolarHBondContact O-N 3.28Å; S320-K323 PolarHBondContact O-N 3.41Å; F321-K323 VanDerWaalsContact C-N 3.35Å; F321-K323 PolarHBondContact O-N 3.32Å; K323-C325 VanDerWaalsContact C-N 3.33Å; K323-E326 PolarHBondContact O-N 2.76Å; K323-Q327 WeakPolarHBondContact O-CB 3.02Å; K323-Q327 WeakPolarHBondContact O-CG 2.97Å; K323-Q327 PolarHBondContact O-N 2.87Å
324	Q	86.4	Confident	86.9	Confident	28 Å²	28	45.3 Å²	45.3	13%	0.131	24%	0.243	C	C	.	.	H	α-helix	trans	-64.1	-41.2	174.7	-170.2	-167.6	0.7	0	0	111.4	S320 F321 L322 E326 Q327 D328 I329 Y441	S320-Q324 PolarHBondContact O-N 3.01Å; F321-Q324 WeakPolarHBondContact O-CB 3.44Å; F321-Q324 PolarHBondContact O-N 2.85Å; L322-Q324 VanDerWaalsContact C-N 3.34Å; L322-Q324 PolarHBondContact O-N 2.81Å; Q324-E326 VanDerWaalsContact C-N 3.32Å; Q324-E326 PolarHBondContact O-N 3.48Å; Q324-Q327 PolarHBondContact O-N 2.9Å; Q324-D328 PolarHBondContact O-N 2.87Å; Q324-I329 HydrophobicContact CG-CD1 4.44Å; Q324-I329 PolarHBondContact O-N 2.75Å; Q324-Y441 HydrophobicContact CG-CD1 4.5Å; Q324-Y441 VanDerWaalsContact NE2-CA 3.35Å; Q324-Y441 PolarHBondContact NE2-O 3.2Å; Q324-Y441 VanDerWaalsContact NE2-O 3.08Å
325	C	87.7	Confident	87.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.21	C	C	.	.	I	π-helix	trans	-59.1	-46.2	174.7	-70.5	0	0	0	0	111.2	F321 L322 K323 I330 I397	F321-C325 WeakPolarHBondContact CZ-SG 3.44Å; F321-C325 PolarHBondContact O-N 2.85Å; F321-C325 PolarHBondContact O-SG 3.33Å; L322-C325 WeakPolarHBondContact O-CB 3.37Å; L322-C325 PolarHBondContact O-N 3.45Å; K323-C325 VanDerWaalsContact C-N 3.33Å; C325-I330 HydrophobicContact CB-CD1 4.02Å; C325-I330 HydrophobicContact CB-CG1 4.39Å; C325-I330 VanDerWaalsContact O-CB 3.26Å; C325-I330 WeakPolarHBondContact O-CB 3.5Å; C325-I330 WeakPolarHBondContact O-CD1 3.33Å; C325-I330 VanDerWaalsContact O-CG1 3.25Å; C325-I330 WeakPolarHBondContact O-CG1 3.42Å; C325-I330 PolarHBondContact O-N 3.22Å; C325-I397 HydrophobicContact CB-CD1 4.43Å
326	E	86.2	Confident	87.5	Confident	69 Å²	69	36 Å²	36	32%	0.322	18%	0.179	S	C	.	.	I	π-helix	trans	-63.3	-43.6	179.5	-174.6	173.1	-176.7	0	0	113.2	L322 K323 Q324 P331 I381	L322-E326 PolarHBondContact O-N 3.49Å; K323-E326 PolarHBondContact O-N 2.76Å; Q324-E326 VanDerWaalsContact C-N 3.32Å; Q324-E326 PolarHBondContact O-N 3.48Å; E326-P331 VanDerWaalsContact O-CD 3.23Å; E326-P331 WeakPolarHBondContact O-CD 3.37Å; E326-P331 WeakPolarHBondContact O-CG 3.23Å; E326-I381 VanDerWaalsContact CA-CD1 3.49Å; E326-I381 HydrophobicContact CB-CD1 3.35Å; E326-I381 HydrophobicContact CG-CD1 3.49Å; E326-I381 VanDerWaalsContact CG-CD1 3.49Å
327	Q	83.6	Confident	87.7	Confident	125 Å²	125	36.6 Å²	36.6	58%	0.584	18%	0.183	S	C	*	.	I	π-helix	trans	-87.1	-33.5	-170.5	-68.9	-178.5	-8.4	0	0	113.8	K323 Q324	K323-Q327 WeakPolarHBondContact O-CB 3.02Å; K323-Q327 WeakPolarHBondContact O-CG 2.97Å; K323-Q327 PolarHBondContact O-N 2.87Å; Q324-Q327 PolarHBondContact O-N 2.9Å
328	D	84.6	Confident	87.8	Confident	16 Å²	16	33.8 Å²	33.8	9%	0.086	17%	0.168	C	C	.	.	I	π-helix	trans	-125.4	-56.9	-168.7	-162	47.8	0	0	0	112.4	R212 F217 Q324 N332	R212-D328 IonicContact NH1-OD1 3.81Å; F217-D328 WeakPolarHBondContact CE2-OD2 3.48Å; F217-D328 WeakPolarHBondContact CZ-OD2 3.25Å; Q324-D328 PolarHBondContact O-N 2.87Å; D328-N332 VanDerWaalsContact O-CB 3.23Å; D328-N332 WeakPolarHBondContact O-CB 3.43Å; D328-N332 PolarHBondContact O-N 3.33Å; D328-N332 VanDerWaalsContact O-N 3.15Å; D328-N332 PolarHBondContact O-ND2 3.18Å; D328-N332 PolarHBondContact OD1-ND2 2.8Å
329	I	88.6	Confident	88	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	17%	0.17	C	C	.	.	I	π-helix	trans	-66.7	-54.2	-170.1	-56	173.1	0	0	0	111.1	F321 Q324 I333 W348 L431 W444	F321-I329 HydrophobicContact CE2-CD1 4.49Å; Q324-I329 HydrophobicContact CG-CD1 4.44Å; Q324-I329 PolarHBondContact O-N 2.75Å; I329-I333 HydrophobicContact CG2-CD1 3.75Å; I329-I333 WeakPolarHBondContact O-CB 3.44Å; I329-I333 WeakPolarHBondContact O-CG1 3.44Å; I329-I333 PolarHBondContact O-N 3.39Å; I329-I333 VanDerWaalsContact O-N 3.16Å; I329-W348 HydrophobicContact CB-CZ3 4.41Å; I329-W348 HydrophobicContact CG1-CH2 4.2Å; I329-W348 HydrophobicContact CG1-CZ3 3.97Å; I329-W348 HydrophobicContact CG2-CE3 4.46Å; I329-W348 HydrophobicContact CG2-CZ3 4.16Å; I329-L431 HydrophobicContact CG2-CD1 4.4Å; I329-L431 HydrophobicContact CG2-CD2 4.26Å; I329-W444 HydrophobicContact CD1-CB 4.21Å; I329-W444 HydrophobicContact CD1-CG 4.4Å
330	I	90.6	Very high	88	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.8	-53.1	-176.3	-62.1	163.3	0	0	0	110.6	C325 N332 I333 L334 I378 I381 I397 F399 W429	C325-I330 HydrophobicContact CB-CD1 4.02Å; C325-I330 HydrophobicContact CB-CG1 4.39Å; C325-I330 VanDerWaalsContact O-CB 3.26Å; C325-I330 WeakPolarHBondContact O-CB 3.5Å; C325-I330 WeakPolarHBondContact O-CD1 3.33Å; C325-I330 VanDerWaalsContact O-CG1 3.25Å; C325-I330 WeakPolarHBondContact O-CG1 3.42Å; C325-I330 PolarHBondContact O-N 3.22Å; I330-N332 VanDerWaalsContact C-N 3.35Å; I330-N332 PolarHBondContact O-N 3.14Å; I330-I333 PolarHBondContact O-N 2.66Å; I330-L334 HydrophobicContact CG2-CD1 4.1Å; I330-L334 WeakPolarHBondContact O-CB 3.47Å; I330-L334 PolarHBondContact O-N 2.81Å; I330-I378 HydrophobicContact CG2-CD1 4.04Å; I330-I378 HydrophobicContact CG2-CG2 4.23Å; I330-I381 HydrophobicContact CD1-CD1 3.74Å; I330-I381 HydrophobicContact CD1-CG1 3.93Å; I330-I381 HydrophobicContact CD1-CG2 3.99Å; I330-I397 HydrophobicContact CD1-CD1 4.13Å; I330-I397 HydrophobicContact CG1-CD1 4.28Å; I330-F399 HydrophobicContact CD1-CD1 3.83Å; I330-F399 HydrophobicContact CD1-CE1 4.14Å; I330-F399 HydrophobicContact CD1-CG 4.12Å; I330-F399 HydrophobicContact CG1-CD1 4.28Å; I330-F399 HydrophobicContact CG1-CE1 4.08Å; I330-F399 HydrophobicContact CG1-CZ 4.45Å; I330-F399 HydrophobicContact CG2-CD1 4.49Å; I330-F399 HydrophobicContact CG2-CD2 4.13Å; I330-F399 HydrophobicContact CG2-CE1 4.02Å; I330-F399 HydrophobicContact CG2-CE2 3.61Å; I330-F399 HydrophobicContact CG2-CZ 3.55Å; I330-W429 HydrophobicContact CB-CH2 4.42Å; I330-W429 HydrophobicContact CB-CZ3 4.26Å; I330-W429 HydrophobicContact CG1-CE3 4.33Å; I330-W429 HydrophobicContact CG1-CZ3 3.97Å; I330-W429 HydrophobicContact CG2-CH2 4.18Å; I330-W429 HydrophobicContact CG2-CZ3 4.45Å
331	P	89.7	Confident	88	Confident	8 Å²	8	30.5 Å²	30.5	5%	0.052	14%	0.139	C	C	.	.	H	α-helix	trans	-60.1	-41.4	-178	-25.6	36.6	0	0	0	113.2	Y205 P208 E326 E335 I378	Y205-P331 HydrophobicContact CE2-CB 4.21Å; Y205-P331 HydrophobicContact CE2-CG 4.27Å; P208-P331 HydrophobicContact CG-CB 4.3Å; E326-P331 VanDerWaalsContact O-CD 3.23Å; E326-P331 WeakPolarHBondContact O-CD 3.37Å; E326-P331 WeakPolarHBondContact O-CG 3.23Å; P331-E335 WeakPolarHBondContact O-CB 3.38Å; P331-E335 WeakPolarHBondContact O-CG 3.14Å; P331-E335 PolarHBondContact O-N 3.44Å; P331-I378 HydrophobicContact CG-CD1 4.46Å
332	N	89	Confident	88	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.011	15%	0.146	C	C	.	.	H	α-helix	trans	-66	-47.5	-178.8	-74.7	-41.7	0	0	0	112	R212 D328 I330 A336	R212-N332 PolarHBondContact N-OD1 3.05Å; D328-N332 VanDerWaalsContact O-CB 3.23Å; D328-N332 WeakPolarHBondContact O-CB 3.43Å; D328-N332 PolarHBondContact O-N 3.33Å; D328-N332 VanDerWaalsContact O-N 3.15Å; D328-N332 PolarHBondContact O-ND2 3.18Å; D328-N332 PolarHBondContact OD1-ND2 2.8Å; I330-N332 VanDerWaalsContact C-N 3.35Å; I330-N332 PolarHBondContact O-N 3.14Å; N332-A336 WeakPolarHBondContact O-CB 3.28Å; N332-A336 PolarHBondContact O-N 3.16Å
333	I	90.3	Very high	88.1	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-68	-45.6	-178.8	-66.5	174.4	0	0	0	110.2	I329 I330 A336 M337 L345 W348 W429 L446	I329-I333 HydrophobicContact CG2-CD1 3.75Å; I329-I333 WeakPolarHBondContact O-CB 3.44Å; I329-I333 WeakPolarHBondContact O-CG1 3.44Å; I329-I333 PolarHBondContact O-N 3.39Å; I329-I333 VanDerWaalsContact O-N 3.16Å; I330-I333 PolarHBondContact O-N 2.66Å; I333-A336 PolarHBondContact O-N 2.89Å; I333-M337 HydrophobicContact CG2-CG 4.49Å; I333-M337 HydrophobicContact CG2-SD 4.19Å; I333-M337 VanDerWaalsContact O-CG 3.32Å; I333-M337 WeakPolarHBondContact O-CG 3.42Å; I333-M337 PolarHBondContact O-N 2.92Å; I333-L345 HydrophobicContact CG2-CD1 4.39Å; I333-W348 HydrophobicContact CD1-CB 3.92Å; I333-W348 HydrophobicContact CD1-CD2 4.23Å; I333-W348 HydrophobicContact CD1-CE3 4.05Å; I333-W348 HydrophobicContact CD1-CG 4.23Å; I333-W348 HydrophobicContact CG1-CB 3.73Å; I333-W348 HydrophobicContact CG1-CD2 4.06Å; I333-W348 HydrophobicContact CG1-CE3 4.36Å; I333-W348 HydrophobicContact CG1-CG 3.8Å; I333-W429 HydrophobicContact CB-CH2 3.61Å; I333-W429 HydrophobicContact CB-CZ3 3.89Å; I333-W429 HydrophobicContact CD1-CH2 4.49Å; I333-W429 HydrophobicContact CD1-CZ3 3.91Å; I333-W429 HydrophobicContact CG1-CZ3 4.46Å; I333-W429 HydrophobicContact CG2-CH2 3.5Å; I333-W429 VanDerWaalsContact CG2-CH2 3.5Å; I333-W429 HydrophobicContact CG2-CZ2 4.08Å; I333-W429 HydrophobicContact CG2-CZ3 3.95Å; I333-L446 HydrophobicContact CD1-CB 4.34Å; I333-L446 HydrophobicContact CG2-CD2 4.16Å
334	L	90	Very high	88.1	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-66.3	-44.3	-175.8	-147.8	162	0	0	0	110.7	I330 M337 I338 I375 F399 A401 L403 Y427 W429	I330-L334 HydrophobicContact CG2-CD1 4.1Å; I330-L334 WeakPolarHBondContact O-CB 3.47Å; I330-L334 PolarHBondContact O-N 2.81Å; L334-M337 PolarHBondContact O-N 3.37Å; L334-I338 HydrophobicContact CD2-CD1 3.29Å; L334-I338 HydrophobicContact CD2-CG1 4.08Å; L334-I338 WeakPolarHBondContact O-CB 3.18Å; L334-I338 VanDerWaalsContact O-CG1 3.25Å; L334-I338 WeakPolarHBondContact O-CG1 3.49Å; L334-I338 PolarHBondContact O-N 2.8Å; L334-I375 HydrophobicContact CB-CD1 3.97Å; L334-I375 HydrophobicContact CD2-CD1 3.29Å; L334-I375 HydrophobicContact CD2-CG1 3.69Å; L334-I375 HydrophobicContact CG-CD1 4.11Å; L334-F399 HydrophobicContact CD1-CE2 3.56Å; L334-F399 HydrophobicContact CD1-CZ 3.89Å; L334-A401 HydrophobicContact CD1-CB 4.17Å; L334-L403 HydrophobicContact CD2-CD2 3.76Å; L334-Y427 HydrophobicContact CD1-CD2 4.36Å; L334-Y427 HydrophobicContact CD1-CE2 4.01Å; L334-W429 HydrophobicContact CB-CH2 4.37Å
335	E	89.1	Confident	88.2	Confident	7 Å²	7	29.8 Å²	29.8	3%	0.033	14%	0.138	C	C	.	.	H	α-helix	trans	-64.3	-39.7	173.3	-73.4	-76.5	158.4	0	0	112.3	Y205 P207 L211 P331 M337 I338 R339 I375	Y205-E335 PolarHBondContact OH-OE1 2.93Å; P207-E335 WeakPolarHBondContact CB-OE1 3.4Å; L211-E335 HydrophobicContact CD1-CB 4.35Å; L211-E335 HydrophobicContact CD2-CB 3.48Å; L211-E335 VanDerWaalsContact CD2-CB 3.48Å; L211-E335 HydrophobicContact CD2-CG 4.33Å; P331-E335 WeakPolarHBondContact O-CB 3.38Å; P331-E335 WeakPolarHBondContact O-CG 3.14Å; P331-E335 PolarHBondContact O-N 3.44Å; E335-M337 VanDerWaalsContact C-N 3.32Å; E335-M337 PolarHBondContact O-N 3.42Å; E335-I338 PolarHBondContact O-N 2.9Å; E335-R339 WeakPolarHBondContact O-CB 3.17Å; E335-R339 VanDerWaalsContact O-CG 3.31Å; E335-R339 WeakPolarHBondContact O-CG 3.32Å; E335-R339 PolarHBondContact O-N 3.28Å; E335-R339 IonicContact OE2-CZ 3.2Å; E335-R339 IonicContact OE2-NE 2.84Å; E335-R339 PolarHBondContact OE2-NE 2.89Å; E335-R339 IonicContact OE2-NH2 2.79Å; E335-R339 PolarHBondContact OE2-NH2 2.87Å; E335-I375 HydrophobicContact CG-CD1 3.75Å; E335-I375 VanDerWaalsContact OE1-CD1 3.27Å; E335-I375 WeakPolarHBondContact OE1-CD1 3.05Å
336	A	90.4	Very high	88.3	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.4	-40.3	177.2	0	0	0	0	0	111.8	L211 N332 I333 G340 E341 V344	L211-A336 HydrophobicContact CD1-CB 4.12Å; N332-A336 WeakPolarHBondContact O-CB 3.28Å; N332-A336 PolarHBondContact O-N 3.16Å; I333-A336 PolarHBondContact O-N 2.89Å; A336-G340 CarbonylContact O-C 3.55Å; A336-G340 WeakPolarHBondContact O-CA 3.12Å; A336-G340 PolarHBondContact O-N 3.13Å; A336-E341 HydrophobicContact CB-CB 4.47Å; A336-E341 PolarHBondContact O-N 2.96Å; A336-V344 HydrophobicContact CB-CB 4.04Å; A336-V344 HydrophobicContact CB-CG1 3.87Å
337	M	89	Confident	88.4	Confident	44 Å²	44	34.9 Å²	34.9	22%	0.217	16%	0.162	C	C	.	.	H	α-helix	trans	-62.6	-46	174.9	-73.6	-179.3	57.5	0	0	111.9	I333 L334 E335 G340 L345 L357 I449	I333-M337 HydrophobicContact CG2-CG 4.49Å; I333-M337 HydrophobicContact CG2-SD 4.19Å; I333-M337 VanDerWaalsContact O-CG 3.32Å; I333-M337 WeakPolarHBondContact O-CG 3.42Å; I333-M337 PolarHBondContact O-N 2.92Å; L334-M337 PolarHBondContact O-N 3.37Å; E335-M337 VanDerWaalsContact C-N 3.32Å; E335-M337 PolarHBondContact O-N 3.42Å; M337-G340 PolarHBondContact O-N 3.3Å; M337-L345 HydrophobicContact CG-CD1 3.6Å; M337-L345 HydrophobicContact CG-CD2 4.47Å; M337-L357 HydrophobicContact CE-CD1 4.37Å; M337-L357 HydrophobicContact CE-CD2 3.81Å; M337-L357 HydrophobicContact CG-CD1 4.45Å; M337-L357 HydrophobicContact SD-CD1 4.11Å; M337-I449 HydrophobicContact CE-CD1 3.77Å; M337-I449 HydrophobicContact SD-CD1 3.66Å
338	I	88.7	Confident	88.7	Confident	12 Å²	12	29 Å²	29	6%	0.062	13%	0.134	C	C	.	.	H	α-helix	trans	-70.8	-41.8	-175.7	-72.8	176.6	0	0	0	112.3	L334 E335 G340 F371 S373 I375 L403	L334-I338 HydrophobicContact CD2-CD1 3.29Å; L334-I338 HydrophobicContact CD2-CG1 4.08Å; L334-I338 WeakPolarHBondContact O-CB 3.18Å; L334-I338 VanDerWaalsContact O-CG1 3.25Å; L334-I338 WeakPolarHBondContact O-CG1 3.49Å; L334-I338 PolarHBondContact O-N 2.8Å; E335-I338 PolarHBondContact O-N 2.9Å; I338-G340 VanDerWaalsContact C-N 3.27Å; I338-F371 VanDerWaalsContact O-CB 3.32Å; I338-F371 WeakPolarHBondContact O-CB 3.07Å; I338-S373 VanDerWaalsContact CG2-O 3.28Å; I338-S373 WeakPolarHBondContact CG2-O 3.48Å; I338-I375 HydrophobicContact CD1-CD1 3.89Å; I338-I375 HydrophobicContact CD1-CG1 3.35Å; I338-L403 HydrophobicContact CD1-CD2 3.21Å; I338-L403 HydrophobicContact CG1-CD2 4.38Å
339	R	87.1	Confident	88.9	Confident	91 Å²	91	28.7 Å²	28.7	34%	0.343	13%	0.133	S	C	.	.	H	α-helix	trans	-77.6	-18	177.3	-63.7	179.4	-169.8	-169.2	4.6	112.3	E335 E341	E335-R339 WeakPolarHBondContact O-CB 3.17Å; E335-R339 VanDerWaalsContact O-CG 3.31Å; E335-R339 WeakPolarHBondContact O-CG 3.32Å; E335-R339 PolarHBondContact O-N 3.28Å; E335-R339 IonicContact OE2-CZ 3.2Å; E335-R339 IonicContact OE2-NE 2.84Å; E335-R339 PolarHBondContact OE2-NE 2.89Å; E335-R339 IonicContact OE2-NH2 2.79Å; E335-R339 PolarHBondContact OE2-NH2 2.87Å; R339-E341 HydrophobicContact CB-CG 4.35Å
340	G	85.8	Confident	88.9	Confident	0 Å²	0	29 Å²	29	0%	0	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	33.8	-175.9	0	0	0	0	0	113.2	A336 M337 I338 L342 K365	A336-G340 CarbonylContact O-C 3.55Å; A336-G340 WeakPolarHBondContact O-CA 3.12Å; A336-G340 PolarHBondContact O-N 3.13Å; M337-G340 PolarHBondContact O-N 3.3Å; I338-G340 VanDerWaalsContact C-N 3.27Å; G340-L342 PolarHBondContact O-N 3.4Å; G340-L342 VanDerWaalsContact O-N 3.14Å; G340-K365 WeakPolarHBondContact O-CE 3.21Å; G340-K365 PolarHBondContact O-NZ 2.82Å
341	E	87.8	Confident	88.6	Confident	78 Å²	78	33.5 Å²	33.5	36%	0.364	16%	0.155	S	C	.	.			trans	-80.4	90.6	176	-73.9	-170.1	-157	0	0	111.1	L211 A336 R339 E343 V344 L345	L211-E341 HydrophobicContact CD1-CB 4.34Å; L211-E341 HydrophobicContact CD1-CG 4.28Å; L211-E341 WeakPolarHBondContact CD1-OE2 3.12Å; A336-E341 HydrophobicContact CB-CB 4.47Å; A336-E341 PolarHBondContact O-N 2.96Å; R339-E341 HydrophobicContact CB-CG 4.35Å; E341-E343 VanDerWaalsContact C-N 3.3Å; E341-E343 PolarHBondContact O-N 2.99Å; E341-V344 HydrophobicContact CB-CB 4.49Å; E341-V344 HydrophobicContact CB-CG2 4.42Å; E341-V344 PolarHBondContact O-N 3Å; E341-L345 WeakPolarHBondContact O-CB 3.44Å; E341-L345 PolarHBondContact O-N 3.3Å; E341-L345 VanDerWaalsContact O-N 3.15Å
342	L	88.3	Confident	88.3	Confident	31 Å²	31	34.2 Å²	34.2	16%	0.162	16%	0.162	C	C	.	.	H	α-helix	trans	-62.1	-33.2	-175.4	-64	176.2	0	0	0	113.5	G340 K346 Y354 A358 I361 Q362	G340-L342 PolarHBondContact O-N 3.4Å; G340-L342 VanDerWaalsContact O-N 3.14Å; L342-K346 WeakPolarHBondContact O-CB 3.36Å; L342-K346 PolarHBondContact O-N 3.03Å; L342-Y354 WeakPolarHBondContact O-CE2 3.24Å; L342-A358 HydrophobicContact CD2-CB 3.96Å; L342-I361 HydrophobicContact CD2-CB 4.06Å; L342-I361 HydrophobicContact CD2-CD1 4.36Å; L342-I361 HydrophobicContact CD2-CG2 3.76Å; L342-I361 HydrophobicContact CG-CG2 4.27Å; L342-Q362 HydrophobicContact CD1-CG 3.69Å
343	E	89	Confident	88.3	Confident	134 Å²	134	34.1 Å²	34.1	63%	0.626	16%	0.162	S	C	*	.	H	α-helix	trans	-67.6	-46.4	-178.4	-63.7	-176.2	-169.5	0	0	112.1	K213 E341 L345 K346 D347	K213-E343 IonicContact NZ-OE2 3.75Å; K213-E343 PolarHBondContact NZ-OE2 2.94Å; E341-E343 VanDerWaalsContact C-N 3.3Å; E341-E343 PolarHBondContact O-N 2.99Å; E343-L345 VanDerWaalsContact C-N 3.32Å; E343-K346 PolarHBondContact O-N 3.11Å; E343-D347 PolarHBondContact O-N 3.45Å
344	V	88.4	Confident	88.2	Confident	4 Å²	4	36.1 Å²	36.1	2%	0.024	17%	0.169	C	C	.	.	H	α-helix	trans	-64.7	-43.6	177.3	178.6	0	0	0	0	109.4	L211 K213 A336 E341 K346 D347 W348	L211-V344 HydrophobicContact CB-CG1 4.24Å; L211-V344 HydrophobicContact CB-CG2 3.99Å; K213-V344 HydrophobicContact CG-CG2 4.2Å; A336-V344 HydrophobicContact CB-CB 4.04Å; A336-V344 HydrophobicContact CB-CG1 3.87Å; E341-V344 HydrophobicContact CB-CB 4.49Å; E341-V344 HydrophobicContact CB-CG2 4.42Å; E341-V344 PolarHBondContact O-N 3Å; V344-K346 VanDerWaalsContact C-N 3.28Å; V344-K346 PolarHBondContact O-N 3.34Å; V344-D347 PolarHBondContact O-N 3.06Å; V344-W348 VanDerWaalsContact O-CD1 3.27Å; V344-W348 PolarHBondContact O-N 2.93Å
345	L	88.8	Confident	88.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.7	-36.9	179.2	-164.3	66.8	0	0	0	112.5	I333 M337 E341 E343 D347 W348 C349 Y354 L357 I361	I333-L345 HydrophobicContact CG2-CD1 4.39Å; M337-L345 HydrophobicContact CG-CD1 3.6Å; M337-L345 HydrophobicContact CG-CD2 4.47Å; E341-L345 WeakPolarHBondContact O-CB 3.44Å; E341-L345 PolarHBondContact O-N 3.3Å; E341-L345 VanDerWaalsContact O-N 3.15Å; E343-L345 VanDerWaalsContact C-N 3.32Å; L345-D347 VanDerWaalsContact C-N 3.33Å; L345-D347 PolarHBondContact O-N 3.24Å; L345-W348 PolarHBondContact O-N 3.38Å; L345-C349 VanDerWaalsContact O-CB 3.25Å; L345-C349 WeakPolarHBondContact O-CB 3.09Å; L345-C349 PolarHBondContact O-N 3.49Å; L345-C349 PolarHBondContact O-SG 3.38Å; L345-Y354 HydrophobicContact CB-CD2 4.46Å; L345-Y354 HydrophobicContact CG-CD2 4.35Å; L345-L357 HydrophobicContact CD1-CD1 4.15Å; L345-L357 HydrophobicContact CD2-CB 3.76Å; L345-L357 HydrophobicContact CD2-CD1 4.2Å; L345-L357 HydrophobicContact CG-CD1 4.47Å; L345-I361 HydrophobicContact CD2-CD1 4.2Å
346	K	88.9	Confident	88.2	Confident	132 Å²	132	43.4 Å²	43.4	57%	0.574	21%	0.21	S	C	*	.	H	α-helix	trans	-64.8	-36	177.6	-170.2	-179.1	177.1	-173.1	0	112.6	L342 E343 V344 Y354	L342-K346 WeakPolarHBondContact O-CB 3.36Å; L342-K346 PolarHBondContact O-N 3.03Å; E343-K346 PolarHBondContact O-N 3.11Å; V344-K346 VanDerWaalsContact C-N 3.28Å; V344-K346 PolarHBondContact O-N 3.34Å; K346-Y354 HydrophobicContact CB-CD2 3.88Å; K346-Y354 HydrophobicContact CB-CE2 3.65Å; K346-Y354 HydrophobicContact CG-CD2 4.33Å; K346-Y354 HydrophobicContact CG-CE1 4.46Å; K346-Y354 HydrophobicContact CG-CE2 4.24Å; K346-Y354 HydrophobicContact CG-CG 4.48Å
347	D	89.4	Confident	88	Confident	45 Å²	45	44.8 Å²	44.8	24%	0.241	22%	0.218	C	C	.	.	H	α-helix	trans	-74.3	-30.6	-178.9	-71.5	-11	0	0	0	112.5	K213 E343 V344 L345	K213-D347 WeakPolarHBondContact CB-OD2 3.48Å; K213-D347 VanDerWaalsContact CD-OD2 3.29Å; K213-D347 WeakPolarHBondContact CD-OD2 3.41Å; K213-D347 WeakPolarHBondContact CG-OD2 3.38Å; E343-D347 PolarHBondContact O-N 3.45Å; V344-D347 PolarHBondContact O-N 3.06Å; L345-D347 VanDerWaalsContact C-N 3.33Å; L345-D347 PolarHBondContact O-N 3.24Å
348	W	89.2	Confident	88.1	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-91	-22.9	-178	-76.8	102.9	0	0	0	114.3	R212 I329 I333 V344 L345 R445 L446	R212-W348 PolarHBondContact O-NE1 3.45Å; I329-W348 HydrophobicContact CB-CZ3 4.41Å; I329-W348 HydrophobicContact CG1-CH2 4.2Å; I329-W348 HydrophobicContact CG1-CZ3 3.97Å; I329-W348 HydrophobicContact CG2-CE3 4.46Å; I329-W348 HydrophobicContact CG2-CZ3 4.16Å; I333-W348 HydrophobicContact CD1-CB 3.92Å; I333-W348 HydrophobicContact CD1-CD2 4.23Å; I333-W348 HydrophobicContact CD1-CE3 4.05Å; I333-W348 HydrophobicContact CD1-CG 4.23Å; I333-W348 HydrophobicContact CG1-CB 3.73Å; I333-W348 HydrophobicContact CG1-CD2 4.06Å; I333-W348 HydrophobicContact CG1-CE3 4.36Å; I333-W348 HydrophobicContact CG1-CG 3.8Å; V344-W348 VanDerWaalsContact O-CD1 3.27Å; V344-W348 PolarHBondContact O-N 2.93Å; L345-W348 PolarHBondContact O-N 3.38Å; W348-R445 CarbonylContact O-C 3.28Å; W348-R445 WeakPolarHBondContact O-CA 3.31Å; W348-L446 PolarHBondContact O-N 2.81Å
349	C	88.7	Confident	88.2	Confident	8 Å²	8	47.2 Å²	47.2	5%	0.054	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-104.4	152.7	-175.6	-63.3	0	0	0	0	113.2	L345	L345-C349 VanDerWaalsContact O-CB 3.25Å; L345-C349 WeakPolarHBondContact O-CB 3.09Å; L345-C349 PolarHBondContact O-N 3.49Å; L345-C349 PolarHBondContact O-SG 3.38Å
350	Y	88.1	Confident	88.3	Confident	7 Å²	7	46.4 Å²	46.4	3%	0.027	24%	0.235	C	C	.	.			trans	-69.1	156.2	164	-79.6	-75.9	0	0	0	111.9	D243 W246 A352 T353 Y354 C432 R445 L446 L447	D243-Y350 HydrophobicContact CB-CD1 4.29Å; W246-Y350 HydrophobicContact CE3-CD1 4.11Å; W246-Y350 AromaticContact CE3-CE1 3.68Å; W246-Y350 HydrophobicContact CE3-CE1 3.68Å; W246-Y350 HydrophobicContact CE3-CE2 4.38Å; W246-Y350 AromaticContact CE3-CZ 3.89Å; W246-Y350 HydrophobicContact CH2-CD1 4.39Å; W246-Y350 AromaticContact CH2-CD2 3.92Å; W246-Y350 HydrophobicContact CH2-CD2 3.92Å; W246-Y350 AromaticContact CH2-CE1 3.64Å; W246-Y350 HydrophobicContact CH2-CE1 3.64Å; W246-Y350 AromaticContact CH2-CE2 3.04Å; W246-Y350 HydrophobicContact CH2-CE2 3.04Å; W246-Y350 AromaticContact CH2-CZ 2.91Å; W246-Y350 WeakPolarHBondContact CH2-OH 3.4Å; W246-Y350 HydrophobicContact CZ2-CD2 4.12Å; W246-Y350 AromaticContact CZ2-CE2 3.6Å; W246-Y350 HydrophobicContact CZ2-CE2 3.6Å; W246-Y350 AromaticContact CZ2-CZ 3.91Å; W246-Y350 AromaticContact CZ3-CD1 3.94Å; W246-Y350 HydrophobicContact CZ3-CD1 3.94Å; W246-Y350 HydrophobicContact CZ3-CD2 4.29Å; W246-Y350 AromaticContact CZ3-CE1 3.12Å; W246-Y350 HydrophobicContact CZ3-CE1 3.12Å; W246-Y350 AromaticContact CZ3-CE2 3.54Å; W246-Y350 HydrophobicContact CZ3-CE2 3.54Å; W246-Y350 HydrophobicContact CZ3-CG 4.48Å; W246-Y350 AromaticContact CZ3-CZ 2.92Å; W246-Y350 WeakPolarHBondContact CZ3-OH 3.46Å; Y350-A352 PolarHBondContact O-N 3.24Å; Y350-T353 PolarHBondContact O-N 3.12Å; Y350-T353 VanDerWaalsContact O-N 3.12Å; Y350-Y354 WeakPolarHBondContact O-CB 3.49Å; Y350-Y354 PolarHBondContact O-N 3.22Å; Y350-C432 HydrophobicContact CE2-CB 4.47Å; Y350-R445 HydrophobicContact CD2-CB 3.8Å; Y350-R445 HydrophobicContact CE2-CB 3.17Å; Y350-R445 HydrophobicContact CE2-CG 4.2Å; Y350-L446 WeakPolarHBondContact CD2-O 3.37Å; Y350-L446 PolarHBondContact N-O 3.05Å; Y350-L447 HydrophobicContact CD2-CB 4.23Å; Y350-L447 HydrophobicContact CD2-CD1 4.08Å; Y350-L447 HydrophobicContact CG-CD1 4.38Å
351	E	84.9	Confident	88.5	Confident	95 Å²	95	47.2 Å²	47.2	44%	0.444	24%	0.239	S	C	.	.	H	α-helix	trans	-52.5	-42.3	-176	-175.4	-178.2	-173.4	0	0	112.7	H241 S355	H241-E351 IonicContact CE1-OE1 2.76Å; H241-E351 IonicContact CE1-OE2 3.72Å; H241-E351 IonicContact ND1-OE1 3.87Å; H241-E351 IonicContact ND1-OE2 3.21Å; H241-E351 PolarHBondContact ND1-OE2 3.42Å; E351-S355 WeakPolarHBondContact O-CB 3.33Å; E351-S355 PolarHBondContact O-N 3.44Å; E351-S355 PolarHBondContact O-OG 3Å
352	A	84.2	Confident	88.6	Confident	24 Å²	24	48 Å²	48	20%	0.198	24%	0.243	C	C	.	.	H	α-helix	trans	-65.2	-48	-180	0	0	0	0	0	112.1	Y247 Y350 S355 Q356	Y247-A352 HydrophobicContact CD1-CB 4.02Å; Y247-A352 HydrophobicContact CD2-CB 3.6Å; Y247-A352 HydrophobicContact CE2-CB 4.25Å; Y247-A352 HydrophobicContact CG-CB 3.48Å; Y247-A352 VanDerWaalsContact CG-CB 3.48Å; Y350-A352 PolarHBondContact O-N 3.24Å; A352-S355 PolarHBondContact O-N 3.37Å; A352-Q356 WeakPolarHBondContact O-CG 3.43Å; A352-Q356 PolarHBondContact O-N 3.42Å
353	T	87.5	Confident	88.7	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-66.8	-43.5	179.5	-28	0	0	0	0	110.9	Y350 S355 Q356 L357 L446 L447 I449	Y350-T353 PolarHBondContact O-N 3.12Å; Y350-T353 VanDerWaalsContact O-N 3.12Å; T353-S355 VanDerWaalsContact C-N 3.3Å; T353-S355 PolarHBondContact O-N 3.22Å; T353-Q356 PolarHBondContact O-N 2.94Å; T353-L357 HydrophobicContact CG2-CD1 4.44Å; T353-L357 WeakPolarHBondContact O-CG 3.39Å; T353-L357 PolarHBondContact O-N 3.23Å; T353-L446 HydrophobicContact CG2-CD2 4.32Å; T353-L446 HydrophobicContact CG2-CG 4.42Å; T353-L446 PolarHBondContact OG1-O 3.46Å; T353-L447 VanDerWaalsContact OG1-C 3.28Å; T353-L447 PolarHBondContact OG1-O 3.06Å; T353-I449 HydrophobicContact CG2-CG2 4.29Å
354	Y	89.9	Confident	88.7	Confident	43 Å²	43	45.4 Å²	45.4	17%	0.169	23%	0.232	C	C	.	.	H	α-helix	trans	-58.4	-44	176.4	172.8	-101.9	0	0	0	111.1	L342 L345 K346 Y350 Q356 L357 A358	L342-Y354 WeakPolarHBondContact O-CE2 3.24Å; L345-Y354 HydrophobicContact CB-CD2 4.46Å; L345-Y354 HydrophobicContact CG-CD2 4.35Å; K346-Y354 HydrophobicContact CB-CD2 3.88Å; K346-Y354 HydrophobicContact CB-CE2 3.65Å; K346-Y354 HydrophobicContact CG-CD2 4.33Å; K346-Y354 HydrophobicContact CG-CE1 4.46Å; K346-Y354 HydrophobicContact CG-CE2 4.24Å; K346-Y354 HydrophobicContact CG-CG 4.48Å; Y350-Y354 WeakPolarHBondContact O-CB 3.49Å; Y350-Y354 PolarHBondContact O-N 3.22Å; Y354-Q356 VanDerWaalsContact C-N 3.29Å; Y354-Q356 PolarHBondContact O-N 3.19Å; Y354-L357 PolarHBondContact O-N 3.18Å; Y354-A358 HydrophobicContact CD1-CB 4.39Å; Y354-A358 HydrophobicContact CD2-CB 4.36Å; Y354-A358 HydrophobicContact CE1-CB 4.01Å; Y354-A358 HydrophobicContact CE2-CB 3.97Å; Y354-A358 WeakPolarHBondContact O-CB 3.48Å; Y354-A358 PolarHBondContact O-N 3Å
355	S	89.3	Confident	88.7	Confident	66 Å²	66	49.8 Å²	49.8	46%	0.462	25%	0.251	S	S	.	.	H	α-helix	trans	-61.9	-37.4	179.7	-61.5	0	0	0	0	112.4	E351 A352 T353 H359	E351-S355 WeakPolarHBondContact O-CB 3.33Å; E351-S355 PolarHBondContact O-N 3.44Å; E351-S355 PolarHBondContact O-OG 3Å; A352-S355 PolarHBondContact O-N 3.37Å; T353-S355 VanDerWaalsContact C-N 3.3Å; T353-S355 PolarHBondContact O-N 3.22Å; S355-H359 PolarHBondContact O-N 3.47Å
356	Q	88	Confident	88.7	Confident	95 Å²	95	54.1 Å²	54.1	44%	0.444	29%	0.286	S	S	.	.	H	α-helix	trans	-69.9	-40.6	177.6	-67.7	177.1	7.7	0	0	112.3	Y247 A352 T353 Y354 P360	Y247-Q356 PolarHBondContact OH-NE2 3.44Å; A352-Q356 WeakPolarHBondContact O-CG 3.43Å; A352-Q356 PolarHBondContact O-N 3.42Å; T353-Q356 PolarHBondContact O-N 2.94Å; Y354-Q356 VanDerWaalsContact C-N 3.29Å; Y354-Q356 PolarHBondContact O-N 3.19Å; Q356-P360 VanDerWaalsContact O-CD 3.27Å; Q356-P360 WeakPolarHBondContact O-CD 3.42Å
357	L	87.8	Confident	88.7	Confident	29 Å²	29	54.3 Å²	54.3	15%	0.152	29%	0.291	C	S	.	.	H	α-helix	trans	-79.3	-35.3	-179.7	-63.6	178.1	0	0	0	113	M337 L345 T353 Y354 P360 I361 I449	M337-L357 HydrophobicContact CE-CD1 4.37Å; M337-L357 HydrophobicContact CE-CD2 3.81Å; M337-L357 HydrophobicContact CG-CD1 4.45Å; M337-L357 HydrophobicContact SD-CD1 4.11Å; L345-L357 HydrophobicContact CD1-CD1 4.15Å; L345-L357 HydrophobicContact CD2-CB 3.76Å; L345-L357 HydrophobicContact CD2-CD1 4.2Å; L345-L357 HydrophobicContact CG-CD1 4.47Å; T353-L357 HydrophobicContact CG2-CD1 4.44Å; T353-L357 WeakPolarHBondContact O-CG 3.39Å; T353-L357 PolarHBondContact O-N 3.23Å; Y354-L357 PolarHBondContact O-N 3.18Å; L357-P360 WeakPolarHBondContact O-CD 3.44Å; L357-I361 VanDerWaalsContact O-CD1 3.29Å; L357-I361 WeakPolarHBondContact O-CD1 3.19Å; L357-I361 WeakPolarHBondContact O-CG1 3.38Å; L357-I449 HydrophobicContact CD1-CG2 4.16Å; L357-I449 HydrophobicContact CD2-CG2 3.94Å; L357-I449 HydrophobicContact CG-CG2 4.38Å
358	A	90	Very high	88.6	Confident	2 Å²	2	53.6 Å²	53.6	2%	0.017	29%	0.294	C	S	.	.	H	α-helix	trans	-71	-34	-176.9	0	0	0	0	0	112.5	L342 Y354 I361 Q362	L342-A358 HydrophobicContact CD2-CB 3.96Å; Y354-A358 HydrophobicContact CD1-CB 4.39Å; Y354-A358 HydrophobicContact CD2-CB 4.36Å; Y354-A358 HydrophobicContact CE1-CB 4.01Å; Y354-A358 HydrophobicContact CE2-CB 3.97Å; Y354-A358 WeakPolarHBondContact O-CB 3.48Å; Y354-A358 PolarHBondContact O-N 3Å; A358-I361 PolarHBondContact O-N 3.28Å; A358-Q362 WeakPolarHBondContact O-CB 3.27Å; A358-Q362 VanDerWaalsContact O-CG 3.24Å; A358-Q362 WeakPolarHBondContact O-CG 3.31Å; A358-Q362 PolarHBondContact O-N 2.82Å
359	H	90.1	Very high	88.6	Confident	106 Å²	106	54.9 Å²	54.9	49%	0.491	30%	0.301	S	S	.	.	H	α-helix	trans	-60.3	-51.1	-173.5	-175.8	-76.9	0	0	0	113.1	S355 I361 Q362 Q363	S355-H359 PolarHBondContact O-N 3.47Å; H359-I361 VanDerWaalsContact C-N 3.33Å; H359-I361 PolarHBondContact O-N 2.94Å; H359-Q362 PolarHBondContact O-N 3.47Å; H359-Q363 PolarHBondContact CE1-NE2 2.96Å; H359-Q363 PolarHBondContact ND1-OE1 3.32Å; H359-Q363 VanDerWaalsContact O-CG 3.3Å; H359-Q363 WeakPolarHBondContact O-CG 3.33Å; H359-Q363 PolarHBondContact O-N 3.05Å
360	P	90.4	Very high	88.6	Confident	74 Å²	74	59.1 Å²	59.1	48%	0.481	32%	0.32	S	S	.	.	H	α-helix	trans	-61.8	-39.1	175.4	-22.2	33.8	0	0	0	113	Q356 L357 Q363 A364	Q356-P360 VanDerWaalsContact O-CD 3.27Å; Q356-P360 WeakPolarHBondContact O-CD 3.42Å; L357-P360 WeakPolarHBondContact O-CD 3.44Å; P360-Q363 PolarHBondContact O-N 2.83Å; P360-A364 WeakPolarHBondContact O-CB 3.36Å; P360-A364 PolarHBondContact O-N 2.61Å
361	I	89.6	Confident	88.6	Confident	17 Å²	17	61.1 Å²	61.1	9%	0.087	33%	0.329	C	S	.	.	H	α-helix	trans	-66	-43.8	-179.4	-62.1	170	0	0	0	110.6	L342 L345 L357 A358 H359 Q363 A364 K365 F371	L342-I361 HydrophobicContact CD2-CB 4.06Å; L342-I361 HydrophobicContact CD2-CD1 4.36Å; L342-I361 HydrophobicContact CD2-CG2 3.76Å; L342-I361 HydrophobicContact CG-CG2 4.27Å; L345-I361 HydrophobicContact CD2-CD1 4.2Å; L357-I361 VanDerWaalsContact O-CD1 3.29Å; L357-I361 WeakPolarHBondContact O-CD1 3.19Å; L357-I361 WeakPolarHBondContact O-CG1 3.38Å; A358-I361 PolarHBondContact O-N 3.28Å; H359-I361 VanDerWaalsContact C-N 3.33Å; H359-I361 PolarHBondContact O-N 2.94Å; I361-Q363 VanDerWaalsContact C-N 3.34Å; I361-A364 PolarHBondContact O-N 3.43Å; I361-K365 HydrophobicContact CG2-CD 4.41Å; I361-K365 WeakPolarHBondContact O-CB 3.1Å; I361-K365 WeakPolarHBondContact O-CG 3.15Å; I361-K365 PolarHBondContact O-N 3.2Å; I361-F371 HydrophobicContact CG2-CE2 4.32Å; I361-F371 HydrophobicContact CG2-CZ 4.34Å
362	Q	90.9	Very high	88.8	Confident	95 Å²	95	60.5 Å²	60.5	44%	0.444	33%	0.326	S	S	.	.	H	α-helix	trans	-64.5	-39.5	177.5	-74.1	176	4.9	0	0	111.5	L342 A358 H359 K365 A366	L342-Q362 HydrophobicContact CD1-CG 3.69Å; A358-Q362 WeakPolarHBondContact O-CB 3.27Å; A358-Q362 VanDerWaalsContact O-CG 3.24Å; A358-Q362 WeakPolarHBondContact O-CG 3.31Å; A358-Q362 PolarHBondContact O-N 2.82Å; H359-Q362 PolarHBondContact O-N 3.47Å; Q362-K365 PolarHBondContact O-N 2.9Å; Q362-A366 WeakPolarHBondContact O-CB 3.43Å; Q362-A366 PolarHBondContact O-N 2.88Å
363	Q	90.6	Very high	89	Confident	97 Å²	97	59.9 Å²	59.9	45%	0.453	32%	0.32	S	S	.	.	H	α-helix	trans	-62.5	-48	174.9	-73	179.3	-40.3	0	0	111.7	H359 P360 I361 K365 A366 M367	H359-Q363 PolarHBondContact CE1-NE2 2.96Å; H359-Q363 PolarHBondContact ND1-OE1 3.32Å; H359-Q363 VanDerWaalsContact O-CG 3.3Å; H359-Q363 WeakPolarHBondContact O-CG 3.33Å; H359-Q363 PolarHBondContact O-N 3.05Å; P360-Q363 PolarHBondContact O-N 2.83Å; I361-Q363 VanDerWaalsContact C-N 3.34Å; Q363-K365 VanDerWaalsContact C-N 3.33Å; Q363-K365 PolarHBondContact O-N 3.38Å; Q363-A366 PolarHBondContact O-N 3.18Å; Q363-M367 WeakPolarHBondContact O-CG 3.44Å; Q363-M367 PolarHBondContact O-N 3.42Å
364	A	88.3	Confident	89.1	Confident	12 Å²	12	66.7 Å²	66.7	10%	0.099	35%	0.35	C	S	.	.	H	α-helix	trans	-62.3	-40	177	0	0	0	0	0	112.2	P360 I361 M367 G368 L369 F371	P360-A364 WeakPolarHBondContact O-CB 3.36Å; P360-A364 PolarHBondContact O-N 2.61Å; I361-A364 PolarHBondContact O-N 3.43Å; A364-M367 PolarHBondContact O-N 2.86Å; A364-G368 PolarHBondContact O-N 2.92Å; A364-L369 HydrophobicContact CB-CB 4.43Å; A364-L369 HydrophobicContact CB-CD1 4.21Å; A364-L369 WeakPolarHBondContact O-CB 3.44Å; A364-L369 PolarHBondContact O-N 3.22Å; A364-F371 HydrophobicContact CB-CE1 4.23Å; A364-F371 HydrophobicContact CB-CE2 4.29Å; A364-F371 HydrophobicContact CB-CZ 3.53Å
365	K	87.9	Confident	89.1	Confident	96 Å²	96	65.2 Å²	65.2	42%	0.417	35%	0.345	S	S	.	.	H	α-helix	trans	-64.4	-40.5	173.6	-76.7	-172.9	179.7	-172.1	0	112.7	G340 I361 Q362 Q363 M367 G368 F371	G340-K365 WeakPolarHBondContact O-CE 3.21Å; G340-K365 PolarHBondContact O-NZ 2.82Å; I361-K365 HydrophobicContact CG2-CD 4.41Å; I361-K365 WeakPolarHBondContact O-CB 3.1Å; I361-K365 WeakPolarHBondContact O-CG 3.15Å; I361-K365 PolarHBondContact O-N 3.2Å; Q362-K365 PolarHBondContact O-N 2.9Å; Q363-K365 VanDerWaalsContact C-N 3.33Å; Q363-K365 PolarHBondContact O-N 3.38Å; K365-M367 PolarHBondContact O-N 2.98Å; K365-G368 PolarHBondContact O-N 3.41Å; K365-F371 HydrophobicContact CG-CE2 4.26Å
366	A	89.8	Confident	89.1	Confident	91 Å²	91	65.8 Å²	65.8	75%	0.752	34%	0.342	S	S	*	.	H	α-helix	trans	-63.9	-30.2	176.6	0	0	0	0	0	112.1	Q362 Q363 G368	Q362-A366 WeakPolarHBondContact O-CB 3.43Å; Q362-A366 PolarHBondContact O-N 2.88Å; Q363-A366 PolarHBondContact O-N 3.18Å; A366-G368 PolarHBondContact O-N 2.58Å
367	M	88.2	Confident	89.1	Confident	137 Å²	137	64 Å²	64	68%	0.675	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-3.5	172.3	-64.7	178.7	-170.4	0	0	113.5	Q363 A364 K365 L369	Q363-M367 WeakPolarHBondContact O-CG 3.44Å; Q363-M367 PolarHBondContact O-N 3.42Å; A364-M367 PolarHBondContact O-N 2.86Å; K365-M367 PolarHBondContact O-N 2.98Å; M367-L369 VanDerWaalsContact C-N 3.31Å; M367-L369 HydrophobicContact CB-CD1 4.35Å; M367-L369 HydrophobicContact CB-CG 4.08Å
368	G	86.8	Confident	89.1	Confident	30 Å²	30	63.5 Å²	63.5	31%	0.309	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	20.8	-178.8	0	0	0	0	0	114.2	A364 K365 A366 T410	A364-G368 PolarHBondContact O-N 2.92Å; K365-G368 PolarHBondContact O-N 3.41Å; A366-G368 PolarHBondContact O-N 2.58Å; G368-T410 WeakPolarHBondContact O-CG2 3.46Å
369	L	89.8	Confident	88.8	Confident	29 Å²	29	65 Å²	65	15%	0.152	34%	0.341	C	S	.	.			trans	-74.4	143	177.5	-60.9	176.4	0	0	0	111	A364 M367 I407 R408 V415	A364-L369 HydrophobicContact CB-CB 4.43Å; A364-L369 HydrophobicContact CB-CD1 4.21Å; A364-L369 WeakPolarHBondContact O-CB 3.44Å; A364-L369 PolarHBondContact O-N 3.22Å; M367-L369 VanDerWaalsContact C-N 3.31Å; M367-L369 HydrophobicContact CB-CD1 4.35Å; M367-L369 HydrophobicContact CB-CG 4.08Å; L369-I407 HydrophobicContact CB-CG2 3.65Å; L369-I407 HydrophobicContact CD1-CG2 3.99Å; L369-I407 HydrophobicContact CD2-CG2 4.46Å; L369-I407 HydrophobicContact CG-CG2 4.24Å; L369-R408 CarbonylContact C-O 3.59Å; L369-V415 HydrophobicContact CD2-CB 4.32Å; L369-V415 HydrophobicContact CD2-CG1 4.45Å; L369-V415 HydrophobicContact CD2-CG2 3.92Å
370	Q	88.1	Confident	88.6	Confident	96 Å²	96	64.9 Å²	64.9	45%	0.449	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	121.2	178.8	-65	-172.3	-14.6	0	0	110.8	H372 R408	Q370-H372 PolarHBondContact O-N 3.43Å; Q370-H372 PolarHBondContact O-ND1 3.26Å; Q370-H372 PolarHBondContact OE1-CE1 3.44Å; Q370-R408 PolarHBondContact N-O 2.9Å; Q370-R408 PolarHBondContact O-N 2.82Å
371	F	89.6	Confident	88.4	Confident	49 Å²	49	62.9 Å²	62.9	22%	0.215	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	118.4	175.9	-59.1	-82	0	0	0	110.8	I338 I361 A364 K365 I407	I338-F371 VanDerWaalsContact O-CB 3.32Å; I338-F371 WeakPolarHBondContact O-CB 3.07Å; I361-F371 HydrophobicContact CG2-CE2 4.32Å; I361-F371 HydrophobicContact CG2-CZ 4.34Å; A364-F371 HydrophobicContact CB-CE1 4.23Å; A364-F371 HydrophobicContact CB-CE2 4.29Å; A364-F371 HydrophobicContact CB-CZ 3.53Å; K365-F371 HydrophobicContact CG-CE2 4.26Å; F371-I407 HydrophobicContact CD1-CD1 4.12Å; F371-I407 HydrophobicContact CD1-CG1 4.04Å; F371-I407 HydrophobicContact CE1-CD1 3.9Å; F371-I407 HydrophobicContact CE1-CG1 4.33Å
372	H	87.4	Confident	88.2	Confident	82 Å²	82	64.6 Å²	64.6	38%	0.38	34%	0.338	S	S	.	.			trans	-118.6	11.4	176.4	-76.7	79.9	0	0	0	112.5	Q370 V406	Q370-H372 PolarHBondContact O-N 3.43Å; Q370-H372 PolarHBondContact O-ND1 3.26Å; Q370-H372 PolarHBondContact OE1-CE1 3.44Å; H372-V406 CarbonylContact C-O 3.55Å; H372-V406 HydrophobicContact CB-CB 4.49Å; H372-V406 PolarHBondContact N-O 3.29Å
373	S	89.3	Confident	87.9	Confident	11 Å²	11	60.7 Å²	60.7	8%	0.077	32%	0.32	C	S	.	.			trans	-61.2	147.8	178.8	-59.2	0	0	0	0	111.6	I338 V404 M405 V406	I338-S373 VanDerWaalsContact CG2-O 3.28Å; I338-S373 WeakPolarHBondContact CG2-O 3.48Å; S373-V404 CarbonylContact C-O 3.59Å; S373-V404 WeakPolarHBondContact CA-O 3.34Å; S373-V404 WeakPolarHBondContact CB-O 3.18Å; S373-M405 WeakPolarHBondContact OG-CA 3.33Å; S373-V406 PolarHBondContact N-O 3.19Å; S373-V406 PolarHBondContact OG-N 2.82Å; S373-V406 PolarHBondContact OG-O 2.92Å
374	K	88.9	Confident	87.5	Confident	144 Å²	144	57 Å²	57	63%	0.626	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.7	143.8	-176	-67.7	-179.9	-177.9	176.4	0	111.4	L403 V404	K374-L403 WeakPolarHBondContact O-CA 3.44Å; K374-V404 PolarHBondContact N-O 3.48Å; K374-V404 PolarHBondContact O-N 2.56Å
375	I	89.9	Confident	87	Confident	12 Å²	12	57.9 Å²	57.9	6%	0.062	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	133.5	169.2	-46.8	171.9	0	0	0	108	Y205 L334 E335 I338 I378 L403	Y205-I375 HydrophobicContact CD1-CB 4.13Å; Y205-I375 HydrophobicContact CD1-CG2 4.02Å; Y205-I375 HydrophobicContact CE1-CB 3.61Å; Y205-I375 HydrophobicContact CE1-CD1 4.29Å; Y205-I375 HydrophobicContact CE1-CG1 4.5Å; Y205-I375 HydrophobicContact CE1-CG2 3.78Å; L334-I375 HydrophobicContact CB-CD1 3.97Å; L334-I375 HydrophobicContact CD2-CD1 3.29Å; L334-I375 HydrophobicContact CD2-CG1 3.69Å; L334-I375 HydrophobicContact CG-CD1 4.11Å; E335-I375 HydrophobicContact CG-CD1 3.75Å; E335-I375 VanDerWaalsContact OE1-CD1 3.27Å; E335-I375 WeakPolarHBondContact OE1-CD1 3.05Å; I338-I375 HydrophobicContact CD1-CD1 3.89Å; I338-I375 HydrophobicContact CD1-CG1 3.35Å; I375-I378 HydrophobicContact CG2-CD1 4.24Å; I375-I378 HydrophobicContact CG2-CG1 3.86Å; I375-L403 HydrophobicContact CB-CD2 4.32Å; I375-L403 HydrophobicContact CG1-CD2 3.76Å; I375-L403 HydrophobicContact CG2-CD2 4.43Å
376	L	88.8	Confident	86.7	Confident	77 Å²	77	53.4 Å²	53.4	40%	0.403	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-41.6	178.2	-64.6	-176.8	0	0	0	112.4	Y205 Q402 V404 V422	Y205-L376 WeakPolarHBondContact CB-O 3.18Å; L376-Q402 HydrophobicContact CB-CB 4.04Å; L376-Q402 PolarHBondContact N-O 3.37Å; L376-V404 HydrophobicContact CD1-CG2 3.84Å; L376-V404 HydrophobicContact CD2-CG2 4.38Å; L376-V404 HydrophobicContact CG-CG2 4.1Å; L376-V422 HydrophobicContact CD1-CB 4.4Å; L376-V422 HydrophobicContact CD1-CG1 3.76Å; L376-V422 HydrophobicContact CD1-CG2 3.72Å
377	D	87.9	Confident	86.3	Confident	58 Å²	58	51 Å²	51	31%	0.31	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	152.6	-177	-160	26.3	0	0	0	111.1	A401 Q402	D377-A401 CarbonylContact O-C 3.59Å; D377-A401 VanDerWaalsContact O-CA 3.28Å; D377-A401 WeakPolarHBondContact O-CA 3.44Å; D377-Q402 HydrophobicContact CB-CB 4.31Å; D377-Q402 HydrophobicContact CB-CG 4.49Å; D377-Q402 PolarHBondContact O-N 3.06Å
378	I	88.6	Confident	85.9	Confident	18 Å²	18	47.6 Å²	47.6	9%	0.092	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	119.2	174.5	-55.4	-179.5	0	0	0	106.8	Y205 I330 P331 I375 I381 F399 Q400 A401	Y205-I378 HydrophobicContact CD2-CD1 3.93Å; Y205-I378 HydrophobicContact CD2-CG1 3.98Å; Y205-I378 HydrophobicContact CE2-CD1 3.42Å; Y205-I378 VanDerWaalsContact CE2-CD1 3.42Å; Y205-I378 HydrophobicContact CE2-CG1 3.98Å; I330-I378 HydrophobicContact CG2-CD1 4.04Å; I330-I378 HydrophobicContact CG2-CG2 4.23Å; P331-I378 HydrophobicContact CG-CD1 4.46Å; I375-I378 HydrophobicContact CG2-CD1 4.24Å; I375-I378 HydrophobicContact CG2-CG1 3.86Å; I378-I381 HydrophobicContact CG2-CD1 4.38Å; I378-F399 HydrophobicContact CG2-CD2 3.91Å; I378-F399 HydrophobicContact CG2-CE2 4.47Å; I378-Q400 CarbonylContact C-O 3.52Å; I378-Q400 WeakPolarHBondContact CA-O 3.18Å; I378-A401 HydrophobicContact CG1-CB 4.29Å
379	D	85	Confident	85.5	Confident	35 Å²	35	46.8 Å²	46.8	19%	0.187	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	161.5	-173.7	61.9	-37.9	0	0	0	113	Q400 R424	D379-Q400 PolarHBondContact N-O 3.14Å; D379-Q400 PolarHBondContact O-N 2.8Å; D379-Q400 WeakPolarHBondContact OD1-CB 2.98Å; D379-R424 IonicContact OD2-NH1 2.77Å
380	N	84.3	Confident	84.1	Confident	103 Å²	103	53.1 Å²	53.1	55%	0.551	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	55.8	54.9	172	-48.2	-52	0	0	0	114.7	D382 F399 Q400	N380-D382 PolarHBondContact O-N 3.2Å; N380-F399 WeakPolarHBondContact O-CA 3.32Å; N380-Q400 HydrophobicContact CB-CG 4.22Å
381	I	87.5	Confident	82.8	Confident	31 Å²	31	51.6 Å²	51.6	16%	0.159	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	119.9	174.4	-55.4	162	0	0	0	109	L322 E326 I330 I378 T398 F399	L322-I381 HydrophobicContact CD2-CG2 4.04Å; E326-I381 VanDerWaalsContact CA-CD1 3.49Å; E326-I381 HydrophobicContact CB-CD1 3.35Å; E326-I381 HydrophobicContact CG-CD1 3.49Å; E326-I381 VanDerWaalsContact CG-CD1 3.49Å; I330-I381 HydrophobicContact CD1-CD1 3.74Å; I330-I381 HydrophobicContact CD1-CG1 3.93Å; I330-I381 HydrophobicContact CD1-CG2 3.99Å; I378-I381 HydrophobicContact CG2-CD1 4.38Å; I381-T398 WeakPolarHBondContact CA-O 3.13Å; I381-F399 HydrophobicContact CB-CB 4.25Å; I381-F399 HydrophobicContact CG1-CB 3.64Å; I381-F399 HydrophobicContact CG1-CG 4.5Å
382	D	84.1	Confident	82.1	Confident	53 Å²	53	49.3 Å²	49.3	28%	0.283	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	150.7	179.4	-170.4	18.7	0	0	0	111.7	N380 I397 T398	N380-D382 PolarHBondContact O-N 3.2Å; D382-I397 CarbonylContact O-C 3.44Å; D382-I397 VanDerWaalsContact O-CA 3.26Å; D382-I397 WeakPolarHBondContact O-CA 3.04Å; D382-T398 PolarHBondContact N-O 2.89Å; D382-T398 PolarHBondContact O-N 3.4Å
383	L	85.7	Confident	82.2	Confident	13 Å²	13	45.5 Å²	45.5	7%	0.068	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	106.4	175.1	179.5	69.4	0	0	0	109	M302 K318 L322 L395 I397	M302-L383 HydrophobicContact CE-CD2 3.72Å; M302-L383 HydrophobicContact CE-CG 4.07Å; K318-L383 HydrophobicContact CD-CD2 4.03Å; K318-L383 HydrophobicContact CG-CD2 4.08Å; L322-L383 HydrophobicContact CD2-CB 4.2Å; L383-L395 HydrophobicContact CD1-CB 3.81Å; L383-L395 HydrophobicContact CD1-CD1 4.29Å; L383-L395 HydrophobicContact CD1-CD2 4.15Å; L383-L395 HydrophobicContact CD1-CG 4.31Å; L383-I397 HydrophobicContact CD1-CG2 3.9Å
384	V	82.1	Confident	82.1	Confident	19 Å²	19	45 Å²	45	12%	0.115	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-47	-172.9	176.9	0	0	0	0	111.8	F263 I396 T398	F263-V384 HydrophobicContact CE1-CG1 4.47Å; V384-I396 PolarHBondContact N-O 3.02Å; V384-T398 HydrophobicContact CB-CG2 4.46Å; V384-T398 HydrophobicContact CG2-CG2 3.48Å; V384-T398 VanDerWaalsContact CG2-CG2 3.48Å; V384-T398 VanDerWaalsContact CG2-OG1 3.23Å; V384-T398 WeakPolarHBondContact CG2-OG1 3.11Å
385	M	76.9	Confident	82.2	Confident	32 Å²	32	38.1 Å²	38.1	16%	0.158	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	178	-175.8	65.6	-174.4	-64.5	0	0	111	F253 F260 F264 M302 I396	F253-M385 HydrophobicContact CZ-CE 4.21Å; F260-M385 HydrophobicContact CD2-CE 4.07Å; F260-M385 HydrophobicContact CD2-SD 3.94Å; F260-M385 HydrophobicContact CE2-CE 3.91Å; F260-M385 HydrophobicContact CE2-SD 3.46Å; F260-M385 WeakPolarHBondContact CE2-SD 3.17Å; F264-M385 HydrophobicContact CE2-SD 4.17Å; F264-M385 HydrophobicContact CZ-SD 3.98Å; M302-M385 VanDerWaalsContact SD-CA 3.54Å; M385-I396 HydrophobicContact CE-CD1 4.37Å; M385-I396 HydrophobicContact CG-CB 3.71Å; M385-I396 HydrophobicContact CG-CD1 3.46Å; M385-I396 VanDerWaalsContact CG-CD1 3.46Å; M385-I396 HydrophobicContact CG-CG1 3.8Å; M385-I396 HydrophobicContact CG-CG2 4.39Å; M385-I396 PolarHBondContact N-O 3.13Å; M385-I396 WeakPolarHBondContact O-CA 3.43Å; M385-I396 PolarHBondContact O-N 3.17Å; M385-I396 HydrophobicContact SD-CD1 3.71Å
386	G	83	Confident	82.1	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.9	138	-170	0	0	0	0	0	107	M302 V394	M302-G386 WeakPolarHBondContact SD-CA 3.48Å; M302-G386 PolarHBondContact SD-N 3.25Å; G386-V394 CarbonylContact C-O 3.58Å; G386-V394 WeakPolarHBondContact CA-O 3.47Å
387	K	81.4	Confident	82.2	Confident	42 Å²	42	34 Å²	34	18%	0.183	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	134.3	-171	-176.5	179.8	177.5	-156.1	0	110.2	F253 M389 V394	F253-K387 HydrophobicContact CD1-CD 3.99Å; F253-K387 HydrophobicContact CD2-CD 3.9Å; F253-K387 HydrophobicContact CE1-CD 3.92Å; F253-K387 HydrophobicContact CE2-CD 3.8Å; F253-K387 HydrophobicContact CG-CD 3.97Å; F253-K387 HydrophobicContact CZ-CD 3.81Å; K387-M389 HydrophobicContact CD-SD 4.02Å; K387-M389 HydrophobicContact CG-SD 4.4Å; K387-V394 PolarHBondContact N-O 3.26Å; K387-V394 WeakPolarHBondContact O-CB 3.33Å; K387-V394 PolarHBondContact O-N 3.38Å
388	M	78.9	Confident	82.3	Confident	64 Å²	64	31.9 Å²	31.9	32%	0.315	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	126.7	168.2	-75	-54.6	-63.2	0	0	110	V305 E308 P393	V305-M388 HydrophobicContact CB-CG 4.48Å; V305-M388 HydrophobicContact CB-SD 4.24Å; V305-M388 HydrophobicContact CG2-CB 4.32Å; V305-M388 HydrophobicContact CG2-CG 3.58Å; V305-M388 VanDerWaalsContact CG2-N 3.3Å; V305-M388 HydrophobicContact CG2-SD 3.79Å; E308-M388 HydrophobicContact CB-CE 4.06Å; E308-M388 HydrophobicContact CB-SD 3.96Å; E308-M388 HydrophobicContact CG-CE 3.65Å; E308-M388 HydrophobicContact CG-SD 3.82Å; M388-P393 HydrophobicContact SD-CB 3.83Å
389	M	78	Confident	82.3	Confident	14 Å²	14	31.1 Å²	31.1	7%	0.069	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	159	169	-59	-69.6	-72.7	0	0	108.4	Q249 W250 K387 Q391 G392 V394	Q249-M389 VanDerWaalsContact C-CE 3.44Å; Q249-M389 HydrophobicContact CB-CE 3.44Å; Q249-M389 VanDerWaalsContact CB-CE 3.44Å; W250-M389 HydrophobicContact CB-CE 4.07Å; W250-M389 VanDerWaalsContact N-CE 3.28Å; K387-M389 HydrophobicContact CD-SD 4.02Å; K387-M389 HydrophobicContact CG-SD 4.4Å; M389-Q391 PolarHBondContact O-N 3.04Å; M389-G392 WeakPolarHBondContact CB-O 3.06Å; M389-G392 PolarHBondContact N-O 3.4Å; M389-G392 PolarHBondContact O-N 3.35Å; M389-V394 HydrophobicContact CB-CG2 4.4Å; M389-V394 HydrophobicContact CG-CG2 3.56Å
390	E	61.5	Low	82.6	Confident	161 Å²	161	30.9 Å²	30.9	75%	0.752	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-20.9	-176.8	-73.3	-174.9	169.4	0	0	113.5	Q249	Q249-E390 VanDerWaalsContact NE2-CD 3.29Å; Q249-E390 PolarHBondContact NE2-OE2 3.12Å
391	Q	59.5	Low	82.9	Confident	65 Å²	65	26 Å²	26	30%	0.304	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-6.5	-177.4	-48.4	82.2	12.8	0	0	113.8	Q249 M389	Q249-Q391 VanDerWaalsContact OE1-OE1 3.09Å; M389-Q391 PolarHBondContact O-N 3.04Å
392	G	75.9	Confident	83	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.01	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.8	160.4	-179	0	0	0	0	0	116.3	M389	M389-G392 WeakPolarHBondContact CB-O 3.06Å; M389-G392 PolarHBondContact N-O 3.4Å; M389-G392 PolarHBondContact O-N 3.35Å
393	P	88.1	Confident	83.3	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.006	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	124.5	171.6	27.7	-30.2	0	0	0	111.5	V305 I309 M388 C432 R433	V305-P393 HydrophobicContact CG1-CB 3.7Å; I309-P393 HydrophobicContact CD1-CB 4.1Å; I309-P393 HydrophobicContact CD1-CG 4.35Å; I309-P393 HydrophobicContact CG1-CB 3.77Å; I309-P393 HydrophobicContact CG1-CG 3.6Å; M388-P393 HydrophobicContact SD-CB 3.83Å; P393-C432 PolarHBondContact O-SG 3.37Å; P393-R433 HydrophobicContact CG-CB 4.19Å; P393-R433 PolarHBondContact O-N 3.21Å
394	V	88.8	Confident	83.5	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	134.6	175.9	-176.4	0	0	0	0	109.6	W250 G386 K387 M389 A430 L431 C432 L447	W250-V394 HydrophobicContact CH2-CG1 4.4Å; W250-V394 HydrophobicContact CZ3-CG1 3.92Å; G386-V394 CarbonylContact C-O 3.58Å; G386-V394 WeakPolarHBondContact CA-O 3.47Å; K387-V394 PolarHBondContact N-O 3.26Å; K387-V394 WeakPolarHBondContact O-CB 3.33Å; K387-V394 PolarHBondContact O-N 3.38Å; M389-V394 HydrophobicContact CB-CG2 4.4Å; M389-V394 HydrophobicContact CG-CG2 3.56Å; V394-A430 HydrophobicContact CG1-CB 4.09Å; V394-L431 CarbonylContact C-O 3.55Å; V394-L431 WeakPolarHBondContact CA-O 3.39Å; V394-L431 WeakPolarHBondContact CG1-O 3.42Å; V394-C432 HydrophobicContact CG2-CB 4.02Å; V394-L447 HydrophobicContact CG1-CD2 4.42Å; V394-L447 HydrophobicContact CG2-CD2 4.21Å
395	L	90.1	Very high	83.9	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	131.3	170.9	-65.9	-174.1	0	0	0	109.9	M302 V305 I309 F316 F321 L383 L431 W444	M302-L395 HydrophobicContact CE-CD2 4.36Å; V305-L395 HydrophobicContact CG1-CD2 3.72Å; I309-L395 HydrophobicContact CD1-CD1 4.16Å; I309-L395 HydrophobicContact CD1-CD2 4.27Å; I309-L395 HydrophobicContact CD1-CG 4.26Å; F316-L395 HydrophobicContact CZ-CD1 4.1Å; F321-L395 HydrophobicContact CD1-CD1 4.13Å; F321-L395 HydrophobicContact CE1-CD1 3.67Å; F321-L395 HydrophobicContact CZ-CD1 3.99Å; L383-L395 HydrophobicContact CD1-CB 3.81Å; L383-L395 HydrophobicContact CD1-CD1 4.29Å; L383-L395 HydrophobicContact CD1-CD2 4.15Å; L383-L395 HydrophobicContact CD1-CG 4.31Å; L395-L431 PolarHBondContact N-O 3.44Å; L395-L431 PolarHBondContact O-N 3.21Å; L395-L431 VanDerWaalsContact O-O 3.09Å; L395-W444 HydrophobicContact CB-CZ3 4.22Å; L395-W444 HydrophobicContact CD1-CH2 3.36Å; L395-W444 HydrophobicContact CD1-CZ2 4.29Å; L395-W444 HydrophobicContact CD1-CZ3 3.74Å; L395-W444 HydrophobicContact CG-CH2 3.94Å; L395-W444 HydrophobicContact CG-CZ3 3.93Å
396	I	88.9	Confident	84.6	Confident	2 Å²	2	25.3 Å²	25.3	1%	0.01	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	116.9	177	-51.1	-171.7	0	0	0	109.1	W250 F260 V384 M385 V428 W429	W250-I396 HydrophobicContact CH2-CD1 3.55Å; W250-I396 HydrophobicContact CH2-CG1 4.06Å; W250-I396 HydrophobicContact CZ3-CD1 4.28Å; F260-I396 HydrophobicContact CE2-CD1 3.93Å; F260-I396 HydrophobicContact CZ-CD1 4.07Å; V384-I396 PolarHBondContact N-O 3.02Å; M385-I396 HydrophobicContact CE-CD1 4.37Å; M385-I396 HydrophobicContact CG-CB 3.71Å; M385-I396 HydrophobicContact CG-CD1 3.46Å; M385-I396 VanDerWaalsContact CG-CD1 3.46Å; M385-I396 HydrophobicContact CG-CG1 3.8Å; M385-I396 HydrophobicContact CG-CG2 4.39Å; M385-I396 PolarHBondContact N-O 3.13Å; M385-I396 WeakPolarHBondContact O-CA 3.43Å; M385-I396 PolarHBondContact O-N 3.17Å; M385-I396 HydrophobicContact SD-CD1 3.71Å; I396-V428 HydrophobicContact CG2-CG1 3.68Å; I396-W429 CarbonylContact C-O 3.48Å; I396-W429 WeakPolarHBondContact CA-O 3.46Å
397	I	90.4	Very high	85	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	150.6	176.5	64.1	170.9	0	0	0	110.4	F321 C325 I330 D382 L383 V428 W429 L431	F321-I397 HydrophobicContact CE1-CG2 4.2Å; C325-I397 HydrophobicContact CB-CD1 4.43Å; I330-I397 HydrophobicContact CD1-CD1 4.13Å; I330-I397 HydrophobicContact CG1-CD1 4.28Å; D382-I397 CarbonylContact O-C 3.44Å; D382-I397 VanDerWaalsContact O-CA 3.26Å; D382-I397 WeakPolarHBondContact O-CA 3.04Å; L383-I397 HydrophobicContact CD1-CG2 3.9Å; I397-V428 WeakPolarHBondContact O-CA 3.44Å; I397-W429 HydrophobicContact CD1-CB 4.33Å; I397-W429 HydrophobicContact CG1-CB 3.82Å; I397-W429 PolarHBondContact N-O 3.36Å; I397-W429 PolarHBondContact O-N 2.89Å; I397-L431 HydrophobicContact CD1-CD1 3.65Å; I397-L431 HydrophobicContact CD1-CG 4.33Å; I397-L431 HydrophobicContact CG1-CD1 4.27Å
398	T	89.1	Confident	85.4	Confident	15 Å²	15	28.3 Å²	28.3	9%	0.092	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	140.5	171.1	57.1	0	0	0	0	110.1	I381 D382 V384 Y427 V428	I381-T398 WeakPolarHBondContact CA-O 3.13Å; D382-T398 PolarHBondContact N-O 2.89Å; D382-T398 PolarHBondContact O-N 3.4Å; V384-T398 HydrophobicContact CB-CG2 4.46Å; V384-T398 HydrophobicContact CG2-CG2 3.48Å; V384-T398 VanDerWaalsContact CG2-CG2 3.48Å; V384-T398 VanDerWaalsContact CG2-OG1 3.23Å; V384-T398 WeakPolarHBondContact CG2-OG1 3.11Å; T398-Y427 VanDerWaalsContact CA-O 3.25Å; T398-Y427 WeakPolarHBondContact CA-O 3.5Å; T398-V428 HydrophobicContact CG2-CB 4.34Å; T398-V428 HydrophobicContact CG2-CG1 4.16Å; T398-V428 HydrophobicContact CG2-CG2 3.96Å
399	F	90.1	Very high	86	Confident	1 Å²	1	27.6 Å²	27.6	0%	0.004	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	162.1	174.6	66.4	-88.5	0	0	0	110.8	I330 L334 I378 N380 I381 A401 Y427 W429	I330-F399 HydrophobicContact CD1-CD1 3.83Å; I330-F399 HydrophobicContact CD1-CE1 4.14Å; I330-F399 HydrophobicContact CD1-CG 4.12Å; I330-F399 HydrophobicContact CG1-CD1 4.28Å; I330-F399 HydrophobicContact CG1-CE1 4.08Å; I330-F399 HydrophobicContact CG1-CZ 4.45Å; I330-F399 HydrophobicContact CG2-CD1 4.49Å; I330-F399 HydrophobicContact CG2-CD2 4.13Å; I330-F399 HydrophobicContact CG2-CE1 4.02Å; I330-F399 HydrophobicContact CG2-CE2 3.61Å; I330-F399 HydrophobicContact CG2-CZ 3.55Å; L334-F399 HydrophobicContact CD1-CE2 3.56Å; L334-F399 HydrophobicContact CD1-CZ 3.89Å; I378-F399 HydrophobicContact CG2-CD2 3.91Å; I378-F399 HydrophobicContact CG2-CE2 4.47Å; N380-F399 WeakPolarHBondContact O-CA 3.32Å; I381-F399 HydrophobicContact CB-CB 4.25Å; I381-F399 HydrophobicContact CG1-CB 3.64Å; I381-F399 HydrophobicContact CG1-CG 4.5Å; F399-A401 HydrophobicContact CD2-CB 4.47Å; F399-A401 HydrophobicContact CE2-CB 4.27Å; F399-Y427 HydrophobicContact CD2-CD2 4.07Å; F399-Y427 HydrophobicContact CE1-CG 4.23Å; F399-Y427 AromaticContact CE2-CD2 3.33Å; F399-Y427 HydrophobicContact CE2-CD2 3.33Å; F399-Y427 HydrophobicContact CE2-CE2 4.18Å; F399-Y427 AromaticContact CE2-CG 3.73Å; F399-Y427 HydrophobicContact CE2-CG 3.73Å; F399-Y427 HydrophobicContact CZ-CD1 4.41Å; F399-Y427 AromaticContact CZ-CD2 3.68Å; F399-Y427 HydrophobicContact CZ-CD2 3.68Å; F399-Y427 AromaticContact CZ-CG 3.56Å; F399-Y427 HydrophobicContact CZ-CG 3.56Å; F399-Y427 PolarHBondContact N-O 3.41Å; F399-Y427 PolarHBondContact O-N 3.04Å; F399-W429 AromaticContact CE1-CD1 3.9Å; F399-W429 AromaticContact CE1-CD2 3.6Å; F399-W429 HydrophobicContact CE1-CD2 3.6Å; F399-W429 AromaticContact CE1-CE2 3.54Å; F399-W429 HydrophobicContact CE1-CE3 4.08Å; F399-W429 AromaticContact CE1-CG 3.86Å; F399-W429 HydrophobicContact CE1-CG 3.86Å; F399-W429 HydrophobicContact CE1-CH2 4.42Å; F399-W429 HydrophobicContact CE1-CZ2 4Å; F399-W429 HydrophobicContact CE1-CZ3 4.46Å; F399-W429 AromaticContact CE1-NE1 3.69Å; F399-W429 HydrophobicContact CZ-CD2 4.06Å; F399-W429 AromaticContact CZ-CE2 3.5Å; F399-W429 HydrophobicContact CZ-CH2 4.11Å; F399-W429 AromaticContact CZ-CZ2 3.56Å; F399-W429 HydrophobicContact CZ-CZ2 3.56Å; F399-W429 AromaticContact CZ-NE1 3.69Å
400	Q	89.4	Confident	86.5	Confident	30 Å²	30	31.5 Å²	31.5	14%	0.14	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	143.4	175.8	-52	-161.6	1.3	0	0	109	I378 D379 N380 M425 M426	I378-Q400 CarbonylContact C-O 3.52Å; I378-Q400 WeakPolarHBondContact CA-O 3.18Å; D379-Q400 PolarHBondContact N-O 3.14Å; D379-Q400 PolarHBondContact O-N 2.8Å; D379-Q400 WeakPolarHBondContact OD1-CB 2.98Å; N380-Q400 HydrophobicContact CB-CG 4.22Å; Q400-M425 CarbonylContact C-O 3.59Å; Q400-M425 WeakPolarHBondContact CA-O 3.46Å; Q400-M426 HydrophobicContact CB-SD 4.17Å; Q400-M426 HydrophobicContact CG-CE 3.68Å; Q400-M426 HydrophobicContact CG-SD 3.3Å; Q400-M426 WeakPolarHBondContact CG-SD 3.16Å; Q400-M426 PolarHBondContact NE2-SD 3.22Å
401	A	90.4	Very high	87.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	140.1	172.6	0	0	0	0	0	111.4	L334 D377 I378 F399 L403 M425 Y427	L334-A401 HydrophobicContact CD1-CB 4.17Å; D377-A401 CarbonylContact O-C 3.59Å; D377-A401 VanDerWaalsContact O-CA 3.28Å; D377-A401 WeakPolarHBondContact O-CA 3.44Å; I378-A401 HydrophobicContact CG1-CB 4.29Å; F399-A401 HydrophobicContact CD2-CB 4.47Å; F399-A401 HydrophobicContact CE2-CB 4.27Å; A401-L403 HydrophobicContact CB-CD1 4.11Å; A401-L403 HydrophobicContact CB-CG 4.45Å; A401-M425 PolarHBondContact N-O 3.14Å; A401-M425 PolarHBondContact O-N 2.9Å; A401-Y427 HydrophobicContact CB-CD2 4.18Å; A401-Y427 HydrophobicContact CB-CE2 3.95Å
402	Q	90.6	Very high	88.8	Confident	39 Å²	39	30.3 Å²	30.3	18%	0.182	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	126.9	174.4	-65.5	179.3	25.7	0	0	109.6	L376 D377 V422 L423	L376-Q402 HydrophobicContact CB-CB 4.04Å; L376-Q402 PolarHBondContact N-O 3.37Å; D377-Q402 HydrophobicContact CB-CB 4.31Å; D377-Q402 HydrophobicContact CB-CG 4.49Å; D377-Q402 PolarHBondContact O-N 3.06Å; Q402-V422 HydrophobicContact CB-CG1 4.18Å; Q402-L423 CarbonylContact C-O 3.5Å; Q402-L423 WeakPolarHBondContact CA-O 3.3Å
403	L	90.3	Very high	89.4	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	139.4	-165.9	-69	143.6	0	0	0	110.4	L334 I338 K374 I375 A401 L423 M425 Y427	L334-L403 HydrophobicContact CD2-CD2 3.76Å; I338-L403 HydrophobicContact CD1-CD2 3.21Å; I338-L403 HydrophobicContact CG1-CD2 4.38Å; K374-L403 WeakPolarHBondContact O-CA 3.44Å; I375-L403 HydrophobicContact CB-CD2 4.32Å; I375-L403 HydrophobicContact CG1-CD2 3.76Å; I375-L403 HydrophobicContact CG2-CD2 4.43Å; A401-L403 HydrophobicContact CB-CD1 4.11Å; A401-L403 HydrophobicContact CB-CG 4.45Å; L403-L423 PolarHBondContact N-O 3.26Å; L403-L423 PolarHBondContact O-N 2.89Å; L403-M425 HydrophobicContact CD1-CB 3.68Å; L403-M425 HydrophobicContact CD1-CG 3.35Å; L403-Y427 HydrophobicContact CD1-CE2 3.89Å; L403-Y427 WeakPolarHBondContact CD1-OH 3.38Å
404	V	91	Very high	89.5	Confident	22 Å²	22	39.2 Å²	39.2	13%	0.133	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	110.5	167.1	179.9	0	0	0	0	106.6	S373 K374 L376 V406 P419 V422	S373-V404 CarbonylContact C-O 3.59Å; S373-V404 WeakPolarHBondContact CA-O 3.34Å; S373-V404 WeakPolarHBondContact CB-O 3.18Å; K374-V404 PolarHBondContact N-O 3.48Å; K374-V404 PolarHBondContact O-N 2.56Å; L376-V404 HydrophobicContact CD1-CG2 3.84Å; L376-V404 HydrophobicContact CD2-CG2 4.38Å; L376-V404 HydrophobicContact CG-CG2 4.1Å; V404-V406 HydrophobicContact CG1-CG2 3.98Å; V404-P419 WeakPolarHBondContact CG1-O 3.35Å; V404-V422 HydrophobicContact CG2-CG2 4.13Å
405	M	89.3	Confident	89.4	Confident	68 Å²	68	43.3 Å²	43.3	34%	0.335	23%	0.228	S	C	.	.			trans	-97.1	116.9	-176.7	-67.3	-66.7	-75.8	0	0	109.5	S373 G417 D418 L423	S373-M405 WeakPolarHBondContact OG-CA 3.33Å; M405-G417 WeakPolarHBondContact O-CA 3.27Å; M405-D418 PolarHBondContact O-N 3.2Å; M405-L423 HydrophobicContact CB-CD1 4.16Å; M405-L423 HydrophobicContact CG-CD1 3.94Å
406	V	91.3	Very high	89.2	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.03	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	122.3	-179.7	-175.7	0	0	0	0	110.1	H372 S373 V404 R408 V414 P419	H372-V406 CarbonylContact C-O 3.55Å; H372-V406 HydrophobicContact CB-CB 4.49Å; H372-V406 PolarHBondContact N-O 3.29Å; S373-V406 PolarHBondContact N-O 3.19Å; S373-V406 PolarHBondContact OG-N 2.82Å; S373-V406 PolarHBondContact OG-O 2.92Å; V404-V406 HydrophobicContact CG1-CG2 3.98Å; V406-R408 HydrophobicContact CG1-CG 3.99Å; V406-V414 HydrophobicContact CG1-CG1 4.17Å; V406-V414 HydrophobicContact CG1-CG2 4.1Å; V406-P419 VanDerWaalsContact CG2-CA 3.43Å; V406-P419 HydrophobicContact CG2-CB 3.86Å
407	I	91.1	Very high	89	Confident	18 Å²	18	51 Å²	51	9%	0.092	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	125.7	172.2	-54.4	-179.8	0	0	0	108.3	L369 F371 V415 E416	L369-I407 HydrophobicContact CB-CG2 3.65Å; L369-I407 HydrophobicContact CD1-CG2 3.99Å; L369-I407 HydrophobicContact CD2-CG2 4.46Å; L369-I407 HydrophobicContact CG-CG2 4.24Å; F371-I407 HydrophobicContact CD1-CD1 4.12Å; F371-I407 HydrophobicContact CD1-CG1 4.04Å; F371-I407 HydrophobicContact CE1-CD1 3.9Å; F371-I407 HydrophobicContact CE1-CG1 4.33Å; I407-V415 PolarHBondContact O-N 3.16Å; I407-E416 HydrophobicContact CB-CB 4.11Å; I407-E416 HydrophobicContact CD1-CB 4.29Å; I407-E416 HydrophobicContact CG1-CB 4.43Å; I407-E416 PolarHBondContact N-O 3.42Å; I407-E416 PolarHBondContact O-N 3.22Å
408	R	91	Very high	88.9	Confident	89 Å²	89	55.5 Å²	55.5	34%	0.336	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	149.5	-178.4	-63.6	-175.6	177.5	-169.3	-3	111.1	L369 Q370 V406 E413 V414	L369-R408 CarbonylContact C-O 3.59Å; Q370-R408 PolarHBondContact N-O 2.9Å; Q370-R408 PolarHBondContact O-N 2.82Å; V406-R408 HydrophobicContact CG1-CG 3.99Å; R408-E413 CarbonylContact C-O 3.59Å; R408-E413 VanDerWaalsContact CA-O 3.22Å; R408-E413 WeakPolarHBondContact CA-O 3.25Å; R408-V414 HydrophobicContact CG-CG2 4.42Å
409	N	91.3	Very high	88.8	Confident	48 Å²	48	57.4 Å²	57.4	26%	0.257	31%	0.311	S	S	.	.			trans	-73.7	169.2	167.8	-158.1	-18.7	0	0	0	110.2	K411 G412 E413 V415	N409-K411 PolarHBondContact O-N 3.5Å; N409-K411 VanDerWaalsContact O-N 3.07Å; N409-G412 PolarHBondContact O-N 3.29Å; N409-E413 PolarHBondContact N-O 2.92Å; N409-V415 HydrophobicContact CB-CG2 3.7Å
410	T	88.1	Confident	88.7	Confident	97 Å²	97	64.7 Å²	64.7	60%	0.595	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	-28.5	166.9	52.6	0	0	0	0	113.9	G368 G412	G368-T410 WeakPolarHBondContact O-CG2 3.46Å; T410-G412 VanDerWaalsContact C-N 3.33Å
411	K	86.3	Confident	88.6	Confident	163 Å²	163	66.6 Å²	66.6	71%	0.709	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-5.1	176.5	-61.2	-177.2	-177.9	178.4	0	114.3	N409 E413	N409-K411 PolarHBondContact O-N 3.5Å; N409-K411 VanDerWaalsContact O-N 3.07Å; K411-E413 VanDerWaalsContact C-N 3.32Å
412	G	83.8	Confident	88.6	Confident	37 Å²	37	68.2 Å²	68.2	38%	0.381	37%	0.368	S	S	.	.	S	Bend	trans	83.9	-0.8	-177.8	0	0	0	0	0	115.2	N409 T410	N409-G412 PolarHBondContact O-N 3.29Å; T410-G412 VanDerWaalsContact C-N 3.33Å
413	E	87.8	Confident	88.4	Confident	126 Å²	126	67.9 Å²	67.9	59%	0.589	37%	0.367	S	S	*	.			trans	-70.7	139.1	173.2	-66.5	171.6	-175.6	0	0	110.6	R408 N409 K411 V415	R408-E413 CarbonylContact C-O 3.59Å; R408-E413 VanDerWaalsContact CA-O 3.22Å; R408-E413 WeakPolarHBondContact CA-O 3.25Å; N409-E413 PolarHBondContact N-O 2.92Å; K411-E413 VanDerWaalsContact C-N 3.32Å; E413-V415 PolarHBondContact O-N 3.13Å
414	V	90.1	Very high	88.3	Confident	63 Å²	63	70.7 Å²	70.7	38%	0.382	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	119.9	176.8	-177.6	0	0	0	0	108.6	V406 R408 G417	V406-V414 HydrophobicContact CG1-CG1 4.17Å; V406-V414 HydrophobicContact CG1-CG2 4.1Å; R408-V414 HydrophobicContact CG-CG2 4.42Å; V414-G417 WeakPolarHBondContact CG1-O 3.22Å
415	V	87.8	Confident	88.1	Confident	86 Å²	86	71 Å²	71	52%	0.521	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-35.8	179.5	-174.2	0	0	0	0	110.3	L369 I407 N409 E413	L369-V415 HydrophobicContact CD2-CB 4.32Å; L369-V415 HydrophobicContact CD2-CG1 4.45Å; L369-V415 HydrophobicContact CD2-CG2 3.92Å; I407-V415 PolarHBondContact O-N 3.16Å; N409-V415 HydrophobicContact CB-CG2 3.7Å; E413-V415 PolarHBondContact O-N 3.13Å
416	E	84.5	Confident	88.1	Confident	126 Å²	126	69.4 Å²	69.4	59%	0.589	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.5	138.8	-177.8	-168.1	-179.6	158.5	0	0	110.6	I407	I407-E416 HydrophobicContact CB-CB 4.11Å; I407-E416 HydrophobicContact CD1-CB 4.29Å; I407-E416 HydrophobicContact CG1-CB 4.43Å; I407-E416 PolarHBondContact N-O 3.42Å; I407-E416 PolarHBondContact O-N 3.22Å
417	G	85.5	Confident	88	Confident	37 Å²	37	70.2 Å²	70.2	38%	0.381	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	83.5	179	-178.4	0	0	0	0	0	113.9	M405 V414	M405-G417 WeakPolarHBondContact O-CA 3.27Å; V414-G417 WeakPolarHBondContact CG1-O 3.22Å
418	D	87.4	Confident	88	Confident	96 Å²	96	71 Å²	71	51%	0.513	38%	0.378	S	S	.	.			trans	-129.6	124.4	-177.1	-74.1	-45.3	0	0	0	109	M405 D420 K421	M405-D418 PolarHBondContact O-N 3.2Å; D418-D420 PolarHBondContact O-N 3.31Å; D418-K421 HydrophobicContact CB-CB 3.66Å; D418-K421 PolarHBondContact O-N 3.35Å
419	P	88	Confident	88	Confident	55 Å²	55	66.8 Å²	66.8	36%	0.357	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-21.6	-179.1	28.6	-35	0	0	0	113.6	V404 V406	V404-P419 WeakPolarHBondContact CG1-O 3.35Å; V406-P419 VanDerWaalsContact CG2-CA 3.43Å; V406-P419 HydrophobicContact CG2-CB 3.86Å
420	D	88	Confident	87.9	Confident	153 Å²	153	64.7 Å²	64.7	82%	0.818	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-11.6	-176.9	-56.1	-39.9	0	0	0	112.2	D418	D418-D420 PolarHBondContact O-N 3.31Å
421	K	87.6	Confident	88.1	Confident	70 Å²	70	60.1 Å²	60.1	30%	0.304	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-94.2	122.7	-178.6	-166	178.3	-176.6	177.2	0	110.3	D418 L423 E455	D418-K421 HydrophobicContact CB-CB 3.66Å; D418-K421 PolarHBondContact O-N 3.35Å; K421-L423 HydrophobicContact CD-CD2 4.1Å; K421-L423 HydrophobicContact CG-CD2 4.26Å; K421-E455 IonicContact NZ-OE1 2.79Å; K421-E455 PolarHBondContact NZ-OE1 3.49Å; K421-E455 IonicContact NZ-OE2 2.88Å; K421-E455 PolarHBondContact NZ-OE2 2.93Å
422	V	89.4	Confident	88.2	Confident	35 Å²	35	52.3 Å²	52.3	21%	0.212	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-90.2	127.2	170.6	-177.3	0	0	0	0	109.1	L376 Q402 V404	L376-V422 HydrophobicContact CD1-CB 4.4Å; L376-V422 HydrophobicContact CD1-CG1 3.76Å; L376-V422 HydrophobicContact CD1-CG2 3.72Å; Q402-V422 HydrophobicContact CB-CG1 4.18Å; V404-V422 HydrophobicContact CG2-CG2 4.13Å
423	L	87.6	Confident	88.3	Confident	32 Å²	32	50.8 Å²	50.8	17%	0.168	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	131.2	175.5	-58.7	178.1	0	0	0	109.1	Q402 L403 M405 K421 M425	Q402-L423 CarbonylContact C-O 3.5Å; Q402-L423 WeakPolarHBondContact CA-O 3.3Å; L403-L423 PolarHBondContact N-O 3.26Å; L403-L423 PolarHBondContact O-N 2.89Å; M405-L423 HydrophobicContact CB-CD1 4.16Å; M405-L423 HydrophobicContact CG-CD1 3.94Å; K421-L423 HydrophobicContact CD-CD2 4.1Å; K421-L423 HydrophobicContact CG-CD2 4.26Å; L423-M425 HydrophobicContact CB-CE 4.42Å; L423-M425 HydrophobicContact CD1-CE 4.09Å
424	R	87.6	Confident	88.1	Confident	58 Å²	58	46.4 Å²	46.4	22%	0.219	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	114.4	170.2	176.6	179.8	-72.5	-113.5	-2.5	108.3	D379 T454 Q456	D379-R424 IonicContact OD2-NH1 2.77Å; R424-T454 WeakPolarHBondContact CB-OG1 3.29Å; R424-T454 WeakPolarHBondContact CG-OG1 3.43Å; R424-T454 PolarHBondContact N-O 3.48Å; R424-T454 PolarHBondContact O-N 2.97Å; R424-T454 VanDerWaalsContact O-O 3.11Å; R424-T454 PolarHBondContact O-OG1 2.91Å; R424-Q456 HydrophobicContact CB-CG 3.89Å
425	M	87.5	Confident	87.6	Confident	30 Å²	30	47.4 Å²	47.4	15%	0.148	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	134.1	179	-64.1	-68.1	-166.9	0	0	110.2	Q400 A401 L403 L423 Y427 S452 S453	Q400-M425 CarbonylContact C-O 3.59Å; Q400-M425 WeakPolarHBondContact CA-O 3.46Å; A401-M425 PolarHBondContact N-O 3.14Å; A401-M425 PolarHBondContact O-N 2.9Å; L403-M425 HydrophobicContact CD1-CB 3.68Å; L403-M425 HydrophobicContact CD1-CG 3.35Å; L423-M425 HydrophobicContact CB-CE 4.42Å; L423-M425 HydrophobicContact CD1-CE 4.09Å; M425-Y427 HydrophobicContact CB-CD2 4.08Å; M425-Y427 HydrophobicContact CB-CE2 3.48Å; M425-Y427 VanDerWaalsContact CB-CE2 3.48Å; M425-Y427 HydrophobicContact CG-CE2 4.33Å; M425-S452 WeakPolarHBondContact CA-O 3.46Å; M425-S453 WeakPolarHBondContact SD-CA 3.38Å; M425-S453 WeakPolarHBondContact SD-CB 3.26Å
426	M	87.9	Confident	87.1	Confident	33 Å²	33	50.7 Å²	50.7	16%	0.163	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	119.3	167.5	-61.4	-64.5	-62.5	0	0	107.8	D271 Q400 A451 S452 T454	D271-M426 HydrophobicContact CB-CE 4.44Å; Q400-M426 HydrophobicContact CB-SD 4.17Å; Q400-M426 HydrophobicContact CG-CE 3.68Å; Q400-M426 HydrophobicContact CG-SD 3.3Å; Q400-M426 WeakPolarHBondContact CG-SD 3.16Å; Q400-M426 PolarHBondContact NE2-SD 3.22Å; M426-A451 WeakPolarHBondContact O-CA 3.35Å; M426-S452 PolarHBondContact N-O 3.46Å; M426-S452 PolarHBondContact O-N 3.42Å; M426-T454 HydrophobicContact CG-CG2 4.4Å
427	Y	90.2	Very high	86.8	Confident	23 Å²	23	46.6 Å²	46.6	9%	0.09	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	139.2	177.9	-73.3	-78	0	0	0	111.3	L334 T398 F399 A401 L403 M425 W429 I449 A451	L334-Y427 HydrophobicContact CD1-CD2 4.36Å; L334-Y427 HydrophobicContact CD1-CE2 4.01Å; T398-Y427 VanDerWaalsContact CA-O 3.25Å; T398-Y427 WeakPolarHBondContact CA-O 3.5Å; F399-Y427 HydrophobicContact CD2-CD2 4.07Å; F399-Y427 HydrophobicContact CE1-CG 4.23Å; F399-Y427 AromaticContact CE2-CD2 3.33Å; F399-Y427 HydrophobicContact CE2-CD2 3.33Å; F399-Y427 HydrophobicContact CE2-CE2 4.18Å; F399-Y427 AromaticContact CE2-CG 3.73Å; F399-Y427 HydrophobicContact CE2-CG 3.73Å; F399-Y427 HydrophobicContact CZ-CD1 4.41Å; F399-Y427 AromaticContact CZ-CD2 3.68Å; F399-Y427 HydrophobicContact CZ-CD2 3.68Å; F399-Y427 AromaticContact CZ-CG 3.56Å; F399-Y427 HydrophobicContact CZ-CG 3.56Å; F399-Y427 PolarHBondContact N-O 3.41Å; F399-Y427 PolarHBondContact O-N 3.04Å; A401-Y427 HydrophobicContact CB-CD2 4.18Å; A401-Y427 HydrophobicContact CB-CE2 3.95Å; L403-Y427 HydrophobicContact CD1-CE2 3.89Å; L403-Y427 WeakPolarHBondContact CD1-OH 3.38Å; M425-Y427 HydrophobicContact CB-CD2 4.08Å; M425-Y427 HydrophobicContact CB-CE2 3.48Å; M425-Y427 VanDerWaalsContact CB-CE2 3.48Å; M425-Y427 HydrophobicContact CG-CE2 4.33Å; Y427-W429 AromaticContact CD1-NE1 3.53Å; Y427-W429 AromaticContact CG-NE1 3.86Å; Y427-I449 HydrophobicContact CD1-CD1 4.2Å; Y427-I449 HydrophobicContact CD1-CG1 4.38Å; Y427-I449 HydrophobicContact CE1-CD1 4.27Å; Y427-A451 HydrophobicContact CD1-CB 3.64Å; Y427-A451 HydrophobicContact CE1-CB 3.48Å; Y427-A451 VanDerWaalsContact CE1-CB 3.48Å
428	V	89.8	Confident	86.1	Confident	35 Å²	35	51.1 Å²	51.1	21%	0.212	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	112.8	168.9	-175	0	0	0	0	106.8	F264 I396 I397 T398 S450	F264-V428 HydrophobicContact CD1-CG2 4.35Å; F264-V428 HydrophobicContact CE1-CG1 3.93Å; F264-V428 HydrophobicContact CE1-CG2 4.41Å; I396-V428 HydrophobicContact CG2-CG1 3.68Å; I397-V428 WeakPolarHBondContact O-CA 3.44Å; T398-V428 HydrophobicContact CG2-CB 4.34Å; T398-V428 HydrophobicContact CG2-CG1 4.16Å; T398-V428 HydrophobicContact CG2-CG2 3.96Å; V428-S450 PolarHBondContact N-O 2.96Å; V428-S450 PolarHBondContact O-N 3.38Å
429	W	91.8	Very high	85.6	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	133.4	-178.3	-72.4	15.2	0	0	0	110.1	I330 I333 L334 I396 I397 F399 Y427 L431 L446 I449	I330-W429 HydrophobicContact CB-CH2 4.42Å; I330-W429 HydrophobicContact CB-CZ3 4.26Å; I330-W429 HydrophobicContact CG1-CE3 4.33Å; I330-W429 HydrophobicContact CG1-CZ3 3.97Å; I330-W429 HydrophobicContact CG2-CH2 4.18Å; I330-W429 HydrophobicContact CG2-CZ3 4.45Å; I333-W429 HydrophobicContact CB-CH2 3.61Å; I333-W429 HydrophobicContact CB-CZ3 3.89Å; I333-W429 HydrophobicContact CD1-CH2 4.49Å; I333-W429 HydrophobicContact CD1-CZ3 3.91Å; I333-W429 HydrophobicContact CG1-CZ3 4.46Å; I333-W429 HydrophobicContact CG2-CH2 3.5Å; I333-W429 VanDerWaalsContact CG2-CH2 3.5Å; I333-W429 HydrophobicContact CG2-CZ2 4.08Å; I333-W429 HydrophobicContact CG2-CZ3 3.95Å; L334-W429 HydrophobicContact CB-CH2 4.37Å; I396-W429 CarbonylContact C-O 3.48Å; I396-W429 WeakPolarHBondContact CA-O 3.46Å; I397-W429 HydrophobicContact CD1-CB 4.33Å; I397-W429 HydrophobicContact CG1-CB 3.82Å; I397-W429 PolarHBondContact N-O 3.36Å; I397-W429 PolarHBondContact O-N 2.89Å; F399-W429 AromaticContact CE1-CD1 3.9Å; F399-W429 AromaticContact CE1-CD2 3.6Å; F399-W429 HydrophobicContact CE1-CD2 3.6Å; F399-W429 AromaticContact CE1-CE2 3.54Å; F399-W429 HydrophobicContact CE1-CE3 4.08Å; F399-W429 AromaticContact CE1-CG 3.86Å; F399-W429 HydrophobicContact CE1-CG 3.86Å; F399-W429 HydrophobicContact CE1-CH2 4.42Å; F399-W429 HydrophobicContact CE1-CZ2 4Å; F399-W429 HydrophobicContact CE1-CZ3 4.46Å; F399-W429 AromaticContact CE1-NE1 3.69Å; F399-W429 HydrophobicContact CZ-CD2 4.06Å; F399-W429 AromaticContact CZ-CE2 3.5Å; F399-W429 HydrophobicContact CZ-CH2 4.11Å; F399-W429 AromaticContact CZ-CZ2 3.56Å; F399-W429 HydrophobicContact CZ-CZ2 3.56Å; F399-W429 AromaticContact CZ-NE1 3.69Å; Y427-W429 AromaticContact CD1-NE1 3.53Å; Y427-W429 AromaticContact CG-NE1 3.86Å; W429-L431 HydrophobicContact CE3-CD2 4.44Å; W429-L446 HydrophobicContact CB-CD1 3.86Å; W429-L446 HydrophobicContact CD2-CD1 3.81Å; W429-L446 HydrophobicContact CE3-CD1 3.87Å; W429-L446 HydrophobicContact CG-CD1 3.84Å; W429-I449 HydrophobicContact CZ2-CD1 4.07Å
430	A	90.1	Very high	85	Confident	3 Å²	3	47.2 Å²	47.2	3%	0.025	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	107.9	167.6	0	0	0	0	0	108.3	W250 V394 L447 D448	W250-A430 HydrophobicContact CH2-CB 3.56Å; W250-A430 HydrophobicContact CZ2-CB 3.53Å; W250-A430 HydrophobicContact CZ3-CB 4.33Å; V394-A430 HydrophobicContact CG1-CB 4.09Å; A430-L447 HydrophobicContact CB-CB 4.33Å; A430-L447 WeakPolarHBondContact O-CB 3.21Å; A430-L447 PolarHBondContact O-N 3.18Å; A430-D448 HydrophobicContact CB-CB 4.13Å; A430-D448 PolarHBondContact N-O 3.15Å; A430-D448 PolarHBondContact O-N 3.34Å
431	L	91	Very high	84.4	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	139.7	173	-63	176.4	0	0	0	108.9	F321 I329 V394 L395 I397 W429 W444 R445 L446	F321-L431 HydrophobicContact CZ-CD1 3.92Å; I329-L431 HydrophobicContact CG2-CD1 4.4Å; I329-L431 HydrophobicContact CG2-CD2 4.26Å; V394-L431 CarbonylContact C-O 3.55Å; V394-L431 WeakPolarHBondContact CA-O 3.39Å; V394-L431 WeakPolarHBondContact CG1-O 3.42Å; L395-L431 PolarHBondContact N-O 3.44Å; L395-L431 PolarHBondContact O-N 3.21Å; L395-L431 VanDerWaalsContact O-O 3.09Å; I397-L431 HydrophobicContact CD1-CD1 3.65Å; I397-L431 HydrophobicContact CD1-CG 4.33Å; I397-L431 HydrophobicContact CG1-CD1 4.27Å; W429-L431 HydrophobicContact CE3-CD2 4.44Å; L431-W444 HydrophobicContact CB-CE3 4.06Å; L431-R445 WeakPolarHBondContact CA-O 3.23Å; L431-L446 HydrophobicContact CD2-CB 4.45Å; L431-L446 HydrophobicContact CD2-CD1 3.96Å
432	C	88.3	Confident	84	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	146.3	173.4	-173.7	0	0	0	0	111.1	W246 Y350 P393 V394 W444 R445	W246-C432 HydrophobicContact CH2-CB 3.3Å; W246-C432 WeakPolarHBondContact CH2-SG 3.4Å; W246-C432 HydrophobicContact CZ2-CB 3.03Å; W246-C432 WeakPolarHBondContact CZ2-SG 3.17Å; Y350-C432 HydrophobicContact CE2-CB 4.47Å; P393-C432 PolarHBondContact O-SG 3.37Å; V394-C432 HydrophobicContact CG2-CB 4.02Å; C432-W444 WeakPolarHBondContact O-CA 3.23Å; C432-R445 PolarHBondContact N-O 3.35Å; C432-R445 PolarHBondContact O-N 3.25Å
433	R	86.8	Confident	83.8	Confident	5 Å²	5	41.4 Å²	41.4	2%	0.019	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	121.5	-179.5	-167.5	172.9	173.1	-82.5	-3.2	109.6	V312 P393 Q435 A443 W444	V312-R433 VanDerWaalsContact CB-NH1 3.28Å; V312-R433 VanDerWaalsContact CG1-NH2 3.32Å; P393-R433 HydrophobicContact CG-CB 4.19Å; P393-R433 PolarHBondContact O-N 3.21Å; R433-Q435 PolarHBondContact O-N 3.39Å; R433-A443 HydrophobicContact CG-CB 3.79Å; R433-W444 HydrophobicContact CB-CD2 4.3Å; R433-W444 HydrophobicContact CB-CE3 3.95Å; R433-W444 HydrophobicContact CB-CH2 3.89Å; R433-W444 HydrophobicContact CB-CZ2 4.23Å; R433-W444 HydrophobicContact CB-CZ3 3.76Å; R433-W444 HydrophobicContact CG-CH2 4.39Å; R433-W444 HydrophobicContact CG-CZ2 4.25Å
434	D	83.4	Confident	83.8	Confident	33 Å²	33	40 Å²	40	18%	0.176	19%	0.191	C	C	.	.			trans	-69.3	121	166.3	-161.9	-16.2	0	0	0	109	R214 E436 E437 A443 R445	R214-D434 IonicContact NH2-OD2 3.66Å; D434-E436 VanDerWaalsContact C-N 3.33Å; D434-E436 PolarHBondContact OD1-N 3.01Å; D434-E437 HydrophobicContact CB-CB 4.26Å; D434-A443 WeakPolarHBondContact CB-O 3.44Å; D434-A443 PolarHBondContact N-O 2.87Å; D434-R445 IonicContact OD2-CZ 3.98Å; D434-R445 IonicContact OD2-NH1 3.19Å; D434-R445 PolarHBondContact OD2-NH1 2.98Å; D434-R445 IonicContact OD2-NH2 3.91Å
435	Q	78.6	Confident	83.9	Confident	85 Å²	85	40.3 Å²	40.3	40%	0.397	19%	0.192	S	C	.	.	S	Bend	trans	-78.8	-20.8	-179.6	-62.1	-174.4	22.1	0	0	112.3	R433 E437	R433-Q435 PolarHBondContact O-N 3.39Å; Q435-E437 VanDerWaalsContact C-N 3.31Å
436	E	78.1	Confident	84.1	Confident	154 Å²	154	38.9 Å²	38.9	72%	0.72	19%	0.185	S	C	*	.	S	Bend	trans	-77.5	-20.9	-179.4	-60.7	-179.9	-175.9	0	0	111.4	K242 D434	K242-E436 IonicContact NZ-OE1 3.22Å; K242-E436 PolarHBondContact NZ-OE1 3.07Å; D434-E436 VanDerWaalsContact C-N 3.33Å; D434-E436 PolarHBondContact OD1-N 3.01Å
437	E	77.6	Confident	84.1	Confident	40 Å²	40	37.4 Å²	37.4	19%	0.187	18%	0.178	C	C	.	.			trans	-80.8	118.8	179.7	-176.1	72.1	-124.5	0	0	111.5	R214 D434 Q435 A442 A443	R214-E437 IonicContact CZ-OE2 3.64Å; R214-E437 IonicContact NE-OE2 2.82Å; R214-E437 IonicContact NH2-OE2 3.85Å; R214-E437 PolarHBondContact NH2-OE2 3.43Å; D434-E437 HydrophobicContact CB-CB 4.26Å; Q435-E437 VanDerWaalsContact C-N 3.31Å; E437-A442 HydrophobicContact CG-CB 4.27Å; E437-A443 HydrophobicContact CB-CB 4.2Å; E437-A443 HydrophobicContact CG-CB 4.24Å
438	L	70.7	Confident	84	Confident	133 Å²	133	37.1 Å²	37.1	70%	0.696	18%	0.178	S	C	*	.			trans	-74.8	-30.4	179.9	-164	75.3	0	0	0	112.4	P440	L438-P440 WeakPolarHBondContact O-CD 3.45Å
439	N	77.3	Confident	83.9	Confident	33 Å²	33	36.8 Å²	36.8	18%	0.176	18%	0.175	C	C	.	.			trans	-78.9	113.5	179.7	-172.7	-16.2	0	0	0	110.5	F217 Y441 A442 A443	F217-N439 PolarHBondContact O-ND2 3.04Å; N439-Y441 PolarHBondContact O-N 3.08Å; N439-Y441 PolarHBondContact OD1-N 2.63Å; N439-Y441 VanDerWaalsContact OD1-N 3.13Å; N439-A442 HydrophobicContact CB-CB 4.22Å; N439-A442 PolarHBondContact O-N 3.36Å; N439-A443 PolarHBondContact O-N 3.3Å; N439-A443 VanDerWaalsContact O-N 3.14Å
440	P	75	Confident	83.7	Confident	36 Å²	36	39.5 Å²	39.5	23%	0.234	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-28.8	-175.2	27.7	-35.9	0	0	0	112.6	D313 L438	D313-P440 VanDerWaalsContact OD2-CB 3.24Å; D313-P440 WeakPolarHBondContact OD2-CB 3.26Å; L438-P440 WeakPolarHBondContact O-CD 3.45Å
441	Y	76	Confident	83.4	Confident	134 Å²	134	42 Å²	42	53%	0.525	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-28.2	-179.5	-62.3	-72.9	0	0	0	112.8	Q324 N439	Q324-Y441 HydrophobicContact CG-CD1 4.5Å; Q324-Y441 VanDerWaalsContact NE2-CA 3.35Å; Q324-Y441 PolarHBondContact NE2-O 3.2Å; Q324-Y441 VanDerWaalsContact NE2-O 3.08Å; N439-Y441 PolarHBondContact O-N 3.08Å; N439-Y441 PolarHBondContact OD1-N 2.63Å; N439-Y441 VanDerWaalsContact OD1-N 3.13Å
442	A	79.6	Confident	82.9	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.008	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-11.9	179.7	0	0	0	0	0	112.8	R214 F217 E437 N439 W444	R214-A442 WeakPolarHBondContact CD-O 2.93Å; R214-A442 HydrophobicContact CG-CB 3.88Å; R214-A442 PolarHBondContact NE-O 2.95Å; R214-A442 PolarHBondContact NH1-O 3.29Å; F217-A442 HydrophobicContact CB-CB 4.27Å; E437-A442 HydrophobicContact CG-CB 4.27Å; N439-A442 HydrophobicContact CB-CB 4.22Å; N439-A442 PolarHBondContact O-N 3.36Å; A442-W444 PolarHBondContact O-N 2.81Å; A442-W444 VanDerWaalsContact O-N 3.1Å
443	A	84.4	Confident	82.4	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.			trans	-64.6	-20.4	-169.8	0	0	0	0	0	114.7	R433 D434 E437 N439	R433-A443 HydrophobicContact CG-CB 3.79Å; D434-A443 WeakPolarHBondContact CB-O 3.44Å; D434-A443 PolarHBondContact N-O 2.87Å; E437-A443 HydrophobicContact CB-CB 4.2Å; E437-A443 HydrophobicContact CG-CB 4.24Å; N439-A443 PolarHBondContact O-N 3.3Å; N439-A443 VanDerWaalsContact O-N 3.14Å
444	W	88.8	Confident	81.4	Confident	4 Å²	4	48 Å²	48	2%	0.015	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	135.7	-173.1	-58.3	94.3	0	0	0	113.2	I309 F316 F321 I329 L395 L431 C432 R433 A442	I309-W444 HydrophobicContact CD1-CH2 4.06Å; F316-W444 HydrophobicContact CD2-CZ2 4.4Å; F316-W444 HydrophobicContact CE2-CH2 4.32Å; F316-W444 AromaticContact CE2-CZ2 3.65Å; F316-W444 HydrophobicContact CE2-CZ2 3.65Å; F316-W444 HydrophobicContact CZ-CZ2 4.27Å; F321-W444 HydrophobicContact CD2-CD2 4.46Å; F321-W444 AromaticContact CD2-CE2 3.81Å; F321-W444 AromaticContact CD2-CZ2 3.9Å; F321-W444 HydrophobicContact CD2-CZ2 3.9Å; F321-W444 AromaticContact CD2-NE1 3.88Å; F321-W444 AromaticContact CE2-CD2 3.57Å; F321-W444 HydrophobicContact CE2-CD2 3.57Å; F321-W444 AromaticContact CE2-CE2 3.35Å; F321-W444 HydrophobicContact CE2-CE3 4Å; F321-W444 HydrophobicContact CE2-CG 4.05Å; F321-W444 HydrophobicContact CE2-CH2 4.07Å; F321-W444 AromaticContact CE2-CZ2 3.64Å; F321-W444 HydrophobicContact CE2-CZ2 3.64Å; F321-W444 HydrophobicContact CE2-CZ3 4.23Å; F321-W444 AromaticContact CE2-NE1 3.67Å; F321-W444 HydrophobicContact CZ-CD2 4.18Å; F321-W444 HydrophobicContact CZ-CE3 4.15Å; F321-W444 HydrophobicContact CZ-CH2 4.24Å; F321-W444 HydrophobicContact CZ-CZ2 4.27Å; F321-W444 HydrophobicContact CZ-CZ3 4.17Å; I329-W444 HydrophobicContact CD1-CB 4.21Å; I329-W444 HydrophobicContact CD1-CG 4.4Å; L395-W444 HydrophobicContact CB-CZ3 4.22Å; L395-W444 HydrophobicContact CD1-CH2 3.36Å; L395-W444 HydrophobicContact CD1-CZ2 4.29Å; L395-W444 HydrophobicContact CD1-CZ3 3.74Å; L395-W444 HydrophobicContact CG-CH2 3.94Å; L395-W444 HydrophobicContact CG-CZ3 3.93Å; L431-W444 HydrophobicContact CB-CE3 4.06Å; C432-W444 WeakPolarHBondContact O-CA 3.23Å; R433-W444 HydrophobicContact CB-CD2 4.3Å; R433-W444 HydrophobicContact CB-CE3 3.95Å; R433-W444 HydrophobicContact CB-CH2 3.89Å; R433-W444 HydrophobicContact CB-CZ2 4.23Å; R433-W444 HydrophobicContact CB-CZ3 3.76Å; R433-W444 HydrophobicContact CG-CH2 4.39Å; R433-W444 HydrophobicContact CG-CZ2 4.25Å; A442-W444 PolarHBondContact O-N 2.81Å; A442-W444 VanDerWaalsContact O-N 3.1Å
445	R	89.2	Confident	80.3	Confident	64 Å²	64	52.3 Å²	52.3	24%	0.242	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	150.4	171.2	-83	174.1	-171.2	135.1	7.7	111.2	R214 W348 Y350 L431 C432 D434 L447	R214-R445 VanDerWaalsContact NH1-CG 3.3Å; W348-R445 CarbonylContact O-C 3.28Å; W348-R445 WeakPolarHBondContact O-CA 3.31Å; Y350-R445 HydrophobicContact CD2-CB 3.8Å; Y350-R445 HydrophobicContact CE2-CB 3.17Å; Y350-R445 HydrophobicContact CE2-CG 4.2Å; L431-R445 WeakPolarHBondContact CA-O 3.23Å; C432-R445 PolarHBondContact N-O 3.35Å; C432-R445 PolarHBondContact O-N 3.25Å; D434-R445 IonicContact OD2-CZ 3.98Å; D434-R445 IonicContact OD2-NH1 3.19Å; D434-R445 PolarHBondContact OD2-NH1 2.98Å; D434-R445 IonicContact OD2-NH2 3.91Å; R445-L447 PolarHBondContact O-N 2.92Å
446	L	90.6	Very high	79.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	118.3	176.7	-172.9	72.9	0	0	0	110.6	I333 W348 Y350 T353 W429 L431 I449	I333-L446 HydrophobicContact CD1-CB 4.34Å; I333-L446 HydrophobicContact CG2-CD2 4.16Å; W348-L446 PolarHBondContact O-N 2.81Å; Y350-L446 WeakPolarHBondContact CD2-O 3.37Å; Y350-L446 PolarHBondContact N-O 3.05Å; T353-L446 HydrophobicContact CG2-CD2 4.32Å; T353-L446 HydrophobicContact CG2-CG 4.42Å; T353-L446 PolarHBondContact OG1-O 3.46Å; W429-L446 HydrophobicContact CB-CD1 3.86Å; W429-L446 HydrophobicContact CD2-CD1 3.81Å; W429-L446 HydrophobicContact CE3-CD1 3.87Å; W429-L446 HydrophobicContact CG-CD1 3.84Å; L431-L446 HydrophobicContact CD2-CB 4.45Å; L431-L446 HydrophobicContact CD2-CD1 3.96Å; L446-I449 HydrophobicContact CD2-CB 4.24Å; L446-I449 HydrophobicContact CD2-CG2 4.45Å
447	L	89.1	Confident	77.5	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	-42.9	178.1	179.8	66	0	0	0	112.4	W246 W250 Y350 T353 V394 A430 R445	W246-L447 HydrophobicContact CD2-CD1 3.94Å; W246-L447 HydrophobicContact CG-CD1 4.1Å; W246-L447 HydrophobicContact CZ2-CB 4.25Å; W246-L447 HydrophobicContact CZ2-CD1 3.69Å; W246-L447 HydrophobicContact CZ2-CD2 3.96Å; W246-L447 HydrophobicContact CZ2-CG 4.16Å; W250-L447 HydrophobicContact CB-CD2 4.1Å; W250-L447 HydrophobicContact CD2-CD2 3.81Å; W250-L447 HydrophobicContact CE3-CD2 3.91Å; W250-L447 HydrophobicContact CG-CD2 3.88Å; W250-L447 HydrophobicContact CG-CG 4.42Å; Y350-L447 HydrophobicContact CD2-CB 4.23Å; Y350-L447 HydrophobicContact CD2-CD1 4.08Å; Y350-L447 HydrophobicContact CG-CD1 4.38Å; T353-L447 VanDerWaalsContact OG1-C 3.28Å; T353-L447 PolarHBondContact OG1-O 3.06Å; V394-L447 HydrophobicContact CG1-CD2 4.42Å; V394-L447 HydrophobicContact CG2-CD2 4.21Å; A430-L447 HydrophobicContact CB-CB 4.33Å; A430-L447 WeakPolarHBondContact O-CB 3.21Å; A430-L447 PolarHBondContact O-N 3.18Å; R445-L447 PolarHBondContact O-N 2.92Å
448	D	87.5	Confident	75.5	Confident	16 Å²	16	59.5 Å²	59.5	9%	0.086	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	149.1	-180	-162.6	11.3	0	0	0	109.8	W250 K254 A430	W250-D448 HydrophobicContact CZ2-CB 4.23Å; W250-D448 VanDerWaalsContact NE1-CB 3.32Å; W250-D448 PolarHBondContact NE1-OD2 3.25Å; K254-D448 IonicContact NZ-OD2 3.89Å; A430-D448 HydrophobicContact CB-CB 4.13Å; A430-D448 PolarHBondContact N-O 3.15Å; A430-D448 PolarHBondContact O-N 3.34Å
449	I	88.6	Confident	75.8	Confident	29 Å²	29	55.9 Å²	55.9	15%	0.149	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	125.7	178.8	178.8	164.6	0	0	0	108.6	M337 T353 L357 Y427 W429 L446	M337-I449 HydrophobicContact CE-CD1 3.77Å; M337-I449 HydrophobicContact SD-CD1 3.66Å; T353-I449 HydrophobicContact CG2-CG2 4.29Å; L357-I449 HydrophobicContact CD1-CG2 4.16Å; L357-I449 HydrophobicContact CD2-CG2 3.94Å; L357-I449 HydrophobicContact CG-CG2 4.38Å; Y427-I449 HydrophobicContact CD1-CD1 4.2Å; Y427-I449 HydrophobicContact CD1-CG1 4.38Å; Y427-I449 HydrophobicContact CE1-CD1 4.27Å; W429-I449 HydrophobicContact CZ2-CD1 4.07Å; L446-I449 HydrophobicContact CD2-CB 4.24Å; L446-I449 HydrophobicContact CD2-CG2 4.45Å
450	S	86.4	Confident	75.7	Confident	57 Å²	57	57.1 Å²	57.1	40%	0.399	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	137.1	167.9	-170.4	0	0	0	0	108.4	V428	V428-S450 PolarHBondContact N-O 2.96Å; V428-S450 PolarHBondContact O-N 3.38Å
451	A	85.5	Confident	75.7	Confident	56 Å²	56	58.2 Å²	58.2	46%	0.463	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	139.8	178.2	0	0	0	0	0	108.9	M426 Y427	M426-A451 WeakPolarHBondContact O-CA 3.35Å; Y427-A451 HydrophobicContact CD1-CB 3.64Å; Y427-A451 HydrophobicContact CE1-CB 3.48Å; Y427-A451 VanDerWaalsContact CE1-CB 3.48Å
452	S	79.7	Confident	75.7	Confident	33 Å²	33	53.8 Å²	53.8	23%	0.231	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	138.5	169.8	-172	0	0	0	0	109.6	M425 M426	M425-S452 WeakPolarHBondContact CA-O 3.46Å; M426-S452 PolarHBondContact N-O 3.46Å; M426-S452 PolarHBondContact O-N 3.42Å
453	S	76.9	Confident	75.5	Confident	71 Å²	71	57.1 Å²	57.1	50%	0.497	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	127.5	179	60.6	0	0	0	0	111.2	M425	M425-S453 WeakPolarHBondContact SD-CA 3.38Å; M425-S453 WeakPolarHBondContact SD-CB 3.26Å
454	T	67	Low	74.9	Confident	27 Å²	27	60.9 Å²	60.9	17%	0.166	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	118.8	166.1	60.6	0	0	0	0	108.4	E272 R424 M426 Q456	E272-T454 HydrophobicContact CG-CG2 3.7Å; R424-T454 WeakPolarHBondContact CB-OG1 3.29Å; R424-T454 WeakPolarHBondContact CG-OG1 3.43Å; R424-T454 PolarHBondContact N-O 3.48Å; R424-T454 PolarHBondContact O-N 2.97Å; R424-T454 VanDerWaalsContact O-O 3.11Å; R424-T454 PolarHBondContact O-OG1 2.91Å; M426-T454 HydrophobicContact CG-CG2 4.4Å; T454-Q456 PolarHBondContact O-N 2.93Å
455	E	60.1	Low	73.9	Confident	123 Å²	123	64.9 Å²	64.9	58%	0.575	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	116.7	173.1	-60.4	-156.6	161.1	0	0	108.1	K421 I457	K421-E455 IonicContact NZ-OE1 2.79Å; K421-E455 PolarHBondContact NZ-OE1 3.49Å; K421-E455 IonicContact NZ-OE2 2.88Å; K421-E455 PolarHBondContact NZ-OE2 2.93Å; E455-I457 PolarHBondContact O-N 2.73Å; E455-I457 VanDerWaalsContact O-N 3.11Å
456	Q	52.5	Low	72.7	Confident	63 Å²	63	65 Å²	65	29%	0.294	37%	0.368	S	S	.	.			trans	-70.8	107.4	168.9	-69.5	-175.6	-44.2	0	0	107.6	R424 T454 L458	R424-Q456 HydrophobicContact CB-CG 3.89Å; T454-Q456 PolarHBondContact O-N 2.93Å; Q456-L458 VanDerWaalsContact C-N 3.32Å; Q456-L458 PolarHBondContact O-N 3.15Å; Q456-L458 VanDerWaalsContact O-N 3.08Å
457	I	44.5	Very low	71.2	Confident	156 Å²	156	70.4 Å²	70.4	80%	0.8	40%	0.398	S	S	*	.			trans	-74.8	96	164.5	-53.3	171.1	0	0	0	105.2	E455	E455-I457 PolarHBondContact O-N 2.73Å; E455-I457 VanDerWaalsContact O-N 3.11Å
458	L	37	Very low	69.6	Low	212 Å²	212	76.6 Å²	76.6	100%	1.11	43%	0.433	S	S	*	.			trans	-70.2	0	172	-86.7	165	0	0	0	111.5	Q456	Q456-L458 VanDerWaalsContact C-N 3.32Å; Q456-L458 PolarHBondContact O-N 3.15Å; Q456-L458 VanDerWaalsContact O-N 3.08Å

Retrieved 458 of 458 residues in 1020.7 ms (Link to these results)

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