A0A077Z6I3_TRITR Loading...

U2 snRNP associated SURP motif containing

AlphaFold DB , UniProt , Accession A0A077Z6I3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 726 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.4	Very low	34.6	Very low	199 Å²	199	150.8 Å²	150.8	98%	0.98	70%	0.704	S	S	*	*				0	139.1	0	-79.9	-168.8	174.6	0	0	108.7	Y64	M1-Y64 HydrophobicContact CE-CE1 4.38Å
2	D	33	Very low	34.4	Very low	116 Å²	116	147.1 Å²	147.1	62%	0.62	70%	0.699	S	S	*	*			trans	-73.7	122.3	179.3	-169.9	-8.8	0	0	0	110.3	R4 L5	D2-R4 PolarHBondContact O-N 3.27Å; D2-L5 PolarHBondContact O-N 3.01Å
3	E	35.5	Very low	34.3	Very low	170 Å²	170	146.6 Å²	146.6	79%	0.794	70%	0.703	S	S	*	*	H	α-helix	trans	-56.2	-18.7	-172.5	-75.6	-166.9	146.7	0	0	114	L5 L6	E3-L5 VanDerWaalsContact C-N 3.32Å; E3-L5 PolarHBondContact O-N 2.99Å; E3-L6 PolarHBondContact O-N 3.43Å
4	R	38.5	Very low	34.3	Very low	211 Å²	211	146.5 Å²	146.5	80%	0.796	70%	0.702	S	S	*	*	H	α-helix	trans	-65.4	-28.7	-177.3	-70.5	-178.5	177.3	-175.2	1	114.2	D2	D2-R4 PolarHBondContact O-N 3.27Å
5	L	34.4	Very low	33.9	Very low	136 Å²	136	146.7 Å²	146.7	71%	0.712	71%	0.707	S	S	*	*	H	α-helix	trans	-77.1	-34.3	179.8	-89	158.1	0	0	0	112.4	D2 E3 G7 K8	D2-L5 PolarHBondContact O-N 3.01Å; E3-L5 VanDerWaalsContact C-N 3.32Å; E3-L5 PolarHBondContact O-N 2.99Å; L5-G7 VanDerWaalsContact C-N 3.32Å; L5-G7 PolarHBondContact O-N 3.19Å; L5-K8 PolarHBondContact O-N 3.38Å
6	L	33	Very low	33.6	Very low	89 Å²	89	147.4 Å²	147.4	47%	0.466	72%	0.715	S	S	.	*	H	α-helix	trans	-66.3	-32.6	177.9	-103.6	139.3	0	0	0	112.7	E3 K8	E3-L6 PolarHBondContact O-N 3.43Å; L6-K8 VanDerWaalsContact C-N 3.25Å; L6-K8 PolarHBondContact O-N 3.22Å
7	G	34	Very low	33.3	Very low	42 Å²	42	150.4 Å²	150.4	43%	0.433	73%	0.725	S	S	.	*	H	α-helix	trans	-66.2	-22.3	177.5	0	0	0	0	0	114.6	L5	L5-G7 VanDerWaalsContact C-N 3.32Å; L5-G7 PolarHBondContact O-N 3.19Å
8	K	35.8	Very low	33.2	Very low	158 Å²	158	151.2 Å²	151.2	69%	0.687	73%	0.731	S	S	*	*	H	α-helix	trans	-77.2	-33.2	-177.4	-75.3	-174.9	176.2	180	0	113.2	L5 L6	L5-K8 PolarHBondContact O-N 3.38Å; L6-K8 VanDerWaalsContact C-N 3.25Å; L6-K8 PolarHBondContact O-N 3.22Å
9	L	31.8	Very low	33	Very low	131 Å²	131	149.1 Å²	149.1	69%	0.686	73%	0.733	S	S	*	*	H	α-helix	trans	-73.9	-28.3	-179	-98.7	152.5	0	0	0	113.5	T12	L9-T12 PolarHBondContact O-OG1 3.49Å
10	Y	33.7	Very low	32.9	Very low	196 Å²	196	150.3 Å²	150.3	77%	0.769	74%	0.737	S	S	*	*	H	α-helix	trans	-83.7	-17	-179.3	-84	-79.2	0	0	0	114.6
11	R	33.8	Very low	32.9	Very low	211 Å²	211	154.3 Å²	154.3	80%	0.796	75%	0.745	S	S	*	*	H	α-helix	trans	-81.2	-22.6	179	-80.6	-169.6	-170.8	-178.9	3.5	114.3
12	T	32	Very low	32.8	Very low	106 Å²	106	149 Å²	149	65%	0.65	73%	0.726	S	S	*	*	S	Bend	trans	-85.7	-12.9	-168.9	40.2	0	0	0	0	115.2	L9	L9-T12 PolarHBondContact O-OG1 3.49Å
13	N	33.4	Very low	32.8	Very low	141 Å²	141	152.7 Å²	152.7	75%	0.754	74%	0.74	S	S	*	*	S	Bend	trans	-111.2	-5.4	-167.2	-77.6	2	0	0	0	117.8
14	E	33.7	Very low	33.1	Very low	145 Å²	145	150.3 Å²	150.3	68%	0.678	74%	0.743	S	S	*	*	S	Bend	trans	-125.6	4.1	-171.8	-73.6	-165.5	168.7	0	0	117.3
15	L	28.9	Very low	33.2	Very low	150 Å²	150	142.3 Å²	142.3	79%	0.785	72%	0.719	S	S	*	*	S	Bend	trans	-95.9	2.2	-170.2	-92.9	165.5	0	0	0	117.9
16	N	28.1	Very low	33.8	Very low	157 Å²	157	140.5 Å²	140.5	84%	0.84	72%	0.715	S	S	*	*	S	Bend	trans	-115.7	16.7	-167.4	-80.8	-4.7	0	0	0	117.7
17	F	29.9	Very low	34.5	Very low	199 Å²	199	140.1 Å²	140.1	87%	0.873	72%	0.72	S	S	*	*	S	Bend	trans	-136.1	134.5	174	-106.1	-99.9	0	0	0	110.4
18	I	31.6	Very low	34.8	Very low	165 Å²	165	140.8 Å²	140.8	85%	0.846	72%	0.716	S	S	*	*			trans	92	61.1	179.6	-39.8	155.4	0	0	0	114.1
19	S	28.4	Very low	35.3	Very low	110 Å²	110	137.3 Å²	137.3	77%	0.769	71%	0.711	S	S	*	*			trans	-137.3	53.7	156.5	72.9	0	0	0	0	111.2
20	E	31.2	Very low	36.2	Very low	174 Å²	174	140.1 Å²	140.1	81%	0.813	71%	0.713	S	S	*	*	S	Bend	trans	-167.2	131.3	168.4	-109.7	158.6	-138.7	0	0	109.5
21	R	32.8	Very low	36.8	Very low	235 Å²	235	133.6 Å²	133.6	89%	0.887	70%	0.699	S	S	*	*			trans	78.5	94.4	171.6	-54.5	174.8	-177.3	-164.6	-1.4	116.9
22	S	35.8	Very low	37.4	Very low	86 Å²	86	127 Å²	127	60%	0.601	68%	0.682	S	S	*	*				158.5	82.8	107.8	69.8	0	0	0	0	109.9
23	E	33.3	Very low	38.2	Very low	194 Å²	194	124.9 Å²	124.9	91%	0.907	68%	0.675	S	S	*	*			trans	-65	124.8	154.4	-62.9	173.4	164.8	0	0	107.5
24	S	40.6	Very low	39.1	Very low	121 Å²	121	120.6 Å²	120.6	85%	0.846	66%	0.656	S	S	*	*			trans	157.4	6.9	153.3	52.2	0	0	0	0	115.9
25	S	40.7	Very low	39.7	Very low	42 Å²	42	119.8 Å²	119.8	29%	0.294	65%	0.651	S	S	.	*			trans	-129.1	126.4	171.6	176.6	0	0	0	0	113.5	S27 V28 S29	S25-S27 PolarHBondContact O-N 3.48Å; S25-S27 VanDerWaalsContact O-N 3.11Å; S25-S27 PolarHBondContact OG-N 3.06Å; S25-S27 PolarHBondContact OG-OG 3.49Å; S25-V28 PolarHBondContact O-N 2.93Å; S25-S29 PolarHBondContact O-N 2.93Å
26	P	47.7	Very low	40.5	Very low	98 Å²	98	116.8 Å²	116.8	64%	0.636	64%	0.635	S	S	*	*	H	α-helix	trans	-55.7	-25.2	172.2	-23.6	32.4	0	0	0	113.8	R30	P26-R30 PolarHBondContact O-N 3.36Å
27	S	46.1	Very low	41.7	Very low	81 Å²	81	116.7 Å²	116.7	57%	0.566	62%	0.624	S	S	*	*	H	α-helix	trans	-71.9	-34.9	176	59.2	0	0	0	0	112.1	S25 R30 A31	S25-S27 PolarHBondContact O-N 3.48Å; S25-S27 VanDerWaalsContact O-N 3.11Å; S25-S27 PolarHBondContact OG-N 3.06Å; S25-S27 PolarHBondContact OG-OG 3.49Å; S27-R30 PolarHBondContact O-N 3.44Å; S27-A31 WeakPolarHBondContact O-CB 3.43Å; S27-A31 PolarHBondContact O-N 2.98Å
28	V	41.9	Very low	42.5	Very low	57 Å²	57	115.3 Å²	115.3	35%	0.345	61%	0.613	S	S	.	*	H	α-helix	trans	-71.4	-44.7	177	179.5	0	0	0	0	110.4	S25 R30 A31 V32	S25-V28 PolarHBondContact O-N 2.93Å; V28-R30 VanDerWaalsContact C-N 3.26Å; V28-R30 PolarHBondContact O-N 3.4Å; V28-A31 WeakPolarHBondContact O-CB 3.13Å; V28-A31 PolarHBondContact O-N 2.87Å; V28-V32 HydrophobicContact CG1-CG2 4.16Å; V28-V32 WeakPolarHBondContact O-CG2 3.37Å; V28-V32 PolarHBondContact O-N 3.34Å
29	S	46.5	Very low	43.1	Very low	84 Å²	84	112 Å²	112	59%	0.587	59%	0.591	S	S	*	*	H	α-helix	trans	-59.6	-37.2	175.7	-65.9	0	0	0	0	112.4	S25 A33	S25-S29 PolarHBondContact O-N 2.93Å; S29-A33 WeakPolarHBondContact O-CB 3.21Å; S29-A33 PolarHBondContact O-N 3.45Å
30	R	50.9	Low	44	Very low	191 Å²	191	113.4 Å²	113.4	72%	0.721	59%	0.585	S	S	*	*	H	α-helix	trans	-68.6	-39	174.8	-125.5	-178.4	-76.6	178.4	-5.9	112	P26 S27 V28 S34	P26-R30 PolarHBondContact O-N 3.36Å; S27-R30 PolarHBondContact O-N 3.44Å; V28-R30 VanDerWaalsContact C-N 3.26Å; V28-R30 PolarHBondContact O-N 3.4Å; R30-S34 VanDerWaalsContact O-CB 3.26Å; R30-S34 WeakPolarHBondContact O-CB 3.45Å; R30-S34 PolarHBondContact O-N 3.01Å
31	A	46.1	Very low	44.6	Very low	59 Å²	59	110.1 Å²	110.1	49%	0.488	57%	0.57	S	S	.	*	H	α-helix	trans	-66	-44.3	175.7	0	0	0	0	0	111.8	S27 V28 S34 F35	S27-A31 WeakPolarHBondContact O-CB 3.43Å; S27-A31 PolarHBondContact O-N 2.98Å; V28-A31 WeakPolarHBondContact O-CB 3.13Å; V28-A31 PolarHBondContact O-N 2.87Å; A31-S34 PolarHBondContact O-N 3.37Å; A31-F35 VanDerWaalsContact O-CB 3.3Å; A31-F35 WeakPolarHBondContact O-CB 3.37Å; A31-F35 PolarHBondContact O-N 3.36Å
32	V	44.9	Very low	45.1	Very low	73 Å²	73	108.5 Å²	108.5	44%	0.442	56%	0.564	S	S	.	*	H	α-helix	trans	-65.6	-42.7	176.1	174.8	0	0	0	0	110.9	V28 F35 N36	V28-V32 HydrophobicContact CG1-CG2 4.16Å; V28-V32 WeakPolarHBondContact O-CG2 3.37Å; V28-V32 PolarHBondContact O-N 3.34Å; V32-F35 PolarHBondContact O-N 2.93Å; V32-N36 WeakPolarHBondContact O-CB 3.48Å; V32-N36 PolarHBondContact O-N 3.27Å
33	A	49.4	Very low	45.3	Very low	60 Å²	60	109.1 Å²	109.1	50%	0.496	56%	0.557	S	S	.	*	H	α-helix	trans	-63.7	-41.7	174.7	0	0	0	0	0	111.9	S29 F35 N36 Y37	S29-A33 WeakPolarHBondContact O-CB 3.21Å; S29-A33 PolarHBondContact O-N 3.45Å; A33-F35 VanDerWaalsContact C-N 3.34Å; A33-N36 PolarHBondContact O-N 3.42Å; A33-Y37 WeakPolarHBondContact O-CB 3.42Å; A33-Y37 PolarHBondContact O-N 2.85Å
34	S	51.9	Low	45.8	Very low	51 Å²	51	108.7 Å²	108.7	36%	0.357	55%	0.552	S	S	.	*	H	α-helix	trans	-65.5	-38.7	175.2	-165.4	0	0	0	0	111.6	R30 A31 R38	R30-S34 VanDerWaalsContact O-CB 3.26Å; R30-S34 WeakPolarHBondContact O-CB 3.45Å; R30-S34 PolarHBondContact O-N 3.01Å; A31-S34 PolarHBondContact O-N 3.37Å; S34-R38 VanDerWaalsContact O-CB 3.3Å; S34-R38 WeakPolarHBondContact O-CB 3.44Å; S34-R38 WeakPolarHBondContact O-CG 3.41Å; S34-R38 PolarHBondContact O-N 3.34Å
35	F	47.9	Very low	45.8	Very low	129 Å²	129	112 Å²	112	57%	0.566	55%	0.546	S	S	*	.	H	α-helix	trans	-66	-48.8	175.2	-173.2	-91.5	0	0	0	111.3	A31 V32 A33 Y37 R38 Y39	A31-F35 VanDerWaalsContact O-CB 3.3Å; A31-F35 WeakPolarHBondContact O-CB 3.37Å; A31-F35 PolarHBondContact O-N 3.36Å; V32-F35 PolarHBondContact O-N 2.93Å; A33-F35 VanDerWaalsContact C-N 3.34Å; F35-Y37 VanDerWaalsContact C-N 3.33Å; F35-Y37 PolarHBondContact O-N 2.99Å; F35-R38 CarbonylContact O-C 3.56Å; F35-R38 PolarHBondContact O-N 2.83Å; F35-Y39 VanDerWaalsContact O-CB 3.25Å; F35-Y39 WeakPolarHBondContact O-CB 3.46Å; F35-Y39 PolarHBondContact O-N 2.99Å
36	N	45.3	Very low	45.8	Very low	87 Å²	87	120.5 Å²	120.5	47%	0.465	57%	0.572	S	S	.	*	H	α-helix	trans	-61.7	-40.2	176.4	-79.6	-24.1	0	0	0	111.9	V32 A33 Y39 Q40	V32-N36 WeakPolarHBondContact O-CB 3.48Å; V32-N36 PolarHBondContact O-N 3.27Å; A33-N36 PolarHBondContact O-N 3.42Å; N36-Y39 PolarHBondContact O-N 3.2Å; N36-Q40 WeakPolarHBondContact O-CB 3.49Å; N36-Q40 WeakPolarHBondContact O-CG 3.45Å; N36-Q40 PolarHBondContact O-N 3.11Å
37	Y	52.6	Low	45.7	Very low	155 Å²	155	123 Å²	123	61%	0.608	57%	0.573	S	S	*	*	H	α-helix	trans	-63.1	-47.9	174	-175.7	-94.1	0	0	0	111.2	A33 F35 Y39 Q40 H41	A33-Y37 WeakPolarHBondContact O-CB 3.42Å; A33-Y37 PolarHBondContact O-N 2.85Å; F35-Y37 VanDerWaalsContact C-N 3.33Å; F35-Y37 PolarHBondContact O-N 2.99Å; Y37-Y39 VanDerWaalsContact C-N 3.29Å; Y37-Y39 PolarHBondContact O-N 3.33Å; Y37-Q40 PolarHBondContact O-N 2.92Å; Y37-H41 WeakPolarHBondContact O-CB 3.09Å; Y37-H41 PolarHBondContact O-N 3.29Å
38	R	46.9	Very low	45.7	Very low	170 Å²	170	122.9 Å²	122.9	64%	0.642	57%	0.568	S	S	*	*	H	α-helix	trans	-62.8	-35.6	175.4	-75	173.7	-178.1	-171.1	1.2	112	S34 F35 H41 R42	S34-R38 VanDerWaalsContact O-CB 3.3Å; S34-R38 WeakPolarHBondContact O-CB 3.44Å; S34-R38 WeakPolarHBondContact O-CG 3.41Å; S34-R38 PolarHBondContact O-N 3.34Å; F35-R38 CarbonylContact O-C 3.56Å; F35-R38 PolarHBondContact O-N 2.83Å; R38-H41 PolarHBondContact O-N 2.89Å; R38-R42 WeakPolarHBondContact O-CB 3.44Å; R38-R42 WeakPolarHBondContact O-CG 3.43Å; R38-R42 PolarHBondContact O-N 3.11Å
39	Y	45.1	Very low	46	Very low	95 Å²	95	123.5 Å²	123.5	37%	0.373	57%	0.572	S	S	.	*	H	α-helix	trans	-69.2	-48.1	177.8	-171.9	-93.2	0	0	0	111.1	F35 N36 Y37 H41 R42 Q43	F35-Y39 VanDerWaalsContact O-CB 3.25Å; F35-Y39 WeakPolarHBondContact O-CB 3.46Å; F35-Y39 PolarHBondContact O-N 2.99Å; N36-Y39 PolarHBondContact O-N 3.2Å; Y37-Y39 VanDerWaalsContact C-N 3.29Å; Y37-Y39 PolarHBondContact O-N 3.33Å; Y39-H41 VanDerWaalsContact C-N 3.28Å; Y39-H41 PolarHBondContact O-N 3.34Å; Y39-R42 PolarHBondContact O-N 3.42Å; Y39-R42 VanDerWaalsContact O-N 3.11Å; Y39-Q43 HydrophobicContact CD1-CG 4.03Å; Y39-Q43 HydrophobicContact CE1-CG 3.69Å; Y39-Q43 WeakPolarHBondContact O-CG 3.37Å; Y39-Q43 PolarHBondContact O-N 3.08Å; Y39-Q43 PolarHBondContact OH-NE2 2.92Å; Y39-Q43 VanDerWaalsContact OH-NE2 3.15Å
40	Q	45.4	Very low	46.2	Very low	139 Å²	139	127.8 Å²	127.8	65%	0.65	58%	0.583	S	S	*	*	H	α-helix	trans	-59.5	-39.1	173.3	-76.9	-169.1	-4.2	0	0	112	N36 Y37 Q43 K44	N36-Q40 WeakPolarHBondContact O-CB 3.49Å; N36-Q40 WeakPolarHBondContact O-CG 3.45Å; N36-Q40 PolarHBondContact O-N 3.11Å; Y37-Q40 PolarHBondContact O-N 2.92Å; Q40-Q43 PolarHBondContact O-N 3.23Å; Q40-K44 PolarHBondContact O-N 3.28Å; Q40-K44 VanDerWaalsContact O-N 3.1Å
41	H	45.3	Very low	46.3	Very low	105 Å²	105	123.1 Å²	123.1	49%	0.486	57%	0.572	S	S	.	*	H	α-helix	trans	-69.9	-32	176.6	-130.9	-74.4	0	0	0	112.8	Y37 R38 Y39	Y37-H41 WeakPolarHBondContact O-CB 3.09Å; Y37-H41 PolarHBondContact O-N 3.29Å; R38-H41 PolarHBondContact O-N 2.89Å; Y39-H41 VanDerWaalsContact C-N 3.28Å; Y39-H41 PolarHBondContact O-N 3.34Å
42	R	43.4	Very low	46.4	Very low	201 Å²	201	123.5 Å²	123.5	76%	0.758	57%	0.566	S	S	*	*	H	α-helix	trans	-70.8	-39.8	171.6	-83.2	-175.2	-177.3	-170	1.6	112	R38 Y39 K44 R45	R38-R42 WeakPolarHBondContact O-CB 3.44Å; R38-R42 WeakPolarHBondContact O-CG 3.43Å; R38-R42 PolarHBondContact O-N 3.11Å; Y39-R42 PolarHBondContact O-N 3.42Å; Y39-R42 VanDerWaalsContact O-N 3.11Å; R42-K44 VanDerWaalsContact C-N 3.3Å; R42-K44 PolarHBondContact O-N 2.62Å; R42-R45 CarbonylContact O-C 3.43Å; R42-R45 WeakPolarHBondContact O-CA 3.38Å; R42-R45 PolarHBondContact O-N 3.37Å
43	Q	39.5	Very low	46.8	Very low	99 Å²	99	123.9 Å²	123.9	46%	0.463	57%	0.57	S	S	.	*	H	α-helix	trans	-63.8	-34.1	176.1	-73.2	-64.8	-24.9	0	0	112.4	Y39 Q40 R45	Y39-Q43 HydrophobicContact CD1-CG 4.03Å; Y39-Q43 HydrophobicContact CE1-CG 3.69Å; Y39-Q43 WeakPolarHBondContact O-CG 3.37Å; Y39-Q43 PolarHBondContact O-N 3.08Å; Y39-Q43 PolarHBondContact OH-NE2 2.92Å; Y39-Q43 VanDerWaalsContact OH-NE2 3.15Å; Q40-Q43 PolarHBondContact O-N 3.23Å; Q43-R45 PolarHBondContact O-N 3.29Å
44	K	44.1	Very low	46.8	Very low	185 Å²	185	129.8 Å²	129.8	80%	0.804	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-18.8	171.6	-81.6	-175.6	176.2	179	0	113.6	Q40 R42 R46	Q40-K44 PolarHBondContact O-N 3.28Å; Q40-K44 VanDerWaalsContact O-N 3.1Å; R42-K44 VanDerWaalsContact C-N 3.3Å; R42-K44 PolarHBondContact O-N 2.62Å; K44-R46 PolarHBondContact O-N 2.77Å
45	R	40.9	Very low	46.3	Very low	192 Å²	192	132 Å²	132	73%	0.725	60%	0.597	S	S	*	*			trans	-96.4	66.2	169.9	-70.1	-170.3	169.8	-163.1	-2.7	109.9	R42 Q43 K47	R42-R45 CarbonylContact O-C 3.43Å; R42-R45 WeakPolarHBondContact O-CA 3.38Å; R42-R45 PolarHBondContact O-N 3.37Å; Q43-R45 PolarHBondContact O-N 3.29Å; R45-K47 VanDerWaalsContact C-N 3.27Å; R45-K47 PolarHBondContact O-N 3.4Å
46	R	39.5	Very low	46.6	Very low	220 Å²	220	129 Å²	129	83%	0.83	59%	0.589	S	S	*	*			trans	-62.3	95.6	160.8	-83	-176.7	175.1	179.8	-0.8	107.5	K44 T48	K44-R46 PolarHBondContact O-N 2.77Å; R46-T48 PolarHBondContact O-N 3.47Å
47	K	45.9	Very low	46.8	Very low	150 Å²	150	126.6 Å²	126.6	65%	0.652	58%	0.576	S	S	*	*			trans	-69.3	119.2	172.5	-73.9	-167.4	176.7	-169.2	0	107.8	R45 D51	R45-K47 VanDerWaalsContact C-N 3.27Å; R45-K47 PolarHBondContact O-N 3.4Å; K47-D51 WeakPolarHBondContact CA-OD2 3.22Å; K47-D51 HydrophobicContact CB-CB 3.95Å; K47-D51 HydrophobicContact CD-CB 4.3Å; K47-D51 HydrophobicContact CG-CB 4.14Å
48	T	45.7	Very low	46.6	Very low	78 Å²	78	123.6 Å²	123.6	48%	0.479	57%	0.566	S	S	.	*			trans	-71.7	164.1	171.4	59.4	0	0	0	0	108.8	R46 E50 D51	R46-T48 PolarHBondContact O-N 3.47Å; T48-E50 PolarHBondContact O-N 3.29Å; T48-E50 VanDerWaalsContact O-N 3.08Å; T48-D51 PolarHBondContact N-OD2 2.79Å; T48-D51 WeakPolarHBondContact O-CB 3.3Å; T48-D51 PolarHBondContact O-N 2.91Å; T48-D51 PolarHBondContact OG1-OD2 2.78Å
49	V	49.9	Very low	46.7	Very low	70 Å²	70	117.7 Å²	117.7	42%	0.424	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-56.5	-27	177.3	174.8	0	0	0	0	111.3	D51 L52 I57	V49-D51 VanDerWaalsContact C-N 3.26Å; V49-D51 PolarHBondContact O-N 2.94Å; V49-L52 PolarHBondContact O-N 3.05Å; V49-I57 WeakPolarHBondContact O-CD1 3.45Å
50	E	50.3	Low	47.3	Very low	174 Å²	174	115.7 Å²	115.7	81%	0.813	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-67.1	-22.2	176.5	-61.2	178.7	174.7	0	0	113.4	T48	T48-E50 PolarHBondContact O-N 3.29Å; T48-E50 VanDerWaalsContact O-N 3.08Å
51	D	52.4	Low	47.7	Very low	94 Å²	94	116.5 Å²	116.5	50%	0.503	55%	0.55	S	S	.	*	G	3₁₀ helix	trans	-86.8	-2.3	179.2	-65.5	-52.1	0	0	0	113.7	K47 T48 V49	K47-D51 WeakPolarHBondContact CA-OD2 3.22Å; K47-D51 HydrophobicContact CB-CB 3.95Å; K47-D51 HydrophobicContact CD-CB 4.3Å; K47-D51 HydrophobicContact CG-CB 4.14Å; T48-D51 PolarHBondContact N-OD2 2.79Å; T48-D51 WeakPolarHBondContact O-CB 3.3Å; T48-D51 PolarHBondContact O-N 2.91Å; T48-D51 PolarHBondContact OG1-OD2 2.78Å; V49-D51 VanDerWaalsContact C-N 3.26Å; V49-D51 PolarHBondContact O-N 2.94Å
52	L	48.9	Very low	48	Very low	67 Å²	67	113.9 Å²	113.9	35%	0.351	54%	0.54	S	S	.	.	S	Bend	trans	-79.8	147.8	178.6	-74.5	162.2	0	0	0	110.9	V49 K54 V56 I57	V49-L52 PolarHBondContact O-N 3.05Å; L52-K54 PolarHBondContact O-N 3.11Å; L52-V56 HydrophobicContact CD2-CG1 4.16Å; L52-I57 HydrophobicContact CB-CD1 4.22Å; L52-I57 HydrophobicContact CB-CG1 3.68Å; L52-I57 WeakPolarHBondContact O-CD1 3.43Å
53	P	52	Low	48.8	Very low	81 Å²	81	113.5 Å²	113.5	53%	0.526	54%	0.538	S	S	.	.			trans	-56.9	138.2	172	-21.8	32.2	0	0	0	111	P55 V56 I57	P53-P55 VanDerWaalsContact C-N 3.28Å; P53-P55 VanDerWaalsContact O-N 3.07Å; P53-V56 HydrophobicContact CB-CG2 4.31Å; P53-V56 HydrophobicContact CG-CG2 4.36Å; P53-V56 WeakPolarHBondContact O-CA 3.34Å; P53-V56 WeakPolarHBondContact O-CB 3.24Å; P53-V56 PolarHBondContact O-N 3.42Å; P53-I57 PolarHBondContact O-N 2.84Å; P53-I57 VanDerWaalsContact O-N 3.11Å
54	K	50.4	Low	50	Low	183 Å²	183	114.1 Å²	114.1	80%	0.796	54%	0.537	S	S	*	.	H	α-helix	trans	-45.2	-40.3	-180	-69.5	-178.8	178.1	179.1	0	114.8	L52 V56 I57 F58	L52-K54 PolarHBondContact O-N 3.11Å; K54-V56 VanDerWaalsContact C-N 3.34Å; K54-V56 PolarHBondContact O-N 3.43Å; K54-I57 PolarHBondContact O-N 3.25Å; K54-F58 WeakPolarHBondContact O-CB 3.46Å; K54-F58 PolarHBondContact O-N 2.71Å
55	P	41.1	Very low	50.7	Low	97 Å²	97	111.5 Å²	111.5	63%	0.63	52%	0.523	S	S	*	.	H	α-helix	trans	-64.5	-35.7	177	-21.1	33	0	0	0	113.5	P53 F58 A59	P53-P55 VanDerWaalsContact C-N 3.28Å; P53-P55 VanDerWaalsContact O-N 3.07Å; P55-F58 PolarHBondContact O-N 3.31Å; P55-A59 WeakPolarHBondContact O-CB 3.37Å; P55-A59 PolarHBondContact O-N 2.95Å
56	V	54	Low	51.6	Low	66 Å²	66	103.6 Å²	103.6	40%	0.4	50%	0.496	S	S	.	.	H	α-helix	trans	-71.8	-43.7	178	-177.5	0	0	0	0	110.1	L52 P53 K54 F58 A59 V60	L52-V56 HydrophobicContact CD2-CG1 4.16Å; P53-V56 HydrophobicContact CB-CG2 4.31Å; P53-V56 HydrophobicContact CG-CG2 4.36Å; P53-V56 WeakPolarHBondContact O-CA 3.34Å; P53-V56 WeakPolarHBondContact O-CB 3.24Å; P53-V56 PolarHBondContact O-N 3.42Å; K54-V56 VanDerWaalsContact C-N 3.34Å; K54-V56 PolarHBondContact O-N 3.43Å; V56-F58 VanDerWaalsContact C-N 3.27Å; V56-F58 PolarHBondContact O-N 2.91Å; V56-A59 PolarHBondContact O-N 3.25Å; V56-V60 HydrophobicContact CG1-CG2 4.43Å; V56-V60 VanDerWaalsContact O-CG2 3.3Å; V56-V60 WeakPolarHBondContact O-CG2 3.4Å; V56-V60 PolarHBondContact O-N 2.9Å
57	I	50.3	Low	53.1	Low	37 Å²	37	98 Å²	98	19%	0.19	48%	0.479	C	S	.	.	H	α-helix	trans	-54.8	-48.2	172.6	-66.6	178	0	0	0	109.7	V49 L52 P53 K54 A59 V60 Y61	V49-I57 WeakPolarHBondContact O-CD1 3.45Å; L52-I57 HydrophobicContact CB-CD1 4.22Å; L52-I57 HydrophobicContact CB-CG1 3.68Å; L52-I57 WeakPolarHBondContact O-CD1 3.43Å; P53-I57 PolarHBondContact O-N 2.84Å; P53-I57 VanDerWaalsContact O-N 3.11Å; K54-I57 PolarHBondContact O-N 3.25Å; I57-A59 PolarHBondContact O-N 2.93Å; I57-V60 PolarHBondContact O-N 2.92Å; I57-Y61 HydrophobicContact CG2-CD2 3.47Å; I57-Y61 VanDerWaalsContact CG2-CD2 3.47Å; I57-Y61 HydrophobicContact CG2-CE2 3.39Å; I57-Y61 VanDerWaalsContact O-CD2 3.22Å; I57-Y61 WeakPolarHBondContact O-CD2 3.24Å; I57-Y61 PolarHBondContact O-N 3.42Å
58	F	46.9	Very low	54.4	Low	92 Å²	92	95.1 Å²	95.1	40%	0.404	47%	0.468	S	S	.	.	H	α-helix	trans	-60.9	-44.1	178.3	-169.2	-104.6	0	0	0	112.9	K54 P55 V56 V60 Y61 L62 R641	K54-F58 WeakPolarHBondContact O-CB 3.46Å; K54-F58 PolarHBondContact O-N 2.71Å; P55-F58 PolarHBondContact O-N 3.31Å; V56-F58 VanDerWaalsContact C-N 3.27Å; V56-F58 PolarHBondContact O-N 2.91Å; F58-V60 VanDerWaalsContact C-N 3.35Å; F58-V60 PolarHBondContact O-N 3.43Å; F58-Y61 PolarHBondContact O-N 2.96Å; F58-L62 HydrophobicContact CD1-CD1 3.5Å; F58-L62 HydrophobicContact CD1-CG 4.17Å; F58-L62 HydrophobicContact CE1-CD1 3.3Å; F58-L62 HydrophobicContact CE1-CG 4Å; F58-L62 HydrophobicContact CG-CD1 4.44Å; F58-L62 HydrophobicContact CZ-CD1 4.1Å; F58-L62 HydrophobicContact CZ-CG 4.38Å; F58-L62 WeakPolarHBondContact O-CB 3.35Å; F58-L62 WeakPolarHBondContact O-CG 3.39Å; F58-L62 PolarHBondContact O-N 2.85Å; F58-R641 VanDerWaalsContact CZ-CZ 3.47Å
59	A	49.7	Very low	55.4	Low	47 Å²	47	94.2 Å²	94.2	39%	0.388	46%	0.458	S	S	.	.	H	α-helix	trans	-64.4	-38.1	176.4	0	0	0	0	0	112.5	P55 V56 I57 R63	P55-A59 WeakPolarHBondContact O-CB 3.37Å; P55-A59 PolarHBondContact O-N 2.95Å; V56-A59 PolarHBondContact O-N 3.25Å; I57-A59 PolarHBondContact O-N 2.93Å; A59-R63 WeakPolarHBondContact O-CG 3.42Å; A59-R63 PolarHBondContact O-N 3.18Å
60	V	58.5	Low	56.3	Low	53 Å²	53	95.3 Å²	95.3	32%	0.321	46%	0.459	S	S	.	.	H	α-helix	trans	-66	-48.8	175.1	171.2	0	0	0	0	110.4	V56 I57 F58 L62 R63 Y64	V56-V60 HydrophobicContact CG1-CG2 4.43Å; V56-V60 VanDerWaalsContact O-CG2 3.3Å; V56-V60 WeakPolarHBondContact O-CG2 3.4Å; V56-V60 PolarHBondContact O-N 2.9Å; I57-V60 PolarHBondContact O-N 2.92Å; F58-V60 VanDerWaalsContact C-N 3.35Å; F58-V60 PolarHBondContact O-N 3.43Å; V60-L62 VanDerWaalsContact C-N 3.32Å; V60-L62 PolarHBondContact O-N 3.45Å; V60-R63 PolarHBondContact O-N 2.98Å; V60-Y64 HydrophobicContact CG1-CD2 3.67Å; V60-Y64 HydrophobicContact CG1-CE2 3.43Å; V60-Y64 VanDerWaalsContact CG1-CE2 3.43Å; V60-Y64 WeakPolarHBondContact O-CD2 3.45Å; V60-Y64 PolarHBondContact O-N 3.38Å
61	Y	54	Low	57.7	Low	155 Å²	155	92.5 Å²	92.5	61%	0.608	45%	0.446	S	S	*	.	H	α-helix	trans	-59.2	-41.6	174.8	-86.1	-69.6	0	0	0	112.4	I57 F58 Y64 Y65	I57-Y61 HydrophobicContact CG2-CD2 3.47Å; I57-Y61 VanDerWaalsContact CG2-CD2 3.47Å; I57-Y61 HydrophobicContact CG2-CE2 3.39Å; I57-Y61 VanDerWaalsContact O-CD2 3.22Å; I57-Y61 WeakPolarHBondContact O-CD2 3.24Å; I57-Y61 PolarHBondContact O-N 3.42Å; F58-Y61 PolarHBondContact O-N 2.96Å; Y61-Y64 PolarHBondContact O-N 2.79Å; Y61-Y65 VanDerWaalsContact O-CB 3.29Å; Y61-Y65 WeakPolarHBondContact O-CB 3.36Å; Y61-Y65 PolarHBondContact O-N 3.29Å
62	L	50.6	Low	58.8	Low	51 Å²	51	95.3 Å²	95.3	27%	0.267	45%	0.449	S	S	.	.	H	α-helix	trans	-61.1	-45.6	174.6	-81.7	172.1	0	0	0	111.2	F58 V60 Y64 Y65 V66 R641	F58-L62 HydrophobicContact CD1-CD1 3.5Å; F58-L62 HydrophobicContact CD1-CG 4.17Å; F58-L62 HydrophobicContact CE1-CD1 3.3Å; F58-L62 HydrophobicContact CE1-CG 4Å; F58-L62 HydrophobicContact CG-CD1 4.44Å; F58-L62 HydrophobicContact CZ-CD1 4.1Å; F58-L62 HydrophobicContact CZ-CG 4.38Å; F58-L62 WeakPolarHBondContact O-CB 3.35Å; F58-L62 WeakPolarHBondContact O-CG 3.39Å; F58-L62 PolarHBondContact O-N 2.85Å; V60-L62 VanDerWaalsContact C-N 3.32Å; V60-L62 PolarHBondContact O-N 3.45Å; L62-Y64 VanDerWaalsContact C-N 3.34Å; L62-Y64 PolarHBondContact O-N 3.29Å; L62-Y65 PolarHBondContact O-N 3.18Å; L62-V66 VanDerWaalsContact O-CB 3.29Å; L62-V66 WeakPolarHBondContact O-CB 3.45Å; L62-V66 WeakPolarHBondContact O-CG2 3.41Å; L62-V66 PolarHBondContact O-N 3.11Å; L62-R641 HydrophobicContact CD2-CG 4.43Å
63	R	60	Low	59.9	Low	192 Å²	192	92.7 Å²	92.7	73%	0.725	44%	0.437	S	S	*	.	H	α-helix	trans	-60.4	-42.9	176.6	-76.8	-171.8	-176.5	-152.7	2.2	112.2	A59 V60 V66 Q67	A59-R63 WeakPolarHBondContact O-CG 3.42Å; A59-R63 PolarHBondContact O-N 3.18Å; V60-R63 PolarHBondContact O-N 2.98Å; R63-V66 PolarHBondContact O-N 3.15Å; R63-Q67 WeakPolarHBondContact O-CB 3.43Å; R63-Q67 VanDerWaalsContact O-CG 3.28Å; R63-Q67 WeakPolarHBondContact O-CG 3.31Å; R63-Q67 PolarHBondContact O-N 2.7Å
64	Y	64.2	Low	61.2	Low	113 Å²	113	93.2 Å²	93.2	44%	0.443	43%	0.431	S	S	.	.	H	α-helix	trans	-62.9	-47	175.5	-80.6	-67.1	0	0	0	112.1	M1 V60 Y61 L62 V66 Q67 E68	M1-Y64 HydrophobicContact CE-CE1 4.38Å; V60-Y64 HydrophobicContact CG1-CD2 3.67Å; V60-Y64 HydrophobicContact CG1-CE2 3.43Å; V60-Y64 VanDerWaalsContact CG1-CE2 3.43Å; V60-Y64 WeakPolarHBondContact O-CD2 3.45Å; V60-Y64 PolarHBondContact O-N 3.38Å; Y61-Y64 PolarHBondContact O-N 2.79Å; L62-Y64 VanDerWaalsContact C-N 3.34Å; L62-Y64 PolarHBondContact O-N 3.29Å; Y64-V66 VanDerWaalsContact C-N 3.31Å; Y64-V66 PolarHBondContact O-N 3Å; Y64-Q67 PolarHBondContact O-N 3.01Å; Y64-E68 WeakPolarHBondContact O-CB 3.3Å; Y64-E68 PolarHBondContact O-N 3Å
65	Y	58.9	Low	62.8	Low	129 Å²	129	90.8 Å²	90.8	51%	0.506	42%	0.423	S	S	.	.	H	α-helix	trans	-61.9	-40.2	179	-175.8	-92.1	0	0	0	111.7	Y61 L62 E68 E69	Y61-Y65 VanDerWaalsContact O-CB 3.29Å; Y61-Y65 WeakPolarHBondContact O-CB 3.36Å; Y61-Y65 PolarHBondContact O-N 3.29Å; L62-Y65 PolarHBondContact O-N 3.18Å; Y65-E68 PolarHBondContact O-N 2.76Å; Y65-E69 HydrophobicContact CD1-CG 4.41Å; Y65-E69 HydrophobicContact CE1-CG 3.96Å; Y65-E69 WeakPolarHBondContact CE1-OE1 3.44Å; Y65-E69 VanDerWaalsContact CZ-OE1 3.3Å; Y65-E69 PolarHBondContact O-N 3.08Å; Y65-E69 PolarHBondContact OH-OE1 3.36Å
66	V	60.6	Low	64.7	Low	26 Å²	26	86.8 Å²	86.8	16%	0.158	40%	0.397	C	S	.	.	H	α-helix	trans	-64	-44.6	174.3	163.1	0	0	0	0	112	L62 R63 Y64 E68 E69 E70	L62-V66 VanDerWaalsContact O-CB 3.29Å; L62-V66 WeakPolarHBondContact O-CB 3.45Å; L62-V66 WeakPolarHBondContact O-CG2 3.41Å; L62-V66 PolarHBondContact O-N 3.11Å; R63-V66 PolarHBondContact O-N 3.15Å; Y64-V66 VanDerWaalsContact C-N 3.31Å; Y64-V66 PolarHBondContact O-N 3Å; V66-E68 VanDerWaalsContact C-N 3.33Å; V66-E69 PolarHBondContact O-N 2.91Å; V66-E70 WeakPolarHBondContact O-CG 3.44Å; V66-E70 PolarHBondContact O-N 3.31Å
67	Q	70.7	Confident	66	Low	103 Å²	103	83.8 Å²	83.8	48%	0.481	38%	0.378	S	S	.	.	H	α-helix	trans	-63.6	-40.6	177	-76.5	176.9	-26	0	0	111.6	R63 Y64 E70 E71	R63-Q67 WeakPolarHBondContact O-CB 3.43Å; R63-Q67 VanDerWaalsContact O-CG 3.28Å; R63-Q67 WeakPolarHBondContact O-CG 3.31Å; R63-Q67 PolarHBondContact O-N 2.7Å; Y64-Q67 PolarHBondContact O-N 3.01Å; Q67-E70 PolarHBondContact O-N 3.11Å; Q67-E71 WeakPolarHBondContact O-CB 3.31Å; Q67-E71 WeakPolarHBondContact O-CG 3.46Å; Q67-E71 PolarHBondContact O-N 2.71Å
68	E	73.5	Confident	67.6	Low	89 Å²	89	88.1 Å²	88.1	42%	0.416	40%	0.398	S	S	.	.	H	α-helix	trans	-65	-41.3	176.5	-167.8	180	178	0	0	111.8	Y64 Y65 V66 E71 R72	Y64-E68 WeakPolarHBondContact O-CB 3.3Å; Y64-E68 PolarHBondContact O-N 3Å; Y65-E68 PolarHBondContact O-N 2.76Å; V66-E68 VanDerWaalsContact C-N 3.33Å; E68-E71 PolarHBondContact O-N 3.32Å; E68-R72 WeakPolarHBondContact O-CB 3.43Å; E68-R72 VanDerWaalsContact O-CG 3.3Å; E68-R72 WeakPolarHBondContact O-CG 3.34Å; E68-R72 PolarHBondContact O-N 3.31Å; E68-R72 IonicContact OE1-CZ 2.84Å; E68-R72 IonicContact OE1-NE 3.14Å; E68-R72 IonicContact OE1-NH2 2.77Å; E68-R72 PolarHBondContact OE1-NH2 2.91Å
69	E	67.2	Low	69.6	Low	59 Å²	59	87.9 Å²	87.9	28%	0.276	40%	0.398	S	S	.	.	H	α-helix	trans	-62.9	-40.5	172.3	-78.3	-174.9	157.5	0	0	112.1	Y65 V66 A73 R645	Y65-E69 HydrophobicContact CD1-CG 4.41Å; Y65-E69 HydrophobicContact CE1-CG 3.96Å; Y65-E69 WeakPolarHBondContact CE1-OE1 3.44Å; Y65-E69 VanDerWaalsContact CZ-OE1 3.3Å; Y65-E69 PolarHBondContact O-N 3.08Å; Y65-E69 PolarHBondContact OH-OE1 3.36Å; V66-E69 PolarHBondContact O-N 2.91Å; E69-A73 WeakPolarHBondContact O-CB 3.18Å; E69-A73 PolarHBondContact O-N 3.08Å; E69-R645 IonicContact OE2-NH1 3.67Å
70	E	69.4	Low	71.2	Confident	93 Å²	93	85.8 Å²	85.8	44%	0.435	38%	0.38	S	S	.	.	H	α-helix	trans	-66.6	-37.9	175.8	-76.4	177.6	-170.3	0	0	112.6	V66 Q67 K74	V66-E70 WeakPolarHBondContact O-CG 3.44Å; V66-E70 PolarHBondContact O-N 3.31Å; Q67-E70 PolarHBondContact O-N 3.11Å; E70-K74 VanDerWaalsContact O-CG 3.24Å; E70-K74 WeakPolarHBondContact O-CG 3.18Å; E70-K74 PolarHBondContact O-N 3.24Å
71	E	78.1	Confident	72.4	Confident	116 Å²	116	85.7 Å²	85.7	54%	0.542	38%	0.38	S	S	.	.	H	α-helix	trans	-67.9	-47.8	176.5	-76.2	176.9	179.9	0	0	111.5	Q67 E68 A73 K74 E75	Q67-E71 WeakPolarHBondContact O-CB 3.31Å; Q67-E71 WeakPolarHBondContact O-CG 3.46Å; Q67-E71 PolarHBondContact O-N 2.71Å; E68-E71 PolarHBondContact O-N 3.32Å; E71-A73 VanDerWaalsContact C-N 3.29Å; E71-A73 PolarHBondContact O-N 2.96Å; E71-K74 WeakPolarHBondContact O-CB 3.37Å; E71-K74 PolarHBondContact O-N 2.8Å; E71-K74 VanDerWaalsContact O-N 3.09Å; E71-E75 PolarHBondContact O-N 2.95Å; E71-E75 VanDerWaalsContact O-N 3.1Å
72	R	75.3	Confident	73.8	Confident	152 Å²	152	79.9 Å²	79.9	57%	0.574	36%	0.364	S	S	*	.	H	α-helix	trans	-58.6	-43.2	173.2	-70.1	176.7	-173.6	-164.7	4.7	111.3	E68 K74 E75 V76	E68-R72 WeakPolarHBondContact O-CB 3.43Å; E68-R72 VanDerWaalsContact O-CG 3.3Å; E68-R72 WeakPolarHBondContact O-CG 3.34Å; E68-R72 PolarHBondContact O-N 3.31Å; E68-R72 IonicContact OE1-CZ 2.84Å; E68-R72 IonicContact OE1-NE 3.14Å; E68-R72 IonicContact OE1-NH2 2.77Å; E68-R72 PolarHBondContact OE1-NH2 2.91Å; R72-K74 PolarHBondContact O-N 3Å; R72-E75 PolarHBondContact O-N 2.92Å; R72-V76 WeakPolarHBondContact O-CB 3.45Å; R72-V76 WeakPolarHBondContact O-CG2 3.29Å; R72-V76 PolarHBondContact O-N 3.39Å; R72-V76 VanDerWaalsContact O-N 3.07Å
73	A	72.3	Confident	75.1	Confident	12 Å²	12	80.3 Å²	80.3	10%	0.099	37%	0.368	C	S	.	.	H	α-helix	trans	-60.1	-44.2	174.9	0	0	0	0	0	111.2	E69 E71 E75 V76 L77 M397	E69-A73 WeakPolarHBondContact O-CB 3.18Å; E69-A73 PolarHBondContact O-N 3.08Å; E71-A73 VanDerWaalsContact C-N 3.29Å; E71-A73 PolarHBondContact O-N 2.96Å; A73-E75 VanDerWaalsContact C-N 3.34Å; A73-E75 PolarHBondContact O-N 2.76Å; A73-V76 WeakPolarHBondContact O-CB 3.42Å; A73-V76 PolarHBondContact O-N 3.07Å; A73-L77 PolarHBondContact O-N 2.91Å; A73-M397 VanDerWaalsContact C-CE 3.5Å; A73-M397 VanDerWaalsContact C-SD 3.54Å; A73-M397 HydrophobicContact CB-CE 3.7Å; A73-M397 HydrophobicContact CB-SD 3.84Å; A73-M397 WeakPolarHBondContact O-CE 3.1Å
74	K	78.8	Confident	76	Confident	93 Å²	93	74.8 Å²	74.8	40%	0.404	35%	0.35	S	S	.	.	H	α-helix	trans	-58.9	-41.8	177.8	-75.5	166.3	-168.7	167.1	0	112.9	E70 E71 R72 L77 Q78 M397	E70-K74 VanDerWaalsContact O-CG 3.24Å; E70-K74 WeakPolarHBondContact O-CG 3.18Å; E70-K74 PolarHBondContact O-N 3.24Å; E71-K74 WeakPolarHBondContact O-CB 3.37Å; E71-K74 PolarHBondContact O-N 2.8Å; E71-K74 VanDerWaalsContact O-N 3.09Å; R72-K74 PolarHBondContact O-N 3Å; K74-L77 PolarHBondContact O-N 3.07Å; K74-Q78 WeakPolarHBondContact O-CG 3.36Å; K74-Q78 PolarHBondContact O-N 3.01Å; K74-Q78 VanDerWaalsContact O-N 3.15Å; K74-M397 HydrophobicContact CG-SD 4.21Å
75	E	84.4	Confident	76.5	Confident	131 Å²	131	75.9 Å²	75.9	61%	0.612	36%	0.359	S	S	*	.	H	α-helix	trans	-63.1	-45	176.3	-67.6	176.6	176.4	0	0	111.2	E71 R72 A73 L77 Q78 E79	E71-E75 PolarHBondContact O-N 2.95Å; E71-E75 VanDerWaalsContact O-N 3.1Å; R72-E75 PolarHBondContact O-N 2.92Å; A73-E75 VanDerWaalsContact C-N 3.34Å; A73-E75 PolarHBondContact O-N 2.76Å; E75-L77 VanDerWaalsContact C-N 3.33Å; E75-L77 PolarHBondContact O-N 2.94Å; E75-Q78 WeakPolarHBondContact O-CB 3.31Å; E75-Q78 PolarHBondContact O-N 3.1Å; E75-Q78 VanDerWaalsContact O-N 3.12Å; E75-E79 PolarHBondContact O-N 3.27Å
76	V	80.5	Confident	76.3	Confident	14 Å²	14	77.4 Å²	77.4	9%	0.085	37%	0.371	C	S	.	.	H	α-helix	trans	-62.4	-37.9	176.4	166.2	0	0	0	0	112.2	R72 A73 Q78 E79 F80 F386 E390 F394	R72-V76 WeakPolarHBondContact O-CB 3.45Å; R72-V76 WeakPolarHBondContact O-CG2 3.29Å; R72-V76 PolarHBondContact O-N 3.39Å; R72-V76 VanDerWaalsContact O-N 3.07Å; A73-V76 WeakPolarHBondContact O-CB 3.42Å; A73-V76 PolarHBondContact O-N 3.07Å; V76-Q78 VanDerWaalsContact C-N 3.3Å; V76-Q78 PolarHBondContact O-N 3.17Å; V76-E79 WeakPolarHBondContact O-CB 3.21Å; V76-E79 PolarHBondContact O-N 2.98Å; V76-F80 PolarHBondContact O-N 3.36Å; V76-F386 HydrophobicContact CG1-CD1 4.01Å; V76-F386 HydrophobicContact CG1-CE1 4.47Å; V76-E390 HydrophobicContact CB-CG 4.43Å; V76-E390 HydrophobicContact CG1-CB 4.08Å; V76-E390 VanDerWaalsContact CG1-CD 3.47Å; V76-E390 HydrophobicContact CG1-CG 3.35Å; V76-E390 VanDerWaalsContact CG2-CD 3.44Å; V76-E390 HydrophobicContact CG2-CG 4.27Å; V76-E390 VanDerWaalsContact CG2-OE2 3.29Å; V76-E390 WeakPolarHBondContact CG2-OE2 3.46Å; V76-F394 HydrophobicContact CG1-CD2 3.64Å; V76-F394 HydrophobicContact CG1-CE2 3.98Å
77	L	81.8	Confident	75.7	Confident	3 Å²	3	78.7 Å²	78.7	2%	0.016	38%	0.381	C	S	.	.	H	α-helix	trans	-66.2	-35.6	174.7	-172.4	62.6	0	0	0	111.9	A73 K74 E75 E79 F80 V81 F394 M397 L398 R401	A73-L77 PolarHBondContact O-N 2.91Å; K74-L77 PolarHBondContact O-N 3.07Å; E75-L77 VanDerWaalsContact C-N 3.33Å; E75-L77 PolarHBondContact O-N 2.94Å; L77-E79 VanDerWaalsContact C-N 3.33Å; L77-F80 HydrophobicContact CD1-CB 4.49Å; L77-F80 HydrophobicContact CD1-CD1 4.03Å; L77-F80 WeakPolarHBondContact O-CB 3.41Å; L77-F80 PolarHBondContact O-N 2.77Å; L77-V81 HydrophobicContact CG-CG2 4.49Å; L77-V81 WeakPolarHBondContact O-CG2 3.43Å; L77-V81 PolarHBondContact O-N 3.26Å; L77-F394 HydrophobicContact CD1-CE2 3.95Å; L77-F394 HydrophobicContact CD1-CZ 4.43Å; L77-M397 HydrophobicContact CB-CE 3.54Å; L77-M397 HydrophobicContact CB-SD 4.07Å; L77-M397 HydrophobicContact CD1-CE 4.4Å; L77-M397 HydrophobicContact CD2-CE 4.01Å; L77-M397 HydrophobicContact CD2-CG 4.02Å; L77-M397 HydrophobicContact CD2-SD 3.93Å; L77-M397 HydrophobicContact CG-CE 4.2Å; L77-L398 HydrophobicContact CD1-CD1 3.85Å; L77-R401 HydrophobicContact CD2-CB 4.36Å; L77-R401 VanDerWaalsContact CD2-CD 3.48Å; L77-R401 HydrophobicContact CD2-CG 3.78Å
78	Q	85.4	Confident	74.3	Confident	127 Å²	127	80.7 Å²	80.7	59%	0.593	40%	0.395	S	S	*	.	H	α-helix	trans	-64.8	-40.3	173.1	-70.1	174.8	-15.4	0	0	111	K74 E75 V76 F80 V81 A82	K74-Q78 WeakPolarHBondContact O-CG 3.36Å; K74-Q78 PolarHBondContact O-N 3.01Å; K74-Q78 VanDerWaalsContact O-N 3.15Å; E75-Q78 WeakPolarHBondContact O-CB 3.31Å; E75-Q78 PolarHBondContact O-N 3.1Å; E75-Q78 VanDerWaalsContact O-N 3.12Å; V76-Q78 VanDerWaalsContact C-N 3.3Å; V76-Q78 PolarHBondContact O-N 3.17Å; Q78-F80 VanDerWaalsContact C-N 3.35Å; Q78-V81 PolarHBondContact O-N 3.19Å; Q78-A82 VanDerWaalsContact O-CB 3.25Å; Q78-A82 WeakPolarHBondContact O-CB 3.44Å; Q78-A82 PolarHBondContact O-N 3.49Å
79	E	87.3	Confident	72.9	Confident	88 Å²	88	81.6 Å²	81.6	41%	0.411	41%	0.411	S	S	.	.	H	α-helix	trans	-58.5	-47.2	170.9	-173.6	-169.4	161	0	0	110.9	E75 V76 L77 A82 T83 F386 R389	E75-E79 PolarHBondContact O-N 3.27Å; V76-E79 WeakPolarHBondContact O-CB 3.21Å; V76-E79 PolarHBondContact O-N 2.98Å; L77-E79 VanDerWaalsContact C-N 3.33Å; E79-A82 PolarHBondContact O-N 3.35Å; E79-T83 VanDerWaalsContact O-CG2 3.24Å; E79-T83 WeakPolarHBondContact O-CG2 3.34Å; E79-T83 PolarHBondContact O-N 3.11Å; E79-T83 VanDerWaalsContact O-N 3.15Å; E79-F386 HydrophobicContact CB-CE1 4.39Å; E79-F386 HydrophobicContact CG-CE1 4.26Å; E79-F386 HydrophobicContact CG-CZ 4.37Å; E79-R389 IonicContact OE1-CZ 3.52Å; E79-R389 IonicContact OE1-NH1 3.68Å; E79-R389 PolarHBondContact OE1-NH1 3.24Å; E79-R389 IonicContact OE1-NH2 3.77Å; E79-R389 PolarHBondContact OE1-NH2 3.36Å; E79-R389 VanDerWaalsContact OE1-NH2 3.14Å; E79-R389 IonicContact OE2-CZ 3.86Å; E79-R389 IonicContact OE2-NH1 3.84Å; E79-R389 IonicContact OE2-NH2 2.68Å; E79-R389 PolarHBondContact OE2-NH2 2.86Å
80	F	85	Confident	71.5	Confident	2 Å²	2	86.8 Å²	86.8	1%	0.009	43%	0.432	C	S	.	.	H	α-helix	trans	-58.2	-50.6	177.7	176.9	-102.5	0	0	0	112.1	V76 L77 Q78 A82 T83 F84 R382 V383 F386 F394 L398 F408	V76-F80 PolarHBondContact O-N 3.36Å; L77-F80 HydrophobicContact CD1-CB 4.49Å; L77-F80 HydrophobicContact CD1-CD1 4.03Å; L77-F80 WeakPolarHBondContact O-CB 3.41Å; L77-F80 PolarHBondContact O-N 2.77Å; Q78-F80 VanDerWaalsContact C-N 3.35Å; F80-A82 VanDerWaalsContact C-N 3.34Å; F80-A82 PolarHBondContact O-N 3.02Å; F80-T83 WeakPolarHBondContact O-CB 3.34Å; F80-T83 PolarHBondContact O-N 3.01Å; F80-T83 VanDerWaalsContact O-N 3.16Å; F80-T83 PolarHBondContact O-OG1 3.38Å; F80-F84 HydrophobicContact CD1-CE2 4.04Å; F80-F84 HydrophobicContact CD2-CE2 4.13Å; F80-F84 HydrophobicContact CE1-CD2 4.46Å; F80-F84 AromaticContact CE1-CE2 3.58Å; F80-F84 HydrophobicContact CE1-CE2 3.58Å; F80-F84 HydrophobicContact CE1-CZ 4.29Å; F80-F84 AromaticContact CE2-CE2 3.69Å; F80-F84 HydrophobicContact CE2-CE2 3.69Å; F80-F84 HydrophobicContact CE2-CZ 4.03Å; F80-F84 HydrophobicContact CG-CE2 4.31Å; F80-F84 AromaticContact CZ-CE2 3.39Å; F80-F84 HydrophobicContact CZ-CE2 3.39Å; F80-F84 AromaticContact CZ-CZ 3.72Å; F80-F84 HydrophobicContact CZ-CZ 3.72Å; F80-F84 VanDerWaalsContact O-CD2 3.27Å; F80-F84 WeakPolarHBondContact O-CD2 3.5Å; F80-R382 HydrophobicContact CE2-CB 4.35Å; F80-V383 HydrophobicContact CE2-CG2 4.1Å; F80-V383 HydrophobicContact CZ-CG2 3.75Å; F80-F386 HydrophobicContact CB-CD1 3.96Å; F80-F386 HydrophobicContact CB-CE1 3.74Å; F80-F386 HydrophobicContact CB-CG 4.47Å; F80-F386 HydrophobicContact CB-CZ 4.07Å; F80-F386 HydrophobicContact CD2-CB 4.45Å; F80-F386 HydrophobicContact CD2-CD1 4.18Å; F80-F386 AromaticContact CD2-CD2 3.66Å; F80-F386 HydrophobicContact CD2-CD2 3.66Å; F80-F386 HydrophobicContact CD2-CE1 4.34Å; F80-F386 AromaticContact CD2-CE2 3.83Å; F80-F386 HydrophobicContact CD2-CE2 3.83Å; F80-F386 AromaticContact CD2-CG 3.84Å; F80-F386 HydrophobicContact CD2-CG 3.84Å; F80-F386 HydrophobicContact CD2-CZ 4.17Å; F80-F386 HydrophobicContact CE2-CD2 4.32Å; F80-F394 HydrophobicContact CB-CE2 3.97Å; F80-F394 HydrophobicContact CB-CZ 3.93Å; F80-F394 HydrophobicContact CD1-CZ 4.14Å; F80-F394 AromaticContact CD2-CZ 3.82Å; F80-F394 HydrophobicContact CD2-CZ 3.82Å; F80-F394 HydrophobicContact CE2-CZ 4.34Å; F80-F394 HydrophobicContact CG-CE2 4.23Å; F80-F394 AromaticContact CG-CZ 3.7Å; F80-F394 HydrophobicContact CG-CZ 3.7Å; F80-L398 HydrophobicContact CD1-CD1 4.16Å; F80-L398 HydrophobicContact CE1-CD1 3.7Å; F80-L398 HydrophobicContact CE1-CD2 4.36Å; F80-L398 HydrophobicContact CZ-CD1 4.5Å; F80-L398 HydrophobicContact CZ-CD2 4.39Å; F80-F408 HydrophobicContact CE1-CE1 4.06Å; F80-F408 AromaticContact CE1-CZ 3.87Å; F80-F408 HydrophobicContact CE1-CZ 3.87Å; F80-F408 HydrophobicContact CZ-CE1 4.02Å; F80-F408 HydrophobicContact CZ-CZ 4.11Å
81	V	83.4	Confident	70	Confident	52 Å²	52	89.4 Å²	89.4	32%	0.315	45%	0.448	S	S	.	.	H	α-helix	trans	-62.5	-41.7	178.7	173	0	0	0	0	111.1	L77 Q78 T83 F84 E85	L77-V81 HydrophobicContact CG-CG2 4.49Å; L77-V81 WeakPolarHBondContact O-CG2 3.43Å; L77-V81 PolarHBondContact O-N 3.26Å; Q78-V81 PolarHBondContact O-N 3.19Å; V81-T83 PolarHBondContact O-N 2.78Å; V81-F84 PolarHBondContact O-N 2.89Å; V81-E85 PolarHBondContact O-N 2.78Å
82	A	83.3	Confident	67.8	Low	33 Å²	33	86.7 Å²	86.7	27%	0.273	45%	0.451	S	S	.	.	H	α-helix	trans	-60.3	-27.8	177.6	0	0	0	0	0	112.9	Q78 E79 F80 F84 E85 Q86	Q78-A82 VanDerWaalsContact O-CB 3.25Å; Q78-A82 WeakPolarHBondContact O-CB 3.44Å; Q78-A82 PolarHBondContact O-N 3.49Å; E79-A82 PolarHBondContact O-N 3.35Å; F80-A82 VanDerWaalsContact C-N 3.34Å; F80-A82 PolarHBondContact O-N 3.02Å; A82-F84 PolarHBondContact O-N 3.49Å; A82-E85 PolarHBondContact O-N 2.8Å; A82-Q86 WeakPolarHBondContact O-CG 3.33Å; A82-Q86 PolarHBondContact O-N 3.49Å; A82-Q86 VanDerWaalsContact O-N 3.13Å
83	T	77.8	Confident	65.7	Low	59 Å²	59	88.6 Å²	88.6	36%	0.362	46%	0.463	S	S	.	.	H	α-helix	trans	-65	-25.8	175.6	71.6	0	0	0	0	113.5	E79 F80 V81 F386	E79-T83 VanDerWaalsContact O-CG2 3.24Å; E79-T83 WeakPolarHBondContact O-CG2 3.34Å; E79-T83 PolarHBondContact O-N 3.11Å; E79-T83 VanDerWaalsContact O-N 3.15Å; F80-T83 WeakPolarHBondContact O-CB 3.34Å; F80-T83 PolarHBondContact O-N 3.01Å; F80-T83 VanDerWaalsContact O-N 3.16Å; F80-T83 PolarHBondContact O-OG1 3.38Å; V81-T83 PolarHBondContact O-N 2.78Å; T83-F386 HydrophobicContact CG2-CE2 4.46Å; T83-F386 HydrophobicContact CG2-CZ 4.1Å
84	F	77.8	Confident	63.6	Low	77 Å²	77	93 Å²	93	34%	0.338	49%	0.489	S	S	.	.	H	α-helix	trans	-85.2	-39.3	175.3	-62.5	-85.7	0	0	0	111.4	F80 V81 A82 Q86 S87 L379	F80-F84 HydrophobicContact CD1-CE2 4.04Å; F80-F84 HydrophobicContact CD2-CE2 4.13Å; F80-F84 HydrophobicContact CE1-CD2 4.46Å; F80-F84 AromaticContact CE1-CE2 3.58Å; F80-F84 HydrophobicContact CE1-CE2 3.58Å; F80-F84 HydrophobicContact CE1-CZ 4.29Å; F80-F84 AromaticContact CE2-CE2 3.69Å; F80-F84 HydrophobicContact CE2-CE2 3.69Å; F80-F84 HydrophobicContact CE2-CZ 4.03Å; F80-F84 HydrophobicContact CG-CE2 4.31Å; F80-F84 AromaticContact CZ-CE2 3.39Å; F80-F84 HydrophobicContact CZ-CE2 3.39Å; F80-F84 AromaticContact CZ-CZ 3.72Å; F80-F84 HydrophobicContact CZ-CZ 3.72Å; F80-F84 VanDerWaalsContact O-CD2 3.27Å; F80-F84 WeakPolarHBondContact O-CD2 3.5Å; V81-F84 PolarHBondContact O-N 2.89Å; A82-F84 PolarHBondContact O-N 3.49Å; F84-Q86 PolarHBondContact O-N 2.9Å; F84-S87 PolarHBondContact O-N 3.41Å; F84-S87 PolarHBondContact O-OG 3.03Å; F84-L379 HydrophobicContact CE1-CD1 4.39Å; F84-L379 HydrophobicContact CZ-CG 4.4Å
85	E	74.5	Confident	61.2	Low	136 Å²	136	97.6 Å²	97.6	64%	0.636	51%	0.51	S	S	*	.	H	α-helix	trans	-67.8	-35.5	-178.3	-66.1	-178	170.7	0	0	113.6	V81 A82 S87	V81-E85 PolarHBondContact O-N 2.78Å; A82-E85 PolarHBondContact O-N 2.8Å; E85-S87 PolarHBondContact O-N 2.75Å; E85-S87 VanDerWaalsContact O-N 3.07Å
86	Q	56.5	Low	58.8	Low	161 Å²	161	97.3 Å²	97.3	75%	0.752	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-12.3	178.4	-72.5	-178.1	12.1	0	0	113.4	A82 F84	A82-Q86 WeakPolarHBondContact O-CG 3.33Å; A82-Q86 PolarHBondContact O-N 3.49Å; A82-Q86 VanDerWaalsContact O-N 3.13Å; F84-Q86 PolarHBondContact O-N 2.9Å
87	S	46.7	Very low	56.3	Low	52 Å²	52	108.1 Å²	108.1	36%	0.364	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.3	-15.7	-174.9	71.8	0	0	0	0	115.1	F84 E85	F84-S87 PolarHBondContact O-N 3.41Å; F84-S87 PolarHBondContact O-OG 3.03Å; E85-S87 PolarHBondContact O-N 2.75Å; E85-S87 VanDerWaalsContact O-N 3.07Å
88	D	42.2	Very low	53.6	Low	146 Å²	146	111.3 Å²	111.3	78%	0.781	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-12.5	-171.3	-79.1	-25.8	0	0	0	115.6
89	S	43.7	Very low	50.8	Low	107 Å²	107	108.2 Å²	108.2	75%	0.748	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	-7.7	-172	-57.8	0	0	0	0	116.5
90	K	38.5	Very low	48.1	Very low	168 Å²	168	111 Å²	111	73%	0.73	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.2	1.3	-175.2	-74.6	-172	-179	176.7	0	116.8
91	I	37	Very low	45.6	Very low	148 Å²	148	117 Å²	117	76%	0.759	65%	0.651	S	S	*	*	S	Bend	trans	-80.1	-12	172.9	-61.3	175	0	0	0	111.2
92	G	31.9	Very low	43.1	Very low	59 Å²	59	121.3 Å²	121.3	61%	0.608	67%	0.672	S	S	*	*	S	Bend	trans	-107.6	106.1	171.9	0	0	0	0	0	113.4
93	K	32.1	Very low	40.5	Very low	192 Å²	192	125.7 Å²	125.7	84%	0.835	70%	0.698	S	S	*	*			trans	71	55.8	159.5	-49.1	178	-176.5	176.2	0	117.7	F95	K93-F95 PolarHBondContact O-N 3.04Å
94	T	27.7	Very low	38.2	Very low	104 Å²	104	126.8 Å²	126.8	64%	0.638	71%	0.713	S	S	*	*			trans	-80.2	74.1	152.4	-39.8	0	0	0	0	109	V96	T94-V96 VanDerWaalsContact C-N 3.34Å; T94-V96 HydrophobicContact CG2-CG2 4.2Å; T94-V96 PolarHBondContact O-N 2.88Å; T94-V96 VanDerWaalsContact O-N 3.1Å
95	F	28.9	Very low	36	Very low	191 Å²	191	132.6 Å²	132.6	84%	0.838	74%	0.741	S	S	*	*			trans	-66	101.1	156.4	-96.2	-97.2	0	0	0	106.3	K93 R97	K93-F95 PolarHBondContact O-N 3.04Å; F95-R97 PolarHBondContact O-N 3.4Å
96	V	32.9	Very low	33.6	Very low	124 Å²	124	133.6 Å²	133.6	75%	0.752	75%	0.75	S	S	*	*			trans	-66.2	104.5	170.1	-178.4	0	0	0	0	106.6	T94 G98	T94-V96 VanDerWaalsContact C-N 3.34Å; T94-V96 HydrophobicContact CG2-CG2 4.2Å; T94-V96 PolarHBondContact O-N 2.88Å; T94-V96 VanDerWaalsContact O-N 3.1Å; V96-G98 PolarHBondContact O-N 2.91Å; V96-G98 VanDerWaalsContact O-N 3.07Å
97	R	27.5	Very low	32.3	Very low	242 Å²	242	132.8 Å²	132.8	91%	0.913	75%	0.751	S	S	*	*			trans	-62	109.5	163.3	-72	-170.8	-134.5	175.3	4.3	106.1	F95 G99	F95-R97 PolarHBondContact O-N 3.4Å; R97-G99 PolarHBondContact O-N 3.39Å
98	G	26.3	Very low	31.3	Very low	70 Å²	70	137.5 Å²	137.5	72%	0.722	77%	0.772	S	S	*	*			trans	-57.6	107.2	169.8	0	0	0	0	0	108.5	V96	V96-G98 PolarHBondContact O-N 2.91Å; V96-G98 VanDerWaalsContact O-N 3.07Å
99	G	26	Very low	30.6	Very low	61 Å²	61	140.1 Å²	140.1	63%	0.629	78%	0.777	S	S	*	*			trans	-65.3	132.3	163.4	0	0	0	0	0	108.2	R97 V101	R97-G99 PolarHBondContact O-N 3.39Å; G99-V101 PolarHBondContact O-N 2.87Å; G99-V101 VanDerWaalsContact O-N 3.08Å
100	V	30.3	Very low	29.9	Very low	147 Å²	147	140.6 Å²	140.6	89%	0.891	78%	0.78	S	S	*	*			trans	-65.4	103.1	170	178.3	0	0	0	0	106.9
101	V	31.9	Very low	29.4	Very low	129 Å²	129	141.3 Å²	141.3	78%	0.782	79%	0.786	S	S	*	*			trans	-88	115.2	176.4	-178.8	0	0	0	0	108.1	G99	G99-V101 PolarHBondContact O-N 2.87Å; G99-V101 VanDerWaalsContact O-N 3.08Å
102	N	31.4	Very low	28.9	Very low	141 Å²	141	142.1 Å²	142.1	75%	0.754	79%	0.791	S	S	*	*			trans	-69.7	125	176.7	-149.5	5	0	0	0	108.6	A104	N102-A104 PolarHBondContact O-N 3.08Å
103	P	29.5	Very low	28.9	Very low	126 Å²	126	144.7 Å²	144.7	82%	0.818	80%	0.795	S	S	*	*	S	Bend	trans	-81	35.8	-162.1	31.7	-36	0	0	0	115.3
104	A	30.2	Very low	28.7	Very low	82 Å²	82	145.2 Å²	145.2	68%	0.678	80%	0.8	S	S	*	*			trans	-120	61.4	-179.4	0	0	0	0	0	111.3	N102	N102-A104 PolarHBondContact O-N 3.08Å
105	E	29.8	Very low	28.7	Very low	198 Å²	198	149 Å²	149	93%	0.925	81%	0.808	S	S	*	*			trans	-161.4	121.3	153	-109.9	161.6	-147.5	0	0	110.5
106	N	25.2	Very low	28.9	Very low	157 Å²	157	144.9 Å²	144.9	84%	0.84	80%	0.795	S	S	*	*			trans	-89.8	108.5	-175.5	-160.2	17.2	0	0	0	106.6
107	D	29.4	Very low	28.7	Very low	145 Å²	145	147.9 Å²	147.9	78%	0.775	80%	0.798	S	S	*	*			trans	-171.5	108	156.3	-95.5	-29.3	0	0	0	113.6	K109	D107-K109 PolarHBondContact O-N 2.69Å
108	N	25.6	Very low	28.7	Very low	150 Å²	150	146 Å²	146	80%	0.802	80%	0.797	S	S	*	*			trans	13.1	97.6	144.7	-58.1	-41.1	0	0	0	118.5
109	K	27.3	Very low	28.7	Very low	202 Å²	202	144.2 Å²	144.2	88%	0.878	77%	0.773	S	S	*	*			trans	-140.3	119.1	144.8	-72.4	-167.9	-179.6	169.2	0	111.6	D107	D107-K109 PolarHBondContact O-N 2.69Å
110	S	28.7	Very low	29	Very low	117 Å²	117	145.4 Å²	145.4	82%	0.818	77%	0.772	S	S	*	*			trans	-58.1	132.6	177.2	37.2	0	0	0	0	113.3
111	E	27.8	Very low	28.9	Very low	183 Å²	183	144.3 Å²	144.3	86%	0.855	77%	0.77	S	S	*	*			trans	-70.7	128.5	179.1	-62.6	172.1	158.3	0	0	111.2
112	L	26.7	Very low	28.7	Very low	164 Å²	164	144.6 Å²	144.6	86%	0.859	76%	0.76	S	S	*	*			trans	-106	115.2	167.4	-76.4	165.5	0	0	0	108.2
113	T	32	Very low	28.6	Very low	114 Å²	114	140.3 Å²	140.3	70%	0.699	74%	0.741	S	S	*	*			trans	-86.8	138	177.7	51.3	0	0	0	0	111.2	F115	T113-F115 PolarHBondContact O-N 2.73Å
114	E	28.5	Very low	28.9	Very low	202 Å²	202	139 Å²	139	94%	0.944	73%	0.731	S	S	*	*	S	Bend	trans	-67.7	31.1	-165.7	-153.8	175.3	-174.6	0	0	116.8
115	F	27.7	Very low	28.9	Very low	184 Å²	184	141.2 Å²	141.2	81%	0.807	73%	0.725	S	S	*	*			trans	-97.9	2	-178.1	-151.6	-101.7	0	0	0	114.7	T113 F117	T113-F115 PolarHBondContact O-N 2.73Å; F115-F117 PolarHBondContact O-N 3.5Å
116	D	31.3	Very low	29.1	Very low	105 Å²	105	136 Å²	136	56%	0.561	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	3.9	-167.8	-87	-23.1	0	0	0	117	F118 C119	D116-F118 VanDerWaalsContact C-N 3.28Å; D116-F118 PolarHBondContact O-N 2.87Å; D116-C119 PolarHBondContact O-N 2.75Å
117	F	29.4	Very low	29.5	Very low	186 Å²	186	135.6 Å²	135.6	82%	0.816	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-23.3	-179.3	-157.1	-99	0	0	0	113.6	F115	F115-F117 PolarHBondContact O-N 3.5Å
118	F	27.5	Very low	29.8	Very low	202 Å²	202	136.7 Å²	136.7	89%	0.886	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-10.5	179.3	-146.4	-97.5	0	0	0	113.8	D116	D116-F118 VanDerWaalsContact C-N 3.28Å; D116-F118 PolarHBondContact O-N 2.87Å
119	C	26.8	Very low	30.3	Very low	33 Å²	33	135.2 Å²	135.2	22%	0.223	68%	0.682	C	S	.	*	T	Hydrogen-bonded Turn	trans	-96.1	0.6	-179.4	-161.2	0	0	0	0	114.8	D116 C121 F122 C123	D116-C119 PolarHBondContact O-N 2.75Å; C119-C121 VanDerWaalsContact C-N 3.35Å; C119-C121 PolarHBondContact O-N 3.11Å; C119-F122 PolarHBondContact O-N 3.35Å; C119-C123 HydrophobicContact CB-CB 4.25Å; C119-C123 WeakPolarHBondContact CB-SG 3.3Å; C119-C123 WeakPolarHBondContact O-CB 3.43Å; C119-C123 PolarHBondContact O-N 2.52Å; C119-C123 PolarHBondContact O-SG 3.45Å; C119-C123 WeakPolarHBondContact SG-CB 3.49Å; C119-C123 CovalentContact SG-SG 2.07Å; C119-C123 PolarHBondContact SG-SG 2.95Å
120	S	31.4	Very low	30.8	Very low	86 Å²	86	131.7 Å²	131.7	60%	0.601	67%	0.668	S	S	*	*	H	α-helix	trans	-60	-40	-174.4	-171.1	0	0	0	0	113.7	V124	S120-V124 WeakPolarHBondContact O-CG2 3.28Å
121	C	28	Very low	31.2	Very low	124 Å²	124	132 Å²	132	84%	0.838	66%	0.657	S	S	*	*	H	α-helix	trans	-77.2	-27.5	177.1	-75.9	0	0	0	0	114.4	C119	C119-C121 VanDerWaalsContact C-N 3.35Å; C119-C121 PolarHBondContact O-N 3.11Å
122	F	28.7	Very low	31.6	Very low	135 Å²	135	126.7 Å²	126.7	59%	0.592	64%	0.644	S	S	*	*	H	α-helix	trans	-88.3	-32.2	-178.8	-160.9	-99.1	0	0	0	112.4	C119 F125 L126	C119-F122 PolarHBondContact O-N 3.35Å; F122-F125 WeakPolarHBondContact O-CB 3.48Å; F122-F125 PolarHBondContact O-N 3.06Å; F122-L126 HydrophobicContact CD1-CD1 4.09Å; F122-L126 HydrophobicContact CD1-CG 4.38Å; F122-L126 HydrophobicContact CE1-CD1 3.88Å; F122-L126 HydrophobicContact CE1-CG 4.14Å; F122-L126 PolarHBondContact O-N 3.25Å
123	C	29.6	Very low	32	Very low	51 Å²	51	121.8 Å²	121.8	35%	0.345	63%	0.628	S	S	.	*	H	α-helix	trans	-73.7	-27.8	-178.6	-77.8	0	0	0	0	112.7	C119 F125 L126 K127	C119-C123 HydrophobicContact CB-CB 4.25Å; C119-C123 WeakPolarHBondContact CB-SG 3.3Å; C119-C123 WeakPolarHBondContact O-CB 3.43Å; C119-C123 PolarHBondContact O-N 2.52Å; C119-C123 PolarHBondContact O-SG 3.45Å; C119-C123 WeakPolarHBondContact SG-CB 3.49Å; C119-C123 CovalentContact SG-SG 2.07Å; C119-C123 PolarHBondContact SG-SG 2.95Å; C123-F125 VanDerWaalsContact C-N 3.27Å; C123-F125 PolarHBondContact O-N 3.2Å; C123-L126 PolarHBondContact O-N 2.85Å; C123-K127 PolarHBondContact O-N 3.4Å
124	V	34.7	Very low	32.2	Very low	99 Å²	99	123.6 Å²	123.6	60%	0.6	63%	0.626	S	S	*	*	H	α-helix	trans	-63.2	-37.1	170.7	175	0	0	0	0	111	S120 F128	S120-V124 WeakPolarHBondContact O-CG2 3.28Å; V124-F128 PolarHBondContact O-N 3.41Å
125	F	31.2	Very low	32.4	Very low	128 Å²	128	121 Å²	121	56%	0.561	62%	0.618	S	S	*	*	H	α-helix	trans	-69.4	-38.4	178.8	-171.4	-98.4	0	0	0	112.8	F122 C123 F128 M129	F122-F125 WeakPolarHBondContact O-CB 3.48Å; F122-F125 PolarHBondContact O-N 3.06Å; C123-F125 VanDerWaalsContact C-N 3.27Å; C123-F125 PolarHBondContact O-N 3.2Å; F125-F128 PolarHBondContact O-N 2.73Å; F125-M129 PolarHBondContact O-N 3.15Å
126	L	32.8	Very low	32.7	Very low	89 Å²	89	122.1 Å²	122.1	47%	0.466	62%	0.617	S	S	.	*	H	α-helix	trans	-72.1	-37	178.5	-74.7	178.8	0	0	0	113.3	F122 C123 F128 M129 E130	F122-L126 HydrophobicContact CD1-CD1 4.09Å; F122-L126 HydrophobicContact CD1-CG 4.38Å; F122-L126 HydrophobicContact CE1-CD1 3.88Å; F122-L126 HydrophobicContact CE1-CG 4.14Å; F122-L126 PolarHBondContact O-N 3.25Å; C123-L126 PolarHBondContact O-N 2.85Å; L126-F128 VanDerWaalsContact C-N 3.25Å; L126-F128 PolarHBondContact O-N 2.87Å; L126-M129 PolarHBondContact O-N 3.3Å; L126-M129 VanDerWaalsContact O-N 3.11Å; L126-E130 PolarHBondContact O-N 3.07Å
127	K	35.1	Very low	32.8	Very low	149 Å²	149	123.3 Å²	123.3	65%	0.648	63%	0.631	S	S	*	*	H	α-helix	trans	-60.4	-38.1	175.1	-80.5	-170.3	175.2	176.4	0	112	C123 M129 E130 E131	C123-K127 PolarHBondContact O-N 3.4Å; K127-M129 VanDerWaalsContact C-N 3.29Å; K127-M129 PolarHBondContact O-N 3.29Å; K127-E130 PolarHBondContact O-N 3.14Å; K127-E131 PolarHBondContact O-N 3.14Å; K127-E131 VanDerWaalsContact O-N 3.11Å
128	F	36	Very low	32.7	Very low	168 Å²	168	124.3 Å²	124.3	74%	0.737	64%	0.635	S	S	*	*	H	α-helix	trans	-63.3	-34	176.5	-125	-87.1	0	0	0	113.1	V124 F125 L126	V124-F128 PolarHBondContact O-N 3.41Å; F125-F128 PolarHBondContact O-N 2.73Å; L126-F128 VanDerWaalsContact C-N 3.25Å; L126-F128 PolarHBondContact O-N 2.87Å
129	M	35.5	Very low	32.7	Very low	119 Å²	119	124.4 Å²	124.4	59%	0.586	64%	0.635	S	S	*	*	H	α-helix	trans	-79.5	-33.8	177.3	-73.4	-72.1	-69.2	0	0	112.8	F125 L126 K127 A132 A133	F125-M129 PolarHBondContact O-N 3.15Å; L126-M129 PolarHBondContact O-N 3.3Å; L126-M129 VanDerWaalsContact O-N 3.11Å; K127-M129 VanDerWaalsContact C-N 3.29Å; K127-M129 PolarHBondContact O-N 3.29Å; M129-A132 PolarHBondContact O-N 2.86Å; M129-A133 PolarHBondContact O-N 2.79Å
130	E	36.7	Very low	32.7	Very low	127 Å²	127	128.8 Å²	128.8	59%	0.593	66%	0.663	S	S	*	*	H	α-helix	trans	-70.9	-34.9	178.7	-114.4	177.5	-176.3	0	0	112.6	L126 K127 A132 A133 K134	L126-E130 PolarHBondContact O-N 3.07Å; K127-E130 PolarHBondContact O-N 3.14Å; E130-A132 VanDerWaalsContact C-N 3.3Å; E130-A132 PolarHBondContact O-N 3.03Å; E130-A133 PolarHBondContact O-N 2.89Å; E130-K134 PolarHBondContact O-N 3.45Å
131	E	37.3	Very low	32.4	Very low	125 Å²	125	131.9 Å²	131.9	58%	0.584	68%	0.678	S	S	*	*	H	α-helix	trans	-62.5	-38.6	173	-128.4	91.5	-122.4	0	0	111.3	K127 A133	K127-E131 PolarHBondContact O-N 3.14Å; K127-E131 VanDerWaalsContact O-N 3.11Å; E131-A133 VanDerWaalsContact C-N 3.32Å; E131-A133 PolarHBondContact O-N 2.93Å
132	A	35.9	Very low	32.3	Very low	70 Å²	70	129.4 Å²	129.4	58%	0.579	67%	0.673	S	S	*	*	H	α-helix	trans	-70.9	-26.8	177	0	0	0	0	0	113	M129 E130	M129-A132 PolarHBondContact O-N 2.86Å; E130-A132 VanDerWaalsContact C-N 3.3Å; E130-A132 PolarHBondContact O-N 3.03Å
133	A	35.8	Very low	32	Very low	62 Å²	62	131.7 Å²	131.7	51%	0.512	68%	0.683	S	S	.	*	H	α-helix	trans	-82.3	-21.1	-179.1	0	0	0	0	0	113.9	M129 E130 E131 N135	M129-A133 PolarHBondContact O-N 2.79Å; E130-A133 PolarHBondContact O-N 2.89Å; E131-A133 VanDerWaalsContact C-N 3.32Å; E131-A133 PolarHBondContact O-N 2.93Å; A133-N135 PolarHBondContact O-N 3.36Å
134	K	36.2	Very low	31.9	Very low	152 Å²	152	136.4 Å²	136.4	66%	0.661	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-13.3	-178.8	-79.1	174.9	-175.8	167.2	0	114.5	E130 R136	E130-K134 PolarHBondContact O-N 3.45Å; K134-R136 PolarHBondContact O-N 3.33Å
135	N	32.8	Very low	31.3	Very low	148 Å²	148	135.7 Å²	135.7	79%	0.791	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	37.7	-179.5	-71.1	-24.4	0	0	0	114.1	A133	A133-N135 PolarHBondContact O-N 3.36Å
136	R	34	Very low	30.9	Very low	207 Å²	207	140.4 Å²	140.4	78%	0.781	72%	0.723	S	S	*	*			trans	-117.4	131.8	175.9	-71.9	-170.9	-176	-161.5	1.2	113.5	K134	K134-R136 PolarHBondContact O-N 3.33Å
137	P	32.3	Very low	30.5	Very low	130 Å²	130	143.3 Å²	143.3	84%	0.844	74%	0.744	S	S	*	*			trans	-71.2	133.4	173.1	26.6	-30.5	0	0	0	111.7
138	K	28.6	Very low	29.8	Very low	206 Å²	206	147.8 Å²	147.8	90%	0.896	76%	0.757	S	S	*	*			trans	-72	126.6	-178.7	-62.8	174.4	179.5	176.3	0	110.7
139	K	27.5	Very low	29.1	Very low	205 Å²	205	146 Å²	146	89%	0.891	76%	0.764	S	S	*	*			trans	-128.1	150.1	160.5	-83.5	-169	179.5	-178.5	0	110.5
140	P	26.8	Very low	28.5	Very low	125 Å²	125	144.7 Å²	144.7	81%	0.812	77%	0.772	S	S	*	*			trans	-89.2	161.7	-148.9	33.5	-33.2	0	0	0	115.2
141	V	26	Very low	27.9	Very low	151 Å²	151	148 Å²	148	92%	0.915	79%	0.788	S	S	*	*			trans	-62.7	129.2	-168.8	-163.8	0	0	0	0	113.2
142	G	25	Very low	27.2	Very low	71 Å²	71	151.5 Å²	151.5	73%	0.732	80%	0.801	S	S	*	*			trans	-118.3	97.6	171.3	0	0	0	0	0	111.3
143	F	22.8	Very low	26.6	Very low	184 Å²	184	158.4 Å²	158.4	81%	0.807	81%	0.813	S	S	*	*			trans	-17.8	114.7	159.6	-166.4	-99.1	0	0	0	117.2
144	V	27.6	Very low	26	Very low	149 Å²	149	162.5 Å²	162.5	90%	0.903	83%	0.832	S	S	*	*			trans	-137.1	125.7	149.1	-174.2	0	0	0	0	109.4
145	S	21.3	Very low	25.3	Very low	84 Å²	84	161.5 Å²	161.5	59%	0.587	84%	0.842	S	S	*	*			trans	-97.2	157.1	-169.5	-165.8	0	0	0	0	111.4
146	R	22.7	Very low	24.9	Very low	228 Å²	228	163.5 Å²	163.5	86%	0.86	85%	0.847	S	S	*	*			trans	78.6	86.4	140.3	-155.5	175.6	-166.9	163.3	2.2	119.3
147	V	24.4	Very low	24.6	Very low	149 Å²	149	161.5 Å²	161.5	90%	0.903	85%	0.85	S	S	*	*			trans	-136.4	102.8	132.6	-175.9	0	0	0	0	108.5
148	R	21.2	Very low	24.4	Very low	243 Å²	243	162.7 Å²	162.7	92%	0.917	85%	0.848	S	S	*	*			trans	-120.8	110	167.3	-97.1	-173	-81.1	179.6	-6.5	105.9
149	C	21.3	Very low	24.4	Very low	131 Å²	131	161.4 Å²	161.4	89%	0.885	85%	0.845	S	S	*	*			trans	-175.8	146.1	145.2	-125.9	0	0	0	0	111.8
150	A	22.1	Very low	24.6	Very low	91 Å²	91	155.5 Å²	155.5	75%	0.752	84%	0.842	S	S	*	*			trans	78	74	159.8	0	0	0	0	0	119.7
151	Q	25.2	Very low	24.8	Very low	198 Å²	198	158.7 Å²	158.7	93%	0.925	84%	0.843	S	S	*	*			trans	-164.1	92.9	130.7	-116.6	162.9	-6.3	0	0	109.2
152	K	22	Very low	25.1	Very low	198 Å²	198	154.8 Å²	154.8	86%	0.861	83%	0.834	S	S	*	*			trans	-117.2	20	-173.6	-142.6	-176	-174.7	-177.1	0	113.7
153	Y	23	Very low	26	Very low	215 Å²	215	157.5 Å²	157.5	84%	0.843	84%	0.836	S	S	*	*	S	Bend	trans	-135.9	111.9	173.9	-66.8	-80.8	0	0	0	107.4
154	V	23.2	Very low	27.1	Very low	148 Å²	148	155.3 Å²	155.3	90%	0.897	83%	0.833	S	S	*	*	S	Bend	trans	162.1	-15.3	154.6	161.1	0	0	0	0	111.9
155	C	21.4	Very low	27.8	Very low	130 Å²	130	152.3 Å²	152.3	88%	0.878	83%	0.832	S	S	*	*			trans	-111.5	75	-179.1	-138.3	0	0	0	0	113.3
156	Q	24.5	Very low	29.1	Very low	191 Å²	191	157.3 Å²	157.3	89%	0.893	84%	0.843	S	S	*	*			trans	-131.6	10.1	167.7	-117.1	-179.7	-2.7	0	0	114.4
157	I	27.1	Very low	30.3	Very low	164 Å²	164	158.1 Å²	158.1	84%	0.841	85%	0.846	S	S	*	*	S	Bend	trans	-95.3	-1.5	-177.3	-63.2	-175.9	0	0	0	113.9
158	I	29.6	Very low	31.7	Very low	156 Å²	156	154.7 Å²	154.7	80%	0.8	82%	0.822	S	S	*	*	S	Bend	trans	-128.5	63.4	178.9	-44	179.1	0	0	0	111.3
159	Q	28.9	Very low	33.5	Very low	178 Å²	178	146.1 Å²	146.1	83%	0.832	80%	0.799	S	S	*	*			trans	-141.7	68.7	157	-72.1	-166.9	-8.5	0	0	109.1	K161	Q159-K161 VanDerWaalsContact C-N 3.29Å; Q159-K161 PolarHBondContact O-N 3.35Å
160	G	31.6	Very low	35.4	Very low	82 Å²	82	147.1 Å²	147.1	85%	0.845	80%	0.795	S	S	*	*			trans	-64.8	96.8	156.8	0	0	0	0	0	107.8	G162	G160-G162 VanDerWaalsContact C-N 3.27Å; G160-G162 PolarHBondContact O-N 2.84Å
161	K	29.6	Very low	37.2	Very low	191 Å²	191	148.7 Å²	148.7	83%	0.83	79%	0.791	S	S	*	*			trans	-59.1	93.3	163.2	-87.8	177.7	169.2	178	0	107.4	Q159 V163	Q159-K161 VanDerWaalsContact C-N 3.29Å; Q159-K161 PolarHBondContact O-N 3.35Å; K161-V163 VanDerWaalsContact C-N 3.33Å; K161-V163 PolarHBondContact O-N 3.38Å
162	G	33.2	Very low	39.4	Very low	70 Å²	70	144.1 Å²	144.1	72%	0.722	77%	0.769	S	S	*	*			trans	-69.8	93.2	167.1	0	0	0	0	0	108.8	G160 D164	G160-G162 VanDerWaalsContact C-N 3.27Å; G160-G162 PolarHBondContact O-N 2.84Å; G162-D164 PolarHBondContact O-N 3.23Å
163	V	42.5	Very low	41.7	Very low	127 Å²	127	136.8 Å²	136.8	77%	0.77	75%	0.746	S	S	*	*	S	Bend	trans	-67.5	110.7	154.4	178	0	0	0	0	104.9	K161	K161-V163 VanDerWaalsContact C-N 3.33Å; K161-V163 PolarHBondContact O-N 3.38Å
164	D	46.1	Very low	43.6	Very low	138 Å²	138	132.7 Å²	132.7	74%	0.738	73%	0.732	S	S	*	*	S	Bend	trans	61.7	114.6	-179.3	-56.8	-38.2	0	0	0	115.8	G162 K166	G162-D164 PolarHBondContact O-N 3.23Å; D164-K166 PolarHBondContact O-N 3.4Å
165	G	43.3	Very low	45.9	Very low	87 Å²	87	132.7 Å²	132.7	90%	0.897	72%	0.72	S	S	*	*			trans	-65.6	36.4	-172.3	0	0	0	0	0	117.4	R167	G165-R167 PolarHBondContact O-N 2.95Å
166	K	48.7	Very low	48.5	Very low	188 Å²	188	132 Å²	132	82%	0.817	70%	0.704	S	S	*	*			trans	-77	107.2	163	-86.3	178.9	177.5	173	0	108.5	D164 M168	D164-K166 PolarHBondContact O-N 3.4Å; K166-M168 PolarHBondContact O-N 3.32Å; K166-M168 VanDerWaalsContact O-N 3.11Å
167	R	46.9	Very low	50.8	Low	245 Å²	245	127.1 Å²	127.1	93%	0.925	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-53.2	121.1	158.5	-73	-170.5	-175.2	-170.8	2.6	107.2	G165 S169	G165-R167 PolarHBondContact O-N 2.95Å; R167-S169 PolarHBondContact O-N 3.23Å
168	M	53.7	Low	52.7	Low	78 Å²	78	123.1 Å²	123.1	38%	0.384	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-56.9	130.6	175	-63.4	-176.6	71.8	0	0	108.7	K166 E172 E176	K166-M168 PolarHBondContact O-N 3.32Å; K166-M168 VanDerWaalsContact O-N 3.11Å; M168-E172 HydrophobicContact CB-CB 4.26Å; M168-E172 HydrophobicContact CE-CB 4.1Å; M168-E172 HydrophobicContact CE-CG 3.73Å; M168-E176 HydrophobicContact CE-CB 4Å; M168-E176 HydrophobicContact CE-CG 4.49Å; M168-E176 WeakPolarHBondContact CE-OE2 3.24Å
169	S	60.1	Low	55.1	Low	63 Å²	63	121.5 Å²	121.5	44%	0.441	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-57.2	149.1	169.8	166.7	0	0	0	0	109.1	R167 L171 E172 A173	R167-S169 PolarHBondContact O-N 3.23Å; S169-L171 PolarHBondContact O-N 3.14Å; S169-L171 PolarHBondContact OG-N 2.9Å; S169-E172 WeakPolarHBondContact O-CA 3.16Å; S169-E172 WeakPolarHBondContact O-CB 3.37Å; S169-E172 PolarHBondContact O-N 3.16Å; S169-A173 PolarHBondContact O-N 3.41Å
170	N	60.1	Low	57.3	Low	151 Å²	151	121 Å²	121	81%	0.807	64%	0.639	S	S	*	*	H	α-helix	trans	-50.3	-31.7	172.6	-72.9	-13	0	0	0	111.9	F174	N170-F174 VanDerWaalsContact O-CB 3.3Å; N170-F174 WeakPolarHBondContact O-CB 3.39Å; N170-F174 PolarHBondContact O-N 3.23Å; N170-F174 VanDerWaalsContact O-N 3.08Å
171	L	59.8	Low	59.1	Low	125 Å²	125	119.2 Å²	119.2	65%	0.654	61%	0.612	S	S	*	*	H	α-helix	trans	-71	-35	174.8	-78.2	160	0	0	0	113.3	S169 K175	S169-L171 PolarHBondContact O-N 3.14Å; S169-L171 PolarHBondContact OG-N 2.9Å; L171-K175 VanDerWaalsContact O-CG 3.3Å; L171-K175 WeakPolarHBondContact O-CG 3.38Å; L171-K175 PolarHBondContact O-N 2.64Å
172	E	71.6	Confident	61.2	Low	101 Å²	101	116.1 Å²	116.1	47%	0.472	60%	0.6	S	S	.	*	H	α-helix	trans	-77.2	-41.7	-179.7	-157.1	174.9	-162	0	0	110.7	M168 S169 F174 K175 E176	M168-E172 HydrophobicContact CB-CB 4.26Å; M168-E172 HydrophobicContact CE-CB 4.1Å; M168-E172 HydrophobicContact CE-CG 3.73Å; S169-E172 WeakPolarHBondContact O-CA 3.16Å; S169-E172 WeakPolarHBondContact O-CB 3.37Å; S169-E172 PolarHBondContact O-N 3.16Å; E172-F174 VanDerWaalsContact C-N 3.26Å; E172-F174 PolarHBondContact O-N 3Å; E172-K175 PolarHBondContact O-N 3.08Å; E172-E176 WeakPolarHBondContact O-CB 3.32Å; E172-E176 PolarHBondContact O-N 2.9Å
173	A	71.4	Confident	63.4	Low	45 Å²	45	117.9 Å²	117.9	37%	0.372	59%	0.589	S	S	.	*	H	α-helix	trans	-58.5	-39.8	169.8	0	0	0	0	0	111.4	S169 E176 E177	S169-A173 PolarHBondContact O-N 3.41Å; A173-E176 PolarHBondContact O-N 2.86Å; A173-E177 WeakPolarHBondContact O-CB 3.47Å; A173-E177 PolarHBondContact O-N 3.46Å
174	F	63.3	Low	65	Low	129 Å²	129	115.8 Å²	115.8	57%	0.566	57%	0.571	S	S	*	*	H	α-helix	trans	-68.6	-39	175.7	-170.2	-105.7	0	0	0	112.9	N170 E172 L178	N170-F174 VanDerWaalsContact O-CB 3.3Å; N170-F174 WeakPolarHBondContact O-CB 3.39Å; N170-F174 PolarHBondContact O-N 3.23Å; N170-F174 VanDerWaalsContact O-N 3.08Å; E172-F174 VanDerWaalsContact C-N 3.26Å; E172-F174 PolarHBondContact O-N 3Å; F174-L178 HydrophobicContact CD1-CD1 3.73Å; F174-L178 HydrophobicContact CD1-CG 4.45Å; F174-L178 HydrophobicContact CE1-CD1 3.44Å; F174-L178 VanDerWaalsContact CE1-CD1 3.44Å; F174-L178 HydrophobicContact CE1-CG 4.17Å; F174-L178 HydrophobicContact CZ-CD1 4.14Å; F174-L178 HydrophobicContact CZ-CG 4.44Å; F174-L178 WeakPolarHBondContact O-CB 3.48Å; F174-L178 WeakPolarHBondContact O-CG 3.47Å; F174-L178 PolarHBondContact O-N 3.16Å
175	K	71	Confident	66	Low	148 Å²	148	115.4 Å²	115.4	64%	0.643	56%	0.56	S	S	*	*	H	α-helix	trans	-64.6	-40.3	174	-79	176.9	-178.7	-175.9	0	111.8	L171 E172 L178 K179	L171-K175 VanDerWaalsContact O-CG 3.3Å; L171-K175 WeakPolarHBondContact O-CG 3.38Å; L171-K175 PolarHBondContact O-N 2.64Å; E172-K175 PolarHBondContact O-N 3.08Å; K175-L178 PolarHBondContact O-N 3.18Å; K175-K179 WeakPolarHBondContact O-CB 3.44Å; K175-K179 PolarHBondContact O-N 2.94Å
176	E	76.3	Confident	67.7	Low	114 Å²	114	114 Å²	114	53%	0.533	54%	0.539	S	S	.	.	H	α-helix	trans	-68.9	-42.4	178.1	-166.5	176.7	-145.5	0	0	111.4	M168 E172 A173 L178 K179 R180	M168-E176 HydrophobicContact CE-CB 4Å; M168-E176 HydrophobicContact CE-CG 4.49Å; M168-E176 WeakPolarHBondContact CE-OE2 3.24Å; E172-E176 WeakPolarHBondContact O-CB 3.32Å; E172-E176 PolarHBondContact O-N 2.9Å; A173-E176 PolarHBondContact O-N 2.86Å; E176-L178 VanDerWaalsContact C-N 3.33Å; E176-L178 PolarHBondContact O-N 3.32Å; E176-K179 PolarHBondContact O-N 2.78Å; E176-R180 VanDerWaalsContact O-CB 3.31Å; E176-R180 WeakPolarHBondContact O-CB 3.46Å; E176-R180 PolarHBondContact O-N 3.28Å
177	E	71.9	Confident	69.1	Low	89 Å²	89	111.7 Å²	111.7	42%	0.416	53%	0.531	S	S	.	.	H	α-helix	trans	-58.9	-43.4	172.2	-178.1	69.9	179.9	0	0	111.4	A173 T181	A173-E177 WeakPolarHBondContact O-CB 3.47Å; A173-E177 PolarHBondContact O-N 3.46Å; E177-T181 WeakPolarHBondContact O-CB 3.48Å; E177-T181 PolarHBondContact O-N 2.81Å; E177-T181 PolarHBondContact O-OG1 3.07Å
178	L	67.8	Low	70.3	Confident	80 Å²	80	105.3 Å²	105.3	42%	0.419	51%	0.507	S	S	.	.	H	α-helix	trans	-63	-45.4	175.6	-84.8	169.2	0	0	0	112.2	F174 K175 E176 T181 Q182	F174-L178 HydrophobicContact CD1-CD1 3.73Å; F174-L178 HydrophobicContact CD1-CG 4.45Å; F174-L178 HydrophobicContact CE1-CD1 3.44Å; F174-L178 VanDerWaalsContact CE1-CD1 3.44Å; F174-L178 HydrophobicContact CE1-CG 4.17Å; F174-L178 HydrophobicContact CZ-CD1 4.14Å; F174-L178 HydrophobicContact CZ-CG 4.44Å; F174-L178 WeakPolarHBondContact O-CB 3.48Å; F174-L178 WeakPolarHBondContact O-CG 3.47Å; F174-L178 PolarHBondContact O-N 3.16Å; K175-L178 PolarHBondContact O-N 3.18Å; E176-L178 VanDerWaalsContact C-N 3.33Å; E176-L178 PolarHBondContact O-N 3.32Å; L178-T181 PolarHBondContact O-N 3.27Å; L178-Q182 WeakPolarHBondContact O-CG 3.31Å; L178-Q182 PolarHBondContact O-N 3.05Å
179	K	79.4	Confident	71.4	Confident	122 Å²	122	107 Å²	107	53%	0.53	51%	0.512	S	S	.	.	H	α-helix	trans	-62.4	-46.3	178.3	-175.6	-178.6	173.9	-170.2	0	110.9	K175 E176 T181 Q182 E183	K175-K179 WeakPolarHBondContact O-CB 3.44Å; K175-K179 PolarHBondContact O-N 2.94Å; E176-K179 PolarHBondContact O-N 2.78Å; K179-T181 VanDerWaalsContact C-N 3.32Å; K179-T181 PolarHBondContact O-N 2.87Å; K179-Q182 WeakPolarHBondContact O-CB 3.5Å; K179-Q182 PolarHBondContact O-N 3.28Å; K179-Q182 VanDerWaalsContact O-N 3.11Å; K179-E183 WeakPolarHBondContact CE-OE1 3.19Å; K179-E183 IonicContact NZ-OE1 2.92Å; K179-E183 WeakPolarHBondContact O-CG 3.31Å; K179-E183 PolarHBondContact O-N 2.61Å
180	R	76	Confident	72.3	Confident	168 Å²	168	112.5 Å²	112.5	63%	0.634	52%	0.524	S	S	*	.	H	α-helix	trans	-59.3	-43.3	175.4	-171.5	-179.4	-175.1	178.2	2.9	111.6	E176 Q182 E183 E184	E176-R180 VanDerWaalsContact O-CB 3.31Å; E176-R180 WeakPolarHBondContact O-CB 3.46Å; E176-R180 PolarHBondContact O-N 3.28Å; R180-Q182 VanDerWaalsContact C-N 3.3Å; R180-Q182 PolarHBondContact O-N 2.87Å; R180-E183 PolarHBondContact O-N 2.72Å; R180-E184 WeakPolarHBondContact O-CB 3.4Å; R180-E184 PolarHBondContact O-N 3.49Å
181	T	68.6	Low	73.2	Confident	45 Å²	45	108.7 Å²	108.7	28%	0.276	50%	0.503	S	S	.	.	H	α-helix	trans	-63.6	-36.3	176.2	-55.4	0	0	0	0	111.8	E177 L178 K179 R185	E177-T181 WeakPolarHBondContact O-CB 3.48Å; E177-T181 PolarHBondContact O-N 2.81Å; E177-T181 PolarHBondContact O-OG1 3.07Å; L178-T181 PolarHBondContact O-N 3.27Å; K179-T181 VanDerWaalsContact C-N 3.32Å; K179-T181 PolarHBondContact O-N 2.87Å; T181-R185 WeakPolarHBondContact O-CB 3.34Å; T181-R185 VanDerWaalsContact O-CG 3.24Å; T181-R185 WeakPolarHBondContact O-CG 3.38Å; T181-R185 PolarHBondContact O-N 3.26Å; T181-R185 VanDerWaalsContact O-N 3.11Å
182	Q	72.7	Confident	74.1	Confident	125 Å²	125	105 Å²	105	58%	0.584	48%	0.48	S	S	*	.	H	α-helix	trans	-70	-42.7	175.8	-75.5	174.6	-19.2	0	0	112.3	L178 K179 R180 R185 A186	L178-Q182 WeakPolarHBondContact O-CG 3.31Å; L178-Q182 PolarHBondContact O-N 3.05Å; K179-Q182 WeakPolarHBondContact O-CB 3.5Å; K179-Q182 PolarHBondContact O-N 3.28Å; K179-Q182 VanDerWaalsContact O-N 3.11Å; R180-Q182 VanDerWaalsContact C-N 3.3Å; R180-Q182 PolarHBondContact O-N 2.87Å; Q182-R185 WeakPolarHBondContact O-CB 3.5Å; Q182-R185 PolarHBondContact O-N 2.83Å; Q182-A186 PolarHBondContact O-N 3.2Å
183	E	80.4	Confident	74.6	Confident	107 Å²	107	104.9 Å²	104.9	50%	0.5	48%	0.48	S	S	.	.	H	α-helix	trans	-62.5	-46.6	176.2	-73.2	172.5	178	0	0	111	K179 R180 R185 A186 E187	K179-E183 WeakPolarHBondContact CE-OE1 3.19Å; K179-E183 IonicContact NZ-OE1 2.92Å; K179-E183 WeakPolarHBondContact O-CG 3.31Å; K179-E183 PolarHBondContact O-N 2.61Å; R180-E183 PolarHBondContact O-N 2.72Å; E183-R185 VanDerWaalsContact C-N 3.28Å; E183-R185 PolarHBondContact O-N 2.68Å; E183-A186 PolarHBondContact O-N 3.32Å; E183-A186 VanDerWaalsContact O-N 3.11Å; E183-E187 WeakPolarHBondContact O-CB 2.93Å; E183-E187 PolarHBondContact O-N 3.49Å
184	E	75.5	Confident	75.1	Confident	84 Å²	84	107.7 Å²	107.7	39%	0.393	49%	0.485	S	S	.	.	H	α-helix	trans	-60.8	-37.1	176	-167.3	-176.1	158.2	0	0	111.7	R180 R188	R180-E184 WeakPolarHBondContact O-CB 3.4Å; R180-E184 PolarHBondContact O-N 3.49Å; E184-R188 WeakPolarHBondContact O-CB 3.49Å; E184-R188 WeakPolarHBondContact O-CG 3.43Å; E184-R188 PolarHBondContact O-N 3.43Å; E184-R188 IonicContact OE1-CZ 2.78Å; E184-R188 IonicContact OE1-NH1 2.76Å; E184-R188 IonicContact OE1-NH2 3.35Å; E184-R188 PolarHBondContact OE1-NH2 3.3Å
185	R	67.7	Low	75.9	Confident	130 Å²	130	103 Å²	103	49%	0.491	47%	0.466	S	S	.	.	H	α-helix	trans	-66.8	-41.4	173.5	-78.4	174.8	-176.3	169.3	2	112.7	T181 Q182 E183 K189 L212	T181-R185 WeakPolarHBondContact O-CB 3.34Å; T181-R185 VanDerWaalsContact O-CG 3.24Å; T181-R185 WeakPolarHBondContact O-CG 3.38Å; T181-R185 PolarHBondContact O-N 3.26Å; T181-R185 VanDerWaalsContact O-N 3.11Å; Q182-R185 WeakPolarHBondContact O-CB 3.5Å; Q182-R185 PolarHBondContact O-N 2.83Å; E183-R185 VanDerWaalsContact C-N 3.28Å; E183-R185 PolarHBondContact O-N 2.68Å; R185-K189 WeakPolarHBondContact O-CB 3.42Å; R185-K189 PolarHBondContact O-N 3.43Å; R185-L212 HydrophobicContact CB-CD2 4.15Å; R185-L212 HydrophobicContact CG-CD2 4.05Å
186	A	78.3	Confident	76.3	Confident	56 Å²	56	101 Å²	101	46%	0.463	46%	0.459	S	S	.	.	H	α-helix	trans	-67.8	-40.1	178.3	0	0	0	0	0	111.5	Q182 E183 K189 R190	Q182-A186 PolarHBondContact O-N 3.2Å; E183-A186 PolarHBondContact O-N 3.32Å; E183-A186 VanDerWaalsContact O-N 3.11Å; A186-K189 PolarHBondContact O-N 3.28Å; A186-R190 PolarHBondContact O-N 3.27Å
187	E	78.4	Confident	76.6	Confident	141 Å²	141	103.6 Å²	103.6	66%	0.659	47%	0.471	S	S	*	.	H	α-helix	trans	-65.6	-44.2	175.9	-169	167.7	-153.8	0	0	111.3	E183 K189 R190 L191	E183-E187 WeakPolarHBondContact O-CB 2.93Å; E183-E187 PolarHBondContact O-N 3.49Å; E187-K189 VanDerWaalsContact C-N 3.34Å; E187-K189 PolarHBondContact O-N 2.69Å; E187-R190 PolarHBondContact O-N 2.66Å; E187-L191 WeakPolarHBondContact O-CB 3.19Å; E187-L191 PolarHBondContact O-N 3.49Å
188	R	72.2	Confident	77.1	Confident	110 Å²	110	107.7 Å²	107.7	42%	0.415	49%	0.488	S	S	.	.	H	α-helix	trans	-58.4	-43.3	171.8	-84.3	-172.5	179.8	134.7	17.8	112.8	E184 L191 R192	E184-R188 WeakPolarHBondContact O-CB 3.49Å; E184-R188 WeakPolarHBondContact O-CG 3.43Å; E184-R188 PolarHBondContact O-N 3.43Å; E184-R188 IonicContact OE1-CZ 2.78Å; E184-R188 IonicContact OE1-NH1 2.76Å; E184-R188 IonicContact OE1-NH2 3.35Å; E184-R188 PolarHBondContact OE1-NH2 3.3Å; R188-L191 PolarHBondContact O-N 3.13Å; R188-R192 WeakPolarHBondContact O-CB 3.43Å; R188-R192 PolarHBondContact O-N 3.38Å
189	K	76.3	Confident	77.6	Confident	113 Å²	113	106.9 Å²	106.9	49%	0.491	50%	0.499	S	S	.	.	H	α-helix	trans	-61.7	-46.2	178.1	-171.8	-179.5	175.8	-172.8	0	110.9	R185 A186 E187 R192 E193 L212	R185-K189 WeakPolarHBondContact O-CB 3.42Å; R185-K189 PolarHBondContact O-N 3.43Å; A186-K189 PolarHBondContact O-N 3.28Å; E187-K189 VanDerWaalsContact C-N 3.34Å; E187-K189 PolarHBondContact O-N 2.69Å; K189-R192 PolarHBondContact O-N 3.32Å; K189-E193 WeakPolarHBondContact CE-OE1 3.4Å; K189-E193 WeakPolarHBondContact O-CG 3.47Å; K189-E193 PolarHBondContact O-N 2.93Å; K189-L212 HydrophobicContact CB-CD1 4.44Å; K189-L212 HydrophobicContact CD-CD1 4.42Å; K189-L212 HydrophobicContact CG-CD1 4.43Å
190	R	80.8	Confident	77.5	Confident	179 Å²	179	104 Å²	104	68%	0.675	49%	0.488	S	S	*	.	H	α-helix	trans	-60.3	-46	175.1	-80.7	-172.4	175.3	-150.3	-0.8	112.5	A186 E187 R192 E193 Q194	A186-R190 PolarHBondContact O-N 3.27Å; E187-R190 PolarHBondContact O-N 2.66Å; R190-R192 VanDerWaalsContact C-N 3.32Å; R190-R192 PolarHBondContact O-N 3.39Å; R190-E193 PolarHBondContact O-N 2.68Å; R190-Q194 WeakPolarHBondContact O-CG 3.28Å; R190-Q194 PolarHBondContact O-N 3.19Å
191	L	78.3	Confident	77.5	Confident	72 Å²	72	99 Å²	99	38%	0.377	48%	0.483	S	S	.	.	H	α-helix	trans	-62.1	-42.8	179.8	-160	83.2	0	0	0	110.7	E187 R188 Q194 L195 I208 A209	E187-L191 WeakPolarHBondContact O-CB 3.19Å; E187-L191 PolarHBondContact O-N 3.49Å; R188-L191 PolarHBondContact O-N 3.13Å; L191-Q194 PolarHBondContact O-N 2.87Å; L191-L195 HydrophobicContact CD2-CD1 4.37Å; L191-L195 HydrophobicContact CG-CD1 4.25Å; L191-L195 WeakPolarHBondContact O-CB 3.42Å; L191-L195 VanDerWaalsContact O-CG 3.24Å; L191-L195 WeakPolarHBondContact O-CG 3.07Å; L191-L195 PolarHBondContact O-N 3.15Å; L191-I208 HydrophobicContact CD2-CG2 4.03Å; L191-A209 HydrophobicContact CD2-CB 4.46Å
192	R	78	Confident	77.7	Confident	46 Å²	46	104.1 Å²	104.1	17%	0.174	50%	0.502	C	S	.	.	H	α-helix	trans	-63	-44.1	177.5	-168.4	178.7	176.3	109.6	1.6	112.1	R188 K189 R190 L195 Q196 L205 D206 A209 P211	R188-R192 WeakPolarHBondContact O-CB 3.43Å; R188-R192 PolarHBondContact O-N 3.38Å; K189-R192 PolarHBondContact O-N 3.32Å; R190-R192 VanDerWaalsContact C-N 3.32Å; R190-R192 PolarHBondContact O-N 3.39Å; R192-L195 PolarHBondContact O-N 2.68Å; R192-Q196 WeakPolarHBondContact O-CB 3.3Å; R192-Q196 WeakPolarHBondContact O-CG 3.42Å; R192-Q196 PolarHBondContact O-N 2.72Å; R192-L205 HydrophobicContact CG-CD1 3.95Å; R192-L205 HydrophobicContact CG-CD2 4.05Å; R192-L205 HydrophobicContact CG-CG 4.11Å; R192-D206 IonicContact CZ-OD1 3.25Å; R192-D206 VanDerWaalsContact CZ-OD1 3.25Å; R192-D206 IonicContact NH1-OD1 3.98Å; R192-D206 PolarHBondContact NH1-OD1 3.33Å; R192-D206 IonicContact NH2-OD1 2.83Å; R192-D206 PolarHBondContact NH2-OD1 2.85Å; R192-A209 HydrophobicContact CB-CB 3.9Å; R192-A209 HydrophobicContact CG-CB 4.34Å; R192-A209 PolarHBondContact NH1-O 3.31Å; R192-P211 VanDerWaalsContact NH1-N 3.11Å
193	E	81.5	Confident	77.3	Confident	99 Å²	99	105.4 Å²	105.4	46%	0.463	51%	0.508	S	S	.	.	H	α-helix	trans	-60.6	-45.1	176.2	-74.1	169.1	-179.6	0	0	111.1	K189 R190 Q196 E197	K189-E193 WeakPolarHBondContact CE-OE1 3.4Å; K189-E193 WeakPolarHBondContact O-CG 3.47Å; K189-E193 PolarHBondContact O-N 2.93Å; R190-E193 PolarHBondContact O-N 2.68Å; E193-Q196 PolarHBondContact O-N 2.74Å; E193-E197 PolarHBondContact O-N 3.24Å
194	Q	82.9	Confident	76.7	Confident	105 Å²	105	102.6 Å²	102.6	49%	0.491	50%	0.499	S	S	.	.	H	α-helix	trans	-61.1	-47.5	175.6	-73.3	177.1	-11	0	0	112.3	R190 L191 Q196 E197 F198	R190-Q194 WeakPolarHBondContact O-CG 3.28Å; R190-Q194 PolarHBondContact O-N 3.19Å; L191-Q194 PolarHBondContact O-N 2.87Å; Q194-Q196 VanDerWaalsContact C-N 3.32Å; Q194-Q196 PolarHBondContact O-N 3.04Å; Q194-E197 WeakPolarHBondContact O-CB 3.43Å; Q194-E197 PolarHBondContact O-N 3.49Å; Q194-F198 WeakPolarHBondContact O-CD2 3.47Å; Q194-F198 PolarHBondContact O-N 2.07Å
195	L	79.9	Confident	76.4	Confident	30 Å²	30	98.7 Å²	98.7	16%	0.157	48%	0.481	C	S	.	.	H	α-helix	trans	-68.5	-30.6	-179.2	-65.8	176.1	0	0	0	112.6	L191 R192 F198 G199 I200 L205 I208	L191-L195 HydrophobicContact CD2-CD1 4.37Å; L191-L195 HydrophobicContact CG-CD1 4.25Å; L191-L195 WeakPolarHBondContact O-CB 3.42Å; L191-L195 VanDerWaalsContact O-CG 3.24Å; L191-L195 WeakPolarHBondContact O-CG 3.07Å; L191-L195 PolarHBondContact O-N 3.15Å; R192-L195 PolarHBondContact O-N 2.68Å; L195-F198 PolarHBondContact O-N 3.48Å; L195-G199 PolarHBondContact O-N 3.17Å; L195-I200 HydrophobicContact CB-CD1 4.05Å; L195-I200 HydrophobicContact CD2-CD1 3.57Å; L195-I200 HydrophobicContact CG-CD1 4.27Å; L195-I200 WeakPolarHBondContact O-CB 3.32Å; L195-I200 PolarHBondContact O-N 2.8Å; L195-L205 HydrophobicContact CB-CD1 3.39Å; L195-L205 HydrophobicContact CD1-CD1 4.06Å; L195-L205 HydrophobicContact CG-CD1 4.38Å; L195-I208 HydrophobicContact CD1-CB 4.02Å; L195-I208 HydrophobicContact CD1-CD1 4.29Å; L195-I208 HydrophobicContact CD1-CG2 3.54Å
196	Q	80.6	Confident	76.3	Confident	107 Å²	107	94.6 Å²	94.6	50%	0.5	47%	0.469	S	S	.	.	H	α-helix	trans	-67.8	-39.3	170.5	-80.9	-177.4	-35.4	0	0	112.1	R192 E193 Q194 F198 G199 L205	R192-Q196 WeakPolarHBondContact O-CB 3.3Å; R192-Q196 WeakPolarHBondContact O-CG 3.42Å; R192-Q196 PolarHBondContact O-N 2.72Å; E193-Q196 PolarHBondContact O-N 2.74Å; Q194-Q196 VanDerWaalsContact C-N 3.32Å; Q194-Q196 PolarHBondContact O-N 3.04Å; Q196-F198 VanDerWaalsContact C-N 3.27Å; Q196-F198 PolarHBondContact O-N 3.2Å; Q196-G199 PolarHBondContact O-N 3.41Å; Q196-L205 HydrophobicContact CG-CD1 4.32Å; Q196-L205 HydrophobicContact CG-CD2 3.38Å; Q196-L205 HydrophobicContact CG-CG 4.5Å
197	E	80.9	Confident	75.7	Confident	168 Å²	168	98.7 Å²	98.7	79%	0.785	48%	0.478	S	S	*	.	H	α-helix	trans	-63.2	-34.7	175.3	-167.4	174.3	-169.8	0	0	111.8	E193 Q194 G199	E193-E197 PolarHBondContact O-N 3.24Å; Q194-E197 WeakPolarHBondContact O-CB 3.43Å; Q194-E197 PolarHBondContact O-N 3.49Å; E197-G199 PolarHBondContact O-N 2.94Å
198	F	82.1	Confident	75.1	Confident	174 Å²	174	96.6 Å²	96.6	76%	0.763	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-0.9	171.8	-81.5	-72.9	0	0	0	114.8	Q194 L195 Q196 I200	Q194-F198 WeakPolarHBondContact O-CD2 3.47Å; Q194-F198 PolarHBondContact O-N 2.07Å; L195-F198 PolarHBondContact O-N 3.48Å; Q196-F198 VanDerWaalsContact C-N 3.27Å; Q196-F198 PolarHBondContact O-N 3.2Å; F198-I200 HydrophobicContact CB-CG1 4.44Å
199	G	79.3	Confident	74.8	Confident	64 Å²	64	91.4 Å²	91.4	66%	0.66	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	22.7	176.4	0	0	0	0	0	114.8	L195 Q196 E197 A201	L195-G199 PolarHBondContact O-N 3.17Å; Q196-G199 PolarHBondContact O-N 3.41Å; E197-G199 PolarHBondContact O-N 2.94Å; G199-A201 PolarHBondContact O-N 3.25Å
200	I	76.4	Confident	74	Confident	60 Å²	60	87.1 Å²	87.1	31%	0.308	44%	0.435	S	S	.	.			trans	-67.3	133.1	177	-61	-173.3	0	0	0	110	L195 F198 P204 L205	L195-I200 HydrophobicContact CB-CD1 4.05Å; L195-I200 HydrophobicContact CD2-CD1 3.57Å; L195-I200 HydrophobicContact CG-CD1 4.27Å; L195-I200 WeakPolarHBondContact O-CB 3.32Å; L195-I200 PolarHBondContact O-N 2.8Å; F198-I200 HydrophobicContact CB-CG1 4.44Å; I200-P204 HydrophobicContact CG2-CB 4.03Å; I200-P204 HydrophobicContact CG2-CG 3.78Å; I200-L205 HydrophobicContact CG2-CB 4.38Å
201	A	76.8	Confident	73	Confident	64 Å²	64	80.9 Å²	80.9	53%	0.529	42%	0.417	S	S	.	.			trans	-57.4	152.1	177.3	0	0	0	0	0	112.1	G199 E203 P204 L205	G199-A201 PolarHBondContact O-N 3.25Å; A201-E203 VanDerWaalsContact C-N 3.29Å; A201-E203 PolarHBondContact O-N 3.29Å; A201-P204 HydrophobicContact CB-CG 4.03Å; A201-P204 VanDerWaalsContact O-CD 3.22Å; A201-P204 WeakPolarHBondContact O-CD 3.45Å; A201-P204 WeakPolarHBondContact O-CG 3.3Å; A201-L205 WeakPolarHBondContact O-CB 3.25Å; A201-L205 PolarHBondContact O-N 2.69Å; A201-L205 VanDerWaalsContact O-N 3.08Å
202	K	72	Confident	71.9	Confident	152 Å²	152	82.1 Å²	82.1	66%	0.661	42%	0.424	S	S	*	.	H	α-helix	trans	-56.8	-39.1	-174	-167.7	179	178.8	-175.5	0	113.4	L205 D206	K202-L205 PolarHBondContact O-N 3.36Å; K202-D206 WeakPolarHBondContact O-CB 3.38Å; K202-D206 VanDerWaalsContact O-CG 3.3Å; K202-D206 PolarHBondContact O-N 3.39Å
203	E	66.2	Low	70.9	Confident	152 Å²	152	87.5 Å²	87.5	71%	0.71	46%	0.456	S	S	*	.	H	α-helix	trans	-64.4	-55.6	-179.2	-68.8	-174.2	166.9	0	0	113.7	A201 L205 D206 Q207	A201-E203 VanDerWaalsContact C-N 3.29Å; A201-E203 PolarHBondContact O-N 3.29Å; E203-L205 VanDerWaalsContact C-N 3.28Å; E203-L205 PolarHBondContact O-N 2.94Å; E203-D206 PolarHBondContact O-N 3.43Å; E203-Q207 WeakPolarHBondContact O-CG 3.42Å; E203-Q207 PolarHBondContact O-N 2.92Å
204	P	66.4	Low	69.2	Low	49 Å²	49	87.6 Å²	87.6	32%	0.318	46%	0.46	S	S	.	.	H	α-helix	trans	-64.7	-31.5	175	17.4	-26.6	0	0	0	112.8	I200 A201 Q207 I208	I200-P204 HydrophobicContact CG2-CB 4.03Å; I200-P204 HydrophobicContact CG2-CG 3.78Å; A201-P204 HydrophobicContact CB-CG 4.03Å; A201-P204 VanDerWaalsContact O-CD 3.22Å; A201-P204 WeakPolarHBondContact O-CD 3.45Å; A201-P204 WeakPolarHBondContact O-CG 3.3Å; P204-Q207 PolarHBondContact O-N 2.85Å; P204-I208 VanDerWaalsContact O-CG1 3.31Å; P204-I208 WeakPolarHBondContact O-CG1 3.33Å; P204-I208 PolarHBondContact O-N 3.29Å
205	L	69.9	Low	67.4	Low	2 Å²	2	86.6 Å²	86.6	1%	0.01	46%	0.463	C	S	.	.	H	α-helix	trans	-61.3	-46.5	173.4	-179.3	72.2	0	0	0	111.8	R192 L195 Q196 I200 A201 K202 E203 Q207 I208 A209	R192-L205 HydrophobicContact CG-CD1 3.95Å; R192-L205 HydrophobicContact CG-CD2 4.05Å; R192-L205 HydrophobicContact CG-CG 4.11Å; L195-L205 HydrophobicContact CB-CD1 3.39Å; L195-L205 HydrophobicContact CD1-CD1 4.06Å; L195-L205 HydrophobicContact CG-CD1 4.38Å; Q196-L205 HydrophobicContact CG-CD1 4.32Å; Q196-L205 HydrophobicContact CG-CD2 3.38Å; Q196-L205 HydrophobicContact CG-CG 4.5Å; I200-L205 HydrophobicContact CG2-CB 4.38Å; A201-L205 WeakPolarHBondContact O-CB 3.25Å; A201-L205 PolarHBondContact O-N 2.69Å; A201-L205 VanDerWaalsContact O-N 3.08Å; K202-L205 PolarHBondContact O-N 3.36Å; E203-L205 VanDerWaalsContact C-N 3.28Å; E203-L205 PolarHBondContact O-N 2.94Å; L205-Q207 PolarHBondContact O-N 3.42Å; L205-I208 PolarHBondContact O-N 2.93Å; L205-A209 CarbonylContact O-C 3.38Å; L205-A209 WeakPolarHBondContact O-CA 3.22Å; L205-A209 PolarHBondContact O-N 3Å
206	D	66.2	Low	65.8	Low	43 Å²	43	92.8 Å²	92.8	23%	0.23	49%	0.485	C	S	.	.	H	α-helix	trans	-68.2	-24.3	179.2	-73.2	-25.8	0	0	0	112.1	R192 K202 E203 P210	R192-D206 IonicContact CZ-OD1 3.25Å; R192-D206 VanDerWaalsContact CZ-OD1 3.25Å; R192-D206 IonicContact NH1-OD1 3.98Å; R192-D206 PolarHBondContact NH1-OD1 3.33Å; R192-D206 IonicContact NH2-OD1 2.83Å; R192-D206 PolarHBondContact NH2-OD1 2.85Å; K202-D206 WeakPolarHBondContact O-CB 3.38Å; K202-D206 VanDerWaalsContact O-CG 3.3Å; K202-D206 PolarHBondContact O-N 3.39Å; E203-D206 PolarHBondContact O-N 3.43Å; D206-P210 WeakPolarHBondContact O-CA 3.36Å
207	Q	65.2	Low	64.3	Low	142 Å²	142	90.6 Å²	90.6	66%	0.664	48%	0.476	S	S	*	.	H	α-helix	trans	-74.9	-39.3	171.7	-69.1	176.4	20.9	0	0	113.1	E203 P204 L205	E203-Q207 WeakPolarHBondContact O-CG 3.42Å; E203-Q207 PolarHBondContact O-N 2.92Å; P204-Q207 PolarHBondContact O-N 2.85Å; L205-Q207 PolarHBondContact O-N 3.42Å
208	I	65.5	Low	62.9	Low	97 Å²	97	84.6 Å²	84.6	50%	0.497	45%	0.454	S	S	.	.	H	α-helix	trans	-81.6	-41.1	-179.1	-61.3	163.4	0	0	0	111.1	L191 L195 P204 L205	L191-I208 HydrophobicContact CD2-CG2 4.03Å; L195-I208 HydrophobicContact CD1-CB 4.02Å; L195-I208 HydrophobicContact CD1-CD1 4.29Å; L195-I208 HydrophobicContact CD1-CG2 3.54Å; P204-I208 VanDerWaalsContact O-CG1 3.31Å; P204-I208 WeakPolarHBondContact O-CG1 3.33Å; P204-I208 PolarHBondContact O-N 3.29Å; L205-I208 PolarHBondContact O-N 2.93Å
209	A	65.3	Low	61.5	Low	1 Å²	1	81 Å²	81	1%	0.008	44%	0.443	C	S	.	.	S	Bend	trans	-141.4	79.4	-174.5	0	0	0	0	0	110.8	L191 R192 L205	L191-A209 HydrophobicContact CD2-CB 4.46Å; R192-A209 HydrophobicContact CB-CB 3.9Å; R192-A209 HydrophobicContact CG-CB 4.34Å; R192-A209 PolarHBondContact NH1-O 3.31Å; L205-A209 CarbonylContact O-C 3.38Å; L205-A209 WeakPolarHBondContact O-CA 3.22Å; L205-A209 PolarHBondContact O-N 3Å
210	P	60.6	Low	60.3	Low	24 Å²	24	81.1 Å²	81.1	16%	0.156	44%	0.438	C	S	.	.			trans	-58.9	155.1	-177.4	23.3	-36.6	0	0	0	114.2	D206 M217	D206-P210 WeakPolarHBondContact O-CA 3.36Å; P210-M217 HydrophobicContact CB-CG 3.44Å; P210-M217 VanDerWaalsContact CB-CG 3.44Å; P210-M217 HydrophobicContact CB-SD 3.43Å; P210-M217 WeakPolarHBondContact CB-SD 3.37Å; P210-M217 HydrophobicContact CG-CG 3.69Å; P210-M217 HydrophobicContact CG-SD 3.34Å; P210-M217 WeakPolarHBondContact CG-SD 3.06Å
211	P	59	Low	59.6	Low	47 Å²	47	81.7 Å²	81.7	31%	0.305	44%	0.437	S	S	.	.			trans	-60.8	141.8	-179.8	-18.4	28.7	0	0	0	112.7	R192 D213 N214	R192-P211 VanDerWaalsContact NH1-N 3.11Å; P211-D213 PolarHBondContact O-N 2.91Å; P211-N214 PolarHBondContact O-N 3.31Å
212	L	56	Low	58.9	Low	98 Å²	98	81.8 Å²	81.8	51%	0.513	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-31.3	176.5	-85	155.3	0	0	0	113.3	R185 K189 N214	R185-L212 HydrophobicContact CB-CD2 4.15Å; R185-L212 HydrophobicContact CG-CD2 4.05Å; K189-L212 HydrophobicContact CB-CD1 4.44Å; K189-L212 HydrophobicContact CD-CD1 4.42Å; K189-L212 HydrophobicContact CG-CD1 4.43Å; L212-N214 PolarHBondContact O-N 3.15Å
213	D	55.7	Low	58.5	Low	160 Å²	160	82.2 Å²	82.2	86%	0.856	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-10.3	-179.5	-65	-24.1	0	0	0	113.1	P211	P211-D213 PolarHBondContact O-N 2.91Å
214	N	46.2	Very low	58.5	Low	100 Å²	100	77.3 Å²	77.3	54%	0.535	42%	0.416	S	S	.	.			trans	-132.2	73.5	179.5	-148.7	15.7	0	0	0	111.8	P211 L212 Y216	P211-N214 PolarHBondContact O-N 3.31Å; L212-N214 PolarHBondContact O-N 3.15Å; N214-Y216 PolarHBondContact O-N 3Å; N214-Y216 VanDerWaalsContact O-N 3.15Å
215	P	45.8	Very low	58.6	Low	85 Å²	85	79.6 Å²	79.6	55%	0.552	43%	0.431	S	S	*	.			trans	-68.2	-12.3	-177.2	27.6	-34.3	0	0	0	113.7	M217	P215-M217 PolarHBondContact O-N 3.16Å
216	Y	46.6	Very low	58.7	Low	160 Å²	160	84 Å²	84	63%	0.627	46%	0.458	S	S	*	.			trans	-95.4	68.3	176.9	-58.6	-84.2	0	0	0	109.4	N214 A218	N214-Y216 PolarHBondContact O-N 3Å; N214-Y216 VanDerWaalsContact O-N 3.15Å; Y216-A218 PolarHBondContact O-N 2.63Å; Y216-A218 VanDerWaalsContact O-N 3.11Å
217	M	49.3	Very low	59.4	Low	61 Å²	61	82 Å²	82	30%	0.3	45%	0.447	S	S	.	.			trans	-58.3	121.5	163.9	-96.4	-162.1	83.4	0	0	108.1	P210 P215 N219 A220	P210-M217 HydrophobicContact CB-CG 3.44Å; P210-M217 VanDerWaalsContact CB-CG 3.44Å; P210-M217 HydrophobicContact CB-SD 3.43Å; P210-M217 WeakPolarHBondContact CB-SD 3.37Å; P210-M217 HydrophobicContact CG-CG 3.69Å; P210-M217 HydrophobicContact CG-SD 3.34Å; P210-M217 WeakPolarHBondContact CG-SD 3.06Å; P215-M217 PolarHBondContact O-N 3.16Å; M217-N219 PolarHBondContact O-N 3.17Å; M217-A220 PolarHBondContact O-N 3.45Å
218	A	50.4	Low	60.3	Low	41 Å²	41	75.5 Å²	75.5	34%	0.339	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-7.8	-173.7	0	0	0	0	0	115.5	Y216 F299	Y216-A218 PolarHBondContact O-N 2.63Å; Y216-A218 VanDerWaalsContact O-N 3.11Å; A218-F299 HydrophobicContact CB-CD1 3.7Å; A218-F299 HydrophobicContact CB-CE1 3.81Å
219	N	52.1	Low	61.4	Low	100 Å²	100	71.3 Å²	71.3	54%	0.535	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	-1.3	-170	-54	-16.7	0	0	0	114	M217 Y221 D222	M217-N219 PolarHBondContact O-N 3.17Å; N219-Y221 PolarHBondContact O-N 3.04Å; N219-D222 PolarHBondContact O-N 3.46Å
220	A	55.5	Low	62.5	Low	66 Å²	66	71.2 Å²	71.2	55%	0.545	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-30.3	-174.4	0	0	0	0	0	112.5	M217	M217-A220 PolarHBondContact O-N 3.45Å
221	Y	61.5	Low	63.8	Low	72 Å²	72	72.5 Å²	72.5	28%	0.282	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-9.8	-175.2	-57.9	-70.9	0	0	0	113.6	N219 L223 D224 T227	N219-Y221 PolarHBondContact O-N 3.04Å; Y221-L223 PolarHBondContact O-N 2.92Å; Y221-D224 PolarHBondContact O-N 2.75Å; Y221-T227 HydrophobicContact CD1-CG2 4.1Å; Y221-T227 HydrophobicContact CG-CG2 4.47Å; Y221-T227 PolarHBondContact O-OG1 2.99Å
222	D	61.9	Low	65	Low	66 Å²	66	70.3 Å²	70.3	35%	0.353	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-33.6	179.1	-73.8	30.1	0	0	0	111.9	N219	N219-D222 PolarHBondContact O-N 3.46Å
223	L	62.4	Low	66.3	Low	161 Å²	161	66.5 Å²	66.5	84%	0.843	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-6.3	-178.5	-60.6	175.7	0	0	0	113.5	Y221 P225	Y221-L223 PolarHBondContact O-N 2.92Å; L223-P225 VanDerWaalsContact O-CD 3.3Å; L223-P225 WeakPolarHBondContact O-CD 3.22Å
224	D	68.2	Low	67.4	Low	49 Å²	49	63.6 Å²	63.6	26%	0.262	35%	0.351	S	S	.	.			trans	-90	109.5	178.3	-178.2	-2	0	0	0	110.6	Y221 T226 T227 R282	Y221-D224 PolarHBondContact O-N 2.75Å; D224-T226 VanDerWaalsContact CG-OG1 3.24Å; D224-T226 PolarHBondContact O-N 3.31Å; D224-T226 VanDerWaalsContact O-N 3.08Å; D224-T226 WeakPolarHBondContact OD1-CB 3.45Å; D224-T226 PolarHBondContact OD1-N 3Å; D224-T226 PolarHBondContact OD1-OG1 2.93Å; D224-T226 PolarHBondContact OD2-OG1 3.28Å; D224-T226 VanDerWaalsContact OD2-OG1 3.11Å; D224-T227 HydrophobicContact CB-CG2 3.92Å; D224-T227 PolarHBondContact O-N 2.86Å; D224-T227 PolarHBondContact O-OG1 2.96Å; D224-T227 VanDerWaalsContact O-OG1 3.11Å; D224-T227 WeakPolarHBondContact OD2-CG2 3.42Å; D224-R282 PolarHBondContact O-NH1 3.37Å
225	P	67.1	Low	69.1	Low	97 Å²	97	59.4 Å²	59.4	63%	0.63	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-9.1	-178.8	30.3	-36.5	0	0	0	113.5	L223 R282	L223-P225 VanDerWaalsContact O-CD 3.3Å; L223-P225 WeakPolarHBondContact O-CD 3.22Å; P225-R282 WeakPolarHBondContact O-CG 3.24Å
226	T	72.3	Confident	70.8	Confident	94 Å²	94	58.4 Å²	58.4	58%	0.577	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-12.5	-177.4	72.4	0	0	0	0	113.8	D224 T228	D224-T226 VanDerWaalsContact CG-OG1 3.24Å; D224-T226 PolarHBondContact O-N 3.31Å; D224-T226 VanDerWaalsContact O-N 3.08Å; D224-T226 WeakPolarHBondContact OD1-CB 3.45Å; D224-T226 PolarHBondContact OD1-N 3Å; D224-T226 PolarHBondContact OD1-OG1 2.93Å; D224-T226 PolarHBondContact OD2-OG1 3.28Å; D224-T226 VanDerWaalsContact OD2-OG1 3.11Å; T226-T228 PolarHBondContact O-N 3.13Å
227	T	80.4	Confident	72.2	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.314	C	S	.	.			trans	-75.8	125.7	-178.4	56.8	0	0	0	0	111.4	Y221 D224 R282 P303	Y221-T227 HydrophobicContact CD1-CG2 4.1Å; Y221-T227 HydrophobicContact CG-CG2 4.47Å; Y221-T227 PolarHBondContact O-OG1 2.99Å; D224-T227 HydrophobicContact CB-CG2 3.92Å; D224-T227 PolarHBondContact O-N 2.86Å; D224-T227 PolarHBondContact O-OG1 2.96Å; D224-T227 VanDerWaalsContact O-OG1 3.11Å; D224-T227 WeakPolarHBondContact OD2-CG2 3.42Å; T227-R282 WeakPolarHBondContact O-CD 3.39Å; T227-R282 PolarHBondContact O-NH1 2.88Å; T227-R282 PolarHBondContact OG1-NH1 3.45Å; T227-P303 HydrophobicContact CG2-CB 4.01Å; T227-P303 HydrophobicContact CG2-CG 4.09Å
228	T	84.3	Confident	73.7	Confident	6 Å²	6	58.5 Å²	58.5	4%	0.037	34%	0.335	C	S	.	.			trans	-114.4	3.6	176.8	63.9	0	0	0	0	113.1	T226 A278 Y279 R282 I306	T226-T228 PolarHBondContact O-N 3.13Å; T228-A278 WeakPolarHBondContact O-CA 3.38Å; T228-Y279 VanDerWaalsContact CB-O 3.24Å; T228-Y279 WeakPolarHBondContact CB-O 3.49Å; T228-Y279 PolarHBondContact O-N 2.73Å; T228-Y279 PolarHBondContact OG1-O 3.3Å; T228-Y279 VanDerWaalsContact OG1-O 3.06Å; T228-R282 HydrophobicContact CG2-CB 4.26Å; T228-I306 HydrophobicContact CG2-CD1 4Å
229	N	88.9	Confident	75.4	Confident	9 Å²	9	57.5 Å²	57.5	5%	0.048	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	134.8	-173.5	-171.8	23.9	0	0	0	111.2	V277 A278 G301 K302 V304	N229-V277 PolarHBondContact OD1-O 2.98Å; N229-A278 HydrophobicContact CB-CB 4.28Å; N229-G301 PolarHBondContact O-N 3.49Å; N229-K302 WeakPolarHBondContact CB-O 3.17Å; N229-K302 PolarHBondContact ND2-O 2.88Å; N229-V304 HydrophobicContact CB-CG2 4.18Å; N229-V304 WeakPolarHBondContact ND2-CG2 3.23Å
230	L	88.6	Confident	77	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	130.9	178.8	-56.9	-178.2	0	0	0	109.2	F248 F276 V277 Y279 A285 A288 V289 F299 W300	L230-F248 HydrophobicContact CD1-CE1 4.5Å; L230-F276 CarbonylContact O-C 3.57Å; L230-F276 VanDerWaalsContact O-CA 3.28Å; L230-F276 WeakPolarHBondContact O-CA 3.15Å; L230-V277 PolarHBondContact N-O 3.37Å; L230-V277 PolarHBondContact O-N 2.87Å; L230-Y279 HydrophobicContact CD1-CD2 4.3Å; L230-Y279 HydrophobicContact CD1-CE2 3.87Å; L230-A285 HydrophobicContact CD1-CB 4.38Å; L230-A285 HydrophobicContact CD2-CB 4.33Å; L230-A285 HydrophobicContact CG-CB 4.36Å; L230-A288 HydrophobicContact CD1-CB 4.1Å; L230-V289 HydrophobicContact CD1-CG2 3.83Å; L230-V289 HydrophobicContact CD2-CG2 3.44Å; L230-V289 VanDerWaalsContact CD2-CG2 3.44Å; L230-V289 HydrophobicContact CG-CG2 4.3Å; L230-F299 CarbonylContact C-O 3.55Å; L230-F299 WeakPolarHBondContact CA-O 3.31Å; L230-W300 HydrophobicContact CD2-CD2 3.96Å; L230-W300 HydrophobicContact CD2-CE3 3.43Å; L230-W300 VanDerWaalsContact CD2-CE3 3.43Å; L230-W300 HydrophobicContact CD2-CH2 3.95Å; L230-W300 HydrophobicContact CD2-CZ2 4.4Å; L230-W300 HydrophobicContact CD2-CZ3 3.42Å; L230-W300 VanDerWaalsContact CD2-CZ3 3.42Å
231	F	86.6	Confident	78.5	Confident	51 Å²	51	57.4 Å²	57.4	22%	0.224	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	128.8	167.8	177.2	-114.5	0	0	0	109.4	A233 M260 T274 G275 F276 E298 F299	F231-A233 HydrophobicContact CD1-CB 4.45Å; F231-A233 HydrophobicContact CE1-CB 3.82Å; F231-A233 HydrophobicContact CZ-CB 4.41Å; F231-M260 HydrophobicContact CE2-CE 3.91Å; F231-T274 HydrophobicContact CE2-CG2 4.42Å; F231-T274 HydrophobicContact CZ-CG2 3.94Å; F231-G275 WeakPolarHBondContact CD2-O 3.45Å; F231-F276 HydrophobicContact CB-CD1 4.13Å; F231-F276 HydrophobicContact CB-CE1 3.76Å; F231-F276 HydrophobicContact CD2-CD1 4.11Å; F231-F276 AromaticContact CD2-CE1 3.55Å; F231-F276 HydrophobicContact CD2-CE1 3.55Å; F231-F276 HydrophobicContact CD2-CE2 4.02Å; F231-F276 AromaticContact CD2-CZ 3.5Å; F231-F276 HydrophobicContact CD2-CZ 3.5Å; F231-F276 VanDerWaalsContact CD2-CZ 3.5Å; F231-F276 HydrophobicContact CE2-CE2 4.41Å; F231-F276 HydrophobicContact CE2-CZ 4.14Å; F231-F276 HydrophobicContact CG-CE1 4.09Å; F231-F276 HydrophobicContact CG-CZ 4.39Å; F231-E298 WeakPolarHBondContact O-CA 3.42Å; F231-F299 HydrophobicContact CB-CB 4.39Å; F231-F299 HydrophobicContact CD1-CB 4.47Å; F231-F299 HydrophobicContact CD1-CD2 4.03Å; F231-F299 PolarHBondContact N-O 3.36Å; F231-F299 PolarHBondContact O-N 3.43Å
232	L	86.1	Confident	79.8	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	116.1	178.1	-55.3	-172.4	0	0	0	109.1	L235 I244 F248 T274 G275 V277 E298	L232-L235 HydrophobicContact CB-CD1 3.88Å; L232-L235 HydrophobicContact CB-CD2 4.04Å; L232-L235 HydrophobicContact CB-CG 4.04Å; L232-L235 HydrophobicContact CD1-CD1 4.29Å; L232-L235 HydrophobicContact CD1-CD2 4.24Å; L232-I244 HydrophobicContact CD1-CG2 4.13Å; L232-F248 HydrophobicContact CD1-CD2 4.22Å; L232-F248 HydrophobicContact CD1-CE1 4.39Å; L232-F248 HydrophobicContact CD1-CE2 3.47Å; L232-F248 VanDerWaalsContact CD1-CE2 3.47Å; L232-F248 HydrophobicContact CD1-CZ 3.6Å; L232-F248 HydrophobicContact CD2-CE1 3.66Å; L232-F248 HydrophobicContact CD2-CE2 4.06Å; L232-F248 HydrophobicContact CD2-CZ 3.25Å; L232-F248 HydrophobicContact CG-CE2 4.42Å; L232-F248 HydrophobicContact CG-CZ 4.07Å; L232-T274 CarbonylContact O-C 3.57Å; L232-T274 VanDerWaalsContact O-CA 3.29Å; L232-T274 WeakPolarHBondContact O-CA 3.19Å; L232-G275 PolarHBondContact N-O 3.12Å; L232-G275 PolarHBondContact O-N 3.01Å; L232-V277 HydrophobicContact CD1-CB 4.38Å; L232-V277 HydrophobicContact CD1-CG2 3.51Å; L232-V277 HydrophobicContact CG-CG2 4.24Å; L232-E298 HydrophobicContact CD2-CB 4.48Å; L232-E298 HydrophobicContact CD2-CG 3.89Å
233	A	81.4	Confident	81.1	Confident	18 Å²	18	60.3 Å²	60.3	15%	0.149	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	158	171	0	0	0	0	0	111.2	F231 N297	F231-A233 HydrophobicContact CD1-CB 4.45Å; F231-A233 HydrophobicContact CE1-CB 3.82Å; F231-A233 HydrophobicContact CZ-CB 4.41Å; A233-N297 HydrophobicContact CB-CB 4.27Å; A233-N297 PolarHBondContact N-O 3.46Å
234	N	79.4	Confident	82.4	Confident	99 Å²	99	52.7 Å²	52.7	53%	0.529	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	62.7	39.9	176.2	-163.3	35.9	0	0	0	113.9	C272	N234-C272 PolarHBondContact OD1-SG 3.27Å
235	L	82	Confident	83.4	Confident	12 Å²	12	52.3 Å²	52.3	6%	0.063	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	145	174.7	-64.5	178.4	0	0	0	110.9	L232 I239 I244 L273	L232-L235 HydrophobicContact CB-CD1 3.88Å; L232-L235 HydrophobicContact CB-CD2 4.04Å; L232-L235 HydrophobicContact CB-CG 4.04Å; L232-L235 HydrophobicContact CD1-CD1 4.29Å; L232-L235 HydrophobicContact CD1-CD2 4.24Å; L235-I239 HydrophobicContact CB-CG2 4.06Å; L235-I239 HydrophobicContact CD1-CG2 4.47Å; L235-I239 HydrophobicContact CD2-CD1 4.3Å; L235-I244 HydrophobicContact CD1-CD1 4.04Å; L235-L273 HydrophobicContact CB-CB 3.89Å; L235-L273 VanDerWaalsContact CB-O 3.31Å; L235-L273 WeakPolarHBondContact CB-O 3.25Å; L235-L273 PolarHBondContact N-O 3.45Å; L235-L273 PolarHBondContact O-N 3.05Å
236	S	81.7	Confident	84.4	Confident	63 Å²	63	51.6 Å²	51.6	44%	0.441	28%	0.277	S	S	.	.			trans	-59.2	138.5	174.2	179.9	0	0	0	0	110.4	E238 I239	S236-E238 PolarHBondContact O-N 3.28Å; S236-E238 VanDerWaalsContact O-N 3.17Å; S236-E238 PolarHBondContact OG-N 3.31Å; S236-I239 WeakPolarHBondContact O-CB 3.49Å; S236-I239 WeakPolarHBondContact O-CG2 2.87Å; S236-I239 PolarHBondContact O-N 3.22Å; S236-I239 VanDerWaalsContact O-N 3.07Å
237	P	75.7	Confident	85	Confident	65 Å²	65	50.3 Å²	50.3	42%	0.422	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-22.6	177.3	24.8	-34.5	0	0	0	113.7	P271	P237-P271 HydrophobicContact CB-CB 4.29Å; P237-P271 HydrophobicContact CB-CG 4.06Å; P237-P271 HydrophobicContact CG-CG 4.21Å
238	E	81	Confident	85.5	Confident	159 Å²	159	50.3 Å²	50.3	74%	0.743	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-3.9	179.7	-62.1	179.3	178.2	0	0	112.9	S236 N240	S236-E238 PolarHBondContact O-N 3.28Å; S236-E238 VanDerWaalsContact O-N 3.17Å; S236-E238 PolarHBondContact OG-N 3.31Å; E238-N240 PolarHBondContact O-N 2.95Å
239	I	85.4	Confident	85.6	Confident	19 Å²	19	50.1 Å²	50.1	10%	0.097	27%	0.265	C	S	.	.			trans	-69.4	130.3	-174.7	-154.6	171.1	0	0	0	111.2	L235 S236 E243 I244 I259 L273	L235-I239 HydrophobicContact CB-CG2 4.06Å; L235-I239 HydrophobicContact CD1-CG2 4.47Å; L235-I239 HydrophobicContact CD2-CD1 4.3Å; S236-I239 WeakPolarHBondContact O-CB 3.49Å; S236-I239 WeakPolarHBondContact O-CG2 2.87Å; S236-I239 PolarHBondContact O-N 3.22Å; S236-I239 VanDerWaalsContact O-N 3.07Å; I239-E243 HydrophobicContact CG1-CB 3.93Å; I239-I244 HydrophobicContact CD1-CD1 4.44Å; I239-I244 HydrophobicContact CD1-CG1 3.7Å; I239-I244 HydrophobicContact CG1-CG1 4.01Å; I239-I244 HydrophobicContact CG2-CD1 4.28Å; I239-I259 HydrophobicContact CG2-CD1 4.43Å; I239-L273 HydrophobicContact CG2-CD1 4.43Å
240	N	87.1	Confident	85.4	Confident	88 Å²	88	57.7 Å²	57.7	47%	0.471	30%	0.297	S	S	.	.			trans	-96.1	158.1	175.2	-64.9	-59.6	0	0	0	111.7	E238 E242 E243 I244	E238-N240 PolarHBondContact O-N 2.95Å; N240-E242 PolarHBondContact O-N 3.11Å; N240-E242 VanDerWaalsContact O-N 3.14Å; N240-E243 HydrophobicContact CB-CG 4.44Å; N240-E243 PolarHBondContact ND2-OE1 3.11Å; N240-E243 PolarHBondContact O-N 3.28Å; N240-I244 PolarHBondContact O-N 3.44Å; N240-I244 VanDerWaalsContact O-N 3.15Å
241	E	86.9	Confident	85.3	Confident	76 Å²	76	59.3 Å²	59.3	36%	0.355	30%	0.303	S	S	.	.	H	α-helix	trans	-56.7	-32.3	174.9	-65.5	-174.8	175.3	0	0	112.2	I244 R245 V257 I259	E241-I244 PolarHBondContact O-N 3.34Å; E241-R245 VanDerWaalsContact O-CG 3.31Å; E241-R245 WeakPolarHBondContact O-CG 3.17Å; E241-R245 PolarHBondContact O-N 3.44Å; E241-R245 IonicContact OE2-CZ 3.79Å; E241-R245 IonicContact OE2-NH2 2.88Å; E241-R245 PolarHBondContact OE2-NH2 3.42Å; E241-V257 HydrophobicContact CB-CG1 4.49Å; E241-I259 HydrophobicContact CB-CD1 4.46Å; E241-I259 HydrophobicContact CG-CD1 3.71Å; E241-I259 HydrophobicContact CG-CG1 4.07Å
242	E	88.5	Confident	85.3	Confident	104 Å²	104	56.9 Å²	56.9	49%	0.486	29%	0.293	S	S	.	.	H	α-helix	trans	-70	-35	178.6	-163	56.5	-147.5	0	0	112.9	N240 R245 C246	N240-E242 PolarHBondContact O-N 3.11Å; N240-E242 VanDerWaalsContact O-N 3.14Å; E242-R245 WeakPolarHBondContact O-CB 3.3Å; E242-R245 PolarHBondContact O-N 2.8Å; E242-R245 WeakPolarHBondContact OE2-CD 3.1Å; E242-R245 IonicContact OE2-CZ 3.76Å; E242-R245 IonicContact OE2-NE 2.87Å; E242-R245 IonicContact OE2-NH1 3.82Å; E242-R245 PolarHBondContact OE2-NH1 3.17Å; E242-C246 WeakPolarHBondContact O-CB 3.28Å; E242-C246 PolarHBondContact O-N 3.43Å
243	E	88.7	Confident	85.4	Confident	95 Å²	95	56.8 Å²	56.8	44%	0.444	29%	0.293	S	S	.	.	H	α-helix	trans	-68	-40.3	174.7	-68.5	166.7	-142.3	0	0	110.6	I239 N240 C246 L247	I239-E243 HydrophobicContact CG1-CB 3.93Å; N240-E243 HydrophobicContact CB-CG 4.44Å; N240-E243 PolarHBondContact ND2-OE1 3.11Å; N240-E243 PolarHBondContact O-N 3.28Å; E243-C246 PolarHBondContact O-N 3.27Å; E243-L247 VanDerWaalsContact O-CB 3.28Å; E243-L247 WeakPolarHBondContact O-CB 3.35Å; E243-L247 PolarHBondContact O-N 2.98Å
244	I	89.3	Confident	86	Confident	2 Å²	2	56 Å²	56	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-61.8	-45.2	172	-61.2	178.7	0	0	0	110.1	L232 L235 I239 N240 E241 C246 L247 F248 V257 I259 V277	L232-I244 HydrophobicContact CD1-CG2 4.13Å; L235-I244 HydrophobicContact CD1-CD1 4.04Å; I239-I244 HydrophobicContact CD1-CD1 4.44Å; I239-I244 HydrophobicContact CD1-CG1 3.7Å; I239-I244 HydrophobicContact CG1-CG1 4.01Å; I239-I244 HydrophobicContact CG2-CD1 4.28Å; N240-I244 PolarHBondContact O-N 3.44Å; N240-I244 VanDerWaalsContact O-N 3.15Å; E241-I244 PolarHBondContact O-N 3.34Å; I244-C246 VanDerWaalsContact C-N 3.31Å; I244-C246 PolarHBondContact O-N 3.17Å; I244-L247 PolarHBondContact O-N 3.28Å; I244-F248 HydrophobicContact CG2-CD2 3.7Å; I244-F248 HydrophobicContact CG2-CE2 4.22Å; I244-F248 WeakPolarHBondContact O-CB 3.45Å; I244-F248 WeakPolarHBondContact O-CD2 3.49Å; I244-F248 PolarHBondContact O-N 3.41Å; I244-V257 HydrophobicContact CB-CG1 4.08Å; I244-V257 HydrophobicContact CG2-CG1 3.7Å; I244-I259 HydrophobicContact CD1-CD1 3.68Å; I244-I259 HydrophobicContact CD1-CG1 3.61Å; I244-V277 HydrophobicContact CG2-CG2 3.39Å
245	R	90.2	Very high	86.5	Confident	41 Å²	41	51.5 Å²	51.5	16%	0.155	26%	0.262	C	S	.	.	H	α-helix	trans	-57.8	-43.5	175.5	-75.6	177.5	-162.6	104.1	12.7	111.7	E241 E242 G249 L254 V257 Y312	E241-R245 VanDerWaalsContact O-CG 3.31Å; E241-R245 WeakPolarHBondContact O-CG 3.17Å; E241-R245 PolarHBondContact O-N 3.44Å; E241-R245 IonicContact OE2-CZ 3.79Å; E241-R245 IonicContact OE2-NH2 2.88Å; E241-R245 PolarHBondContact OE2-NH2 3.42Å; E242-R245 WeakPolarHBondContact O-CB 3.3Å; E242-R245 PolarHBondContact O-N 2.8Å; E242-R245 WeakPolarHBondContact OE2-CD 3.1Å; E242-R245 IonicContact OE2-CZ 3.76Å; E242-R245 IonicContact OE2-NE 2.87Å; E242-R245 IonicContact OE2-NH1 3.82Å; E242-R245 PolarHBondContact OE2-NH1 3.17Å; R245-G249 WeakPolarHBondContact O-CA 3.31Å; R245-G249 PolarHBondContact O-N 2.84Å; R245-L254 HydrophobicContact CB-CD1 4.39Å; R245-L254 HydrophobicContact CG-CD1 4.24Å; R245-V257 HydrophobicContact CG-CG2 4.01Å; R245-Y312 HydrophobicContact CB-CD1 4.35Å; R245-Y312 HydrophobicContact CB-CD2 3.68Å; R245-Y312 HydrophobicContact CB-CE2 3.89Å; R245-Y312 HydrophobicContact CB-CG 3.89Å; R245-Y312 HydrophobicContact CG-CD2 4.02Å; R245-Y312 HydrophobicContact CG-CG 4.05Å; R245-Y312 WeakPolarHBondContact O-CE1 3.47Å
246	C	86.9	Confident	86.9	Confident	82 Å²	82	53.3 Å²	53.3	55%	0.554	28%	0.276	S	S	*	.	H	α-helix	trans	-65.7	-47.4	177.4	-171.5	0	0	0	0	112.1	E242 E243 I244 K250	E242-C246 WeakPolarHBondContact O-CB 3.28Å; E242-C246 PolarHBondContact O-N 3.43Å; E243-C246 PolarHBondContact O-N 3.27Å; I244-C246 VanDerWaalsContact C-N 3.31Å; I244-C246 PolarHBondContact O-N 3.17Å; C246-K250 PolarHBondContact O-N 2.86Å
247	L	86.4	Confident	87.3	Confident	66 Å²	66	51 Å²	51	35%	0.346	26%	0.259	S	S	.	.	H	α-helix	trans	-65.7	-50.8	-176.1	-171.2	72.5	0	0	0	112.1	E243 I244 L292 L295	E243-L247 VanDerWaalsContact O-CB 3.28Å; E243-L247 WeakPolarHBondContact O-CB 3.35Å; E243-L247 PolarHBondContact O-N 2.98Å; I244-L247 PolarHBondContact O-N 3.28Å; L247-L292 HydrophobicContact CD1-CD2 4.43Å; L247-L292 HydrophobicContact CD2-CD2 4.22Å; L247-L292 HydrophobicContact CG-CD2 4.16Å; L247-L295 HydrophobicContact CD1-CD2 4.23Å; L247-L295 HydrophobicContact CD2-CD2 4.07Å
248	F	89.3	Confident	88	Confident	1 Å²	1	54.1 Å²	54.1	0%	0.004	27%	0.266	C	S	.	.	H	α-helix	trans	-80.3	-28.5	-179.9	-75.8	-91.6	0	0	0	112	L230 L232 I244 K250 Y251 L254 V277 Y279 A288 L292	L230-F248 HydrophobicContact CD1-CE1 4.5Å; L232-F248 HydrophobicContact CD1-CD2 4.22Å; L232-F248 HydrophobicContact CD1-CE1 4.39Å; L232-F248 HydrophobicContact CD1-CE2 3.47Å; L232-F248 VanDerWaalsContact CD1-CE2 3.47Å; L232-F248 HydrophobicContact CD1-CZ 3.6Å; L232-F248 HydrophobicContact CD2-CE1 3.66Å; L232-F248 HydrophobicContact CD2-CE2 4.06Å; L232-F248 HydrophobicContact CD2-CZ 3.25Å; L232-F248 HydrophobicContact CG-CE2 4.42Å; L232-F248 HydrophobicContact CG-CZ 4.07Å; I244-F248 HydrophobicContact CG2-CD2 3.7Å; I244-F248 HydrophobicContact CG2-CE2 4.22Å; I244-F248 WeakPolarHBondContact O-CB 3.45Å; I244-F248 WeakPolarHBondContact O-CD2 3.49Å; I244-F248 PolarHBondContact O-N 3.41Å; F248-K250 PolarHBondContact O-N 2.96Å; F248-Y251 PolarHBondContact O-N 3.33Å; F248-Y251 VanDerWaalsContact O-N 3.08Å; F248-L254 HydrophobicContact CB-CD1 4.25Å; F248-L254 HydrophobicContact CB-CD2 4.17Å; F248-V277 HydrophobicContact CB-CG1 4.02Å; F248-V277 HydrophobicContact CD1-CB 4.5Å; F248-V277 HydrophobicContact CD1-CG1 4.16Å; F248-V277 HydrophobicContact CD2-CG2 4.31Å; F248-V277 HydrophobicContact CG-CG1 4.1Å; F248-V277 HydrophobicContact CG-CG2 4.31Å; F248-Y279 VanDerWaalsContact C-OH 3.3Å; F248-Y279 WeakPolarHBondContact CA-OH 3.25Å; F248-Y279 VanDerWaalsContact CB-OH 3.3Å; F248-Y279 WeakPolarHBondContact CB-OH 3.37Å; F248-Y279 HydrophobicContact CD1-CE2 4.32Å; F248-Y279 WeakPolarHBondContact CD1-OH 3.31Å; F248-Y279 PolarHBondContact O-OH 3.43Å; F248-A288 HydrophobicContact CD1-CB 4.36Å; F248-L292 HydrophobicContact CD1-CD1 3.65Å; F248-L292 HydrophobicContact CE1-CD1 3.29Å; F248-L292 HydrophobicContact CE2-CD1 4.32Å; F248-L292 HydrophobicContact CG-CD1 4.3Å; F248-L292 HydrophobicContact CZ-CD1 3.64Å
249	G	87.5	Confident	88.4	Confident	1 Å²	1	47 Å²	47	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-59.9	-25.3	177.1	0	0	0	0	0	114.4	R245 Y251 G252 P314	R245-G249 WeakPolarHBondContact O-CA 3.31Å; R245-G249 PolarHBondContact O-N 2.84Å; G249-Y251 PolarHBondContact O-N 3.19Å; G249-G252 WeakPolarHBondContact CA-O 3.24Å; G249-G252 PolarHBondContact O-N 2.74Å; G249-P314 WeakPolarHBondContact O-CB 3.47Å; G249-P314 WeakPolarHBondContact O-CG 3.18Å
250	K	85.6	Confident	88.3	Confident	168 Å²	168	49.6 Å²	49.6	73%	0.73	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.9	173.8	-174.6	-179.7	178.3	-175.5	0	113	C246 F248	C246-K250 PolarHBondContact O-N 2.86Å; F248-K250 PolarHBondContact O-N 2.96Å
251	Y	86.2	Confident	88	Confident	34 Å²	34	52.7 Å²	52.7	13%	0.133	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-24.8	-177.5	-59	-75.3	0	0	0	113.1	F248 G249 R287 A288 G291 L292	F248-Y251 PolarHBondContact O-N 3.33Å; F248-Y251 VanDerWaalsContact O-N 3.08Å; G249-Y251 PolarHBondContact O-N 3.19Å; Y251-R287 HydrophobicContact CD1-CB 4.25Å; Y251-R287 PolarHBondContact O-NH2 3.22Å; Y251-A288 HydrophobicContact CD2-CB 3.76Å; Y251-A288 HydrophobicContact CE2-CB 4.47Å; Y251-A288 HydrophobicContact CG-CB 3.85Å; Y251-G291 PolarHBondContact OH-O 2.89Å; Y251-L292 HydrophobicContact CD2-CD1 4.07Å; Y251-L292 HydrophobicContact CE2-CD1 3.48Å; Y251-L292 VanDerWaalsContact CE2-CD1 3.48Å; Y251-L292 HydrophobicContact CE2-CD2 4.39Å; Y251-L292 HydrophobicContact CE2-CG 3.65Å
252	G	86.8	Confident	87.2	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.258	C	S	.	.	S	Bend	trans	170.5	177.3	-177.8	0	0	0	0	0	113.9	G249	G249-G252 WeakPolarHBondContact CA-O 3.24Å; G249-G252 PolarHBondContact O-N 2.74Å
253	P	88.4	Confident	86.4	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.276	C	S	.	.			trans	-75.2	141.3	177.6	34.2	-33.5	0	0	0	110.9	Y279 M280 D284 P310 Y312 M317 Y459	P253-Y279 WeakPolarHBondContact O-CD1 3.4Å; P253-M280 HydrophobicContact CB-CG 4.15Å; P253-M280 HydrophobicContact CG-CB 4.09Å; P253-M280 HydrophobicContact CG-CG 4.04Å; P253-M280 PolarHBondContact O-N 3.41Å; P253-M280 VanDerWaalsContact O-N 3.16Å; P253-D284 WeakPolarHBondContact CD-OD2 3.33Å; P253-P310 HydrophobicContact CB-CB 4.14Å; P253-Y312 WeakPolarHBondContact CA-O 3.27Å; P253-M317 HydrophobicContact CG-CE 4.46Å; P253-Y459 HydrophobicContact CB-CD1 4.48Å; P253-Y459 HydrophobicContact CB-CE1 3.91Å; P253-Y459 HydrophobicContact CB-CE2 4.05Å; P253-Y459 HydrophobicContact CG-CD1 3.66Å; P253-Y459 HydrophobicContact CG-CD2 3.5Å; P253-Y459 VanDerWaalsContact CG-CD2 3.5Å; P253-Y459 HydrophobicContact CG-CE1 3.54Å; P253-Y459 HydrophobicContact CG-CE2 3.38Å; P253-Y459 HydrophobicContact CG-CG 3.63Å
254	L	92.3	Very high	85	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	129.3	-174.7	-49.1	179.3	0	0	0	110.2	R245 F248 V257 V277 A278 Y279 P310 V311 Y312	R245-L254 HydrophobicContact CB-CD1 4.39Å; R245-L254 HydrophobicContact CG-CD1 4.24Å; F248-L254 HydrophobicContact CB-CD1 4.25Å; F248-L254 HydrophobicContact CB-CD2 4.17Å; L254-V257 HydrophobicContact CB-CG2 4.23Å; L254-V257 HydrophobicContact CD1-CG2 3.56Å; L254-V277 HydrophobicContact CD1-CG1 4.32Å; L254-V277 HydrophobicContact CD2-CG1 3.76Å; L254-A278 CarbonylContact C-O 3.46Å; L254-A278 WeakPolarHBondContact CA-O 3.45Å; L254-Y279 HydrophobicContact CD2-CD1 3.67Å; L254-Y279 HydrophobicContact CD2-CD2 4.39Å; L254-Y279 HydrophobicContact CD2-CE1 3.35Å; L254-Y279 HydrophobicContact CD2-CE2 4.13Å; L254-Y279 HydrophobicContact CD2-CG 4.18Å; L254-P310 CarbonylContact O-C 3.5Å; L254-P310 WeakPolarHBondContact O-CA 3.46Å; L254-V311 PolarHBondContact O-N 2.81Å; L254-Y312 HydrophobicContact CD1-CD1 4.2Å; L254-Y312 HydrophobicContact CG-CD1 4.22Å; L254-Y312 PolarHBondContact N-O 2.77Å; L254-Y312 PolarHBondContact O-N 3.46Å
255	A	90.3	Very high	83.6	Confident	5 Å²	5	65.7 Å²	65.7	4%	0.041	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	-40.8	171.2	0	0	0	0	0	111.5	A278 M280 I306 P307 V311	A255-A278 WeakPolarHBondContact CA-O 3.41Å; A255-A278 HydrophobicContact CB-CB 4.06Å; A255-A278 WeakPolarHBondContact CB-O 3.42Å; A255-A278 PolarHBondContact N-O 3.28Å; A255-M280 VanDerWaalsContact CA-SD 3.57Å; A255-M280 HydrophobicContact CB-CG 4.41Å; A255-M280 HydrophobicContact CB-SD 3.61Å; A255-I306 HydrophobicContact CB-CG2 4.4Å; A255-P307 HydrophobicContact CB-CG 4.19Å; A255-V311 WeakPolarHBondContact O-CG2 3.45Å
256	S	90.4	Very high	82	Confident	50 Å²	50	69.6 Å²	69.6	35%	0.35	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	146.2	-179.5	-172.3	0	0	0	0	110.6	V277 A278	S256-V277 WeakPolarHBondContact O-CA 3.4Å; S256-A278 PolarHBondContact N-O 2.89Å; S256-A278 PolarHBondContact O-N 3.02Å
257	V	91.2	Very high	80.5	Confident	14 Å²	14	75 Å²	75	9%	0.085	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	130.4	171	178.7	0	0	0	0	106.6	E241 I244 R245 L254 F276 V277	E241-V257 HydrophobicContact CB-CG1 4.49Å; I244-V257 HydrophobicContact CB-CG1 4.08Å; I244-V257 HydrophobicContact CG2-CG1 3.7Å; R245-V257 HydrophobicContact CG-CG2 4.01Å; L254-V257 HydrophobicContact CB-CG2 4.23Å; L254-V257 HydrophobicContact CD1-CG2 3.56Å; V257-F276 WeakPolarHBondContact CA-O 3.46Å; V257-V277 HydrophobicContact CG1-CG2 4.32Å; V257-V277 HydrophobicContact CG2-CG2 4.35Å
258	K	89.5	Confident	78.9	Confident	132 Å²	132	83.7 Å²	83.7	57%	0.574	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145	122.5	179.5	-173.5	175.8	-176	179.2	0	111	G275 F276	K258-G275 CarbonylContact O-C 3.3Å; K258-G275 WeakPolarHBondContact O-CA 3.22Å; K258-F276 PolarHBondContact N-O 3.42Å; K258-F276 PolarHBondContact O-N 3.15Å
259	I	88.9	Confident	77.3	Confident	9 Å²	9	88.8 Å²	88.8	5%	0.046	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	135.4	171.8	-59.4	174.4	0	0	0	108.8	I239 E241 I244 W261 L273	I239-I259 HydrophobicContact CG2-CD1 4.43Å; E241-I259 HydrophobicContact CB-CD1 4.46Å; E241-I259 HydrophobicContact CG-CD1 3.71Å; E241-I259 HydrophobicContact CG-CG1 4.07Å; I244-I259 HydrophobicContact CD1-CD1 3.68Å; I244-I259 HydrophobicContact CD1-CG1 3.61Å; I259-W261 HydrophobicContact CB-CZ2 4.44Å; I259-W261 HydrophobicContact CD1-CZ2 4.41Å; I259-W261 HydrophobicContact CG2-CD2 4.21Å; I259-W261 HydrophobicContact CG2-CZ2 4.04Å; I259-L273 HydrophobicContact CG2-CB 4.5Å; I259-L273 HydrophobicContact CG2-CD1 4.23Å
260	M	84.1	Confident	75.7	Confident	73 Å²	73	97.4 Å²	97.4	36%	0.36	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	107.1	171.9	-62.6	-163.6	-58.1	0	0	109.2	F231 T274 F276	F231-M260 HydrophobicContact CE2-CE 3.91Å; M260-T274 WeakPolarHBondContact CA-O 2.86Å; M260-T274 WeakPolarHBondContact CB-O 3.4Å; M260-T274 WeakPolarHBondContact CE-OG1 3.24Å; M260-T274 PolarHBondContact N-O 3.13Å; M260-F276 HydrophobicContact CE-CE2 3.84Å; M260-F276 HydrophobicContact SD-CD2 4.28Å; M260-F276 HydrophobicContact SD-CE2 3.74Å
261	W	80	Confident	74.6	Confident	154 Å²	154	93.2 Å²	93.2	58%	0.583	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-79	134.6	176.1	-57.7	96	0	0	0	110.3	I259 L273	I259-W261 HydrophobicContact CB-CZ2 4.44Å; I259-W261 HydrophobicContact CD1-CZ2 4.41Å; I259-W261 HydrophobicContact CG2-CD2 4.21Å; I259-W261 HydrophobicContact CG2-CZ2 4.04Å; W261-L273 HydrophobicContact CE3-CD1 4.15Å; W261-L273 HydrophobicContact CE3-CD2 3.87Å; W261-L273 HydrophobicContact CH2-CD1 4.13Å; W261-L273 HydrophobicContact CZ3-CD1 3.65Å; W261-L273 HydrophobicContact CZ3-CD2 4.18Å
262	P	71.7	Confident	73.8	Confident	78 Å²	78	94.7 Å²	94.7	51%	0.506	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-61.7	141.4	175.9	26	-33.4	0	0	0	110	L273	P262-L273 HydrophobicContact CG-CD2 4.41Å
263	R	70.1	Confident	73.5	Confident	229 Å²	229	95 Å²	95	86%	0.864	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-86.5	120.6	172.8	-65.9	179.3	177.4	-179.9	-1.6	107.7	G265	R263-G265 PolarHBondContact O-N 3.14Å
264	N	59.7	Low	73.3	Confident	179 Å²	179	97 Å²	97	96%	0.957	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-10.5	31.1	175.2	-58.4	0.5	0	0	0	122.1
265	G	60.6	Low	73.1	Confident	63 Å²	63	97 Å²	97	65%	0.649	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.3	-11.5	-175.8	0	0	0	0	0	115.6	R263	R263-G265 PolarHBondContact O-N 3.14Å
266	D	56.5	Low	73.1	Confident	124 Å²	124	98.6 Å²	98.6	66%	0.663	49%	0.493	S	S	*	.			trans	-103.1	25.5	-176	-78.4	-33.6	0	0	0	114	R268 V269	D266-R268 PolarHBondContact O-N 2.87Å; D266-V269 PolarHBondContact O-N 3.29Å
267	E	54.2	Low	73.2	Confident	195 Å²	195	96.2 Å²	96.2	91%	0.911	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-18.3	-179.8	-94.1	-175	164.1	0	0	114.7	V269	E267-V269 VanDerWaalsContact C-N 3.29Å; E267-V269 PolarHBondContact O-N 3.25Å
268	R	53.9	Low	73.2	Confident	249 Å²	249	95.7 Å²	95.7	94%	0.94	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-11.5	-175.5	-58.2	-173.6	-159.5	-173	5.5	113.8	D266	D266-R268 PolarHBondContact O-N 2.87Å
269	V	55.1	Low	73.4	Confident	108 Å²	108	89.4 Å²	89.4	66%	0.655	45%	0.446	S	S	*	.	S	Bend	trans	-110.6	128.4	175.6	-168.2	0	0	0	0	107.1	D266 E267	D266-V269 PolarHBondContact O-N 3.29Å; E267-V269 VanDerWaalsContact C-N 3.29Å; E267-V269 PolarHBondContact O-N 3.25Å
270	K	55	Low	73.3	Confident	181 Å²	181	89.8 Å²	89.8	79%	0.787	45%	0.448	S	S	*	.			trans	-37.9	128.4	177	-75.2	178.2	174.6	179.3	0	109.5	C272	K270-C272 PolarHBondContact O-N 3.49Å
271	P	61.8	Low	73.3	Confident	81 Å²	81	87.9 Å²	87.9	53%	0.526	44%	0.44	S	S	.	.			trans	-73.5	75.2	-166.9	31.2	-36.5	0	0	0	110.2	P237 L273	P237-P271 HydrophobicContact CB-CB 4.29Å; P237-P271 HydrophobicContact CB-CG 4.06Å; P237-P271 HydrophobicContact CG-CG 4.21Å; P271-L273 PolarHBondContact O-N 3.11Å
272	C	69.4	Low	73.6	Confident	64 Å²	64	82.3 Å²	82.3	43%	0.432	42%	0.419	S	S	.	.			trans	-78.7	110.8	168.7	-70.2	0	0	0	0	106.7	N234 K270	N234-C272 PolarHBondContact OD1-SG 3.27Å; K270-C272 PolarHBondContact O-N 3.49Å
273	L	79.6	Confident	74.2	Confident	6 Å²	6	82.4 Å²	82.4	3%	0.031	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	152.9	173.9	-67.8	176.7	0	0	0	109.5	L235 I239 I259 W261 P262 P271	L235-L273 HydrophobicContact CB-CB 3.89Å; L235-L273 VanDerWaalsContact CB-O 3.31Å; L235-L273 WeakPolarHBondContact CB-O 3.25Å; L235-L273 PolarHBondContact N-O 3.45Å; L235-L273 PolarHBondContact O-N 3.05Å; I239-L273 HydrophobicContact CG2-CD1 4.43Å; I259-L273 HydrophobicContact CG2-CB 4.5Å; I259-L273 HydrophobicContact CG2-CD1 4.23Å; W261-L273 HydrophobicContact CE3-CD1 4.15Å; W261-L273 HydrophobicContact CE3-CD2 3.87Å; W261-L273 HydrophobicContact CH2-CD1 4.13Å; W261-L273 HydrophobicContact CZ3-CD1 3.65Å; W261-L273 HydrophobicContact CZ3-CD2 4.18Å; P262-L273 HydrophobicContact CG-CD2 4.41Å; P271-L273 PolarHBondContact O-N 3.11Å
274	T	85.2	Confident	75.1	Confident	42 Å²	42	71.6 Å²	71.6	26%	0.258	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	154	172.4	56.3	0	0	0	0	108.7	F231 L232 M260	F231-T274 HydrophobicContact CE2-CG2 4.42Å; F231-T274 HydrophobicContact CZ-CG2 3.94Å; L232-T274 CarbonylContact O-C 3.57Å; L232-T274 VanDerWaalsContact O-CA 3.29Å; L232-T274 WeakPolarHBondContact O-CA 3.19Å; M260-T274 WeakPolarHBondContact CA-O 2.86Å; M260-T274 WeakPolarHBondContact CB-O 3.4Å; M260-T274 WeakPolarHBondContact CE-OG1 3.24Å; M260-T274 PolarHBondContact N-O 3.13Å
275	G	88.3	Confident	76.4	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	178.1	-176.2	0	0	0	0	0	113.3	F231 L232 K258	F231-G275 WeakPolarHBondContact CD2-O 3.45Å; L232-G275 PolarHBondContact N-O 3.12Å; L232-G275 PolarHBondContact O-N 3.01Å; K258-G275 CarbonylContact O-C 3.3Å; K258-G275 WeakPolarHBondContact O-CA 3.22Å
276	F	91.1	Very high	77.6	Confident	40 Å²	40	63.9 Å²	63.9	18%	0.175	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	140.8	176	-70.6	-82.2	0	0	0	110.7	L230 F231 V257 K258 M260	L230-F276 CarbonylContact O-C 3.57Å; L230-F276 VanDerWaalsContact O-CA 3.28Å; L230-F276 WeakPolarHBondContact O-CA 3.15Å; F231-F276 HydrophobicContact CB-CD1 4.13Å; F231-F276 HydrophobicContact CB-CE1 3.76Å; F231-F276 HydrophobicContact CD2-CD1 4.11Å; F231-F276 AromaticContact CD2-CE1 3.55Å; F231-F276 HydrophobicContact CD2-CE1 3.55Å; F231-F276 HydrophobicContact CD2-CE2 4.02Å; F231-F276 AromaticContact CD2-CZ 3.5Å; F231-F276 HydrophobicContact CD2-CZ 3.5Å; F231-F276 VanDerWaalsContact CD2-CZ 3.5Å; F231-F276 HydrophobicContact CE2-CE2 4.41Å; F231-F276 HydrophobicContact CE2-CZ 4.14Å; F231-F276 HydrophobicContact CG-CE1 4.09Å; F231-F276 HydrophobicContact CG-CZ 4.39Å; V257-F276 WeakPolarHBondContact CA-O 3.46Å; K258-F276 PolarHBondContact N-O 3.42Å; K258-F276 PolarHBondContact O-N 3.15Å; M260-F276 HydrophobicContact CE-CE2 3.84Å; M260-F276 HydrophobicContact SD-CD2 4.28Å; M260-F276 HydrophobicContact SD-CE2 3.74Å
277	V	91.7	Very high	79	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	118.4	172.1	174.3	0	0	0	0	108.7	N229 L230 L232 I244 F248 L254 S256 V257 Y279	N229-V277 PolarHBondContact OD1-O 2.98Å; L230-V277 PolarHBondContact N-O 3.37Å; L230-V277 PolarHBondContact O-N 2.87Å; L232-V277 HydrophobicContact CD1-CB 4.38Å; L232-V277 HydrophobicContact CD1-CG2 3.51Å; L232-V277 HydrophobicContact CG-CG2 4.24Å; I244-V277 HydrophobicContact CG2-CG2 3.39Å; F248-V277 HydrophobicContact CB-CG1 4.02Å; F248-V277 HydrophobicContact CD1-CB 4.5Å; F248-V277 HydrophobicContact CD1-CG1 4.16Å; F248-V277 HydrophobicContact CD2-CG2 4.31Å; F248-V277 HydrophobicContact CG-CG1 4.1Å; F248-V277 HydrophobicContact CG-CG2 4.31Å; L254-V277 HydrophobicContact CD1-CG1 4.32Å; L254-V277 HydrophobicContact CD2-CG1 3.76Å; S256-V277 WeakPolarHBondContact O-CA 3.4Å; V257-V277 HydrophobicContact CG1-CG2 4.32Å; V257-V277 HydrophobicContact CG2-CG2 4.35Å; V277-Y279 HydrophobicContact CG1-CD2 4.47Å; V277-Y279 HydrophobicContact CG1-CE2 4.08Å
278	A	91.5	Very high	80.5	Confident	3 Å²	3	50.9 Å²	50.9	3%	0.025	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	132.9	174.3	0	0	0	0	0	110.4	T228 N229 L254 A255 S256	T228-A278 WeakPolarHBondContact O-CA 3.38Å; N229-A278 HydrophobicContact CB-CB 4.28Å; L254-A278 CarbonylContact C-O 3.46Å; L254-A278 WeakPolarHBondContact CA-O 3.45Å; A255-A278 WeakPolarHBondContact CA-O 3.41Å; A255-A278 HydrophobicContact CB-CB 4.06Å; A255-A278 WeakPolarHBondContact CB-O 3.42Å; A255-A278 PolarHBondContact N-O 3.28Å; S256-A278 PolarHBondContact N-O 2.89Å; S256-A278 PolarHBondContact O-N 3.02Å
279	Y	92.2	Very high	82	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	156.4	171.8	-76.2	-92.1	0	0	0	111.5	T228 L230 F248 P253 L254 V277 T281 D284 A285 A288	T228-Y279 VanDerWaalsContact CB-O 3.24Å; T228-Y279 WeakPolarHBondContact CB-O 3.49Å; T228-Y279 PolarHBondContact O-N 2.73Å; T228-Y279 PolarHBondContact OG1-O 3.3Å; T228-Y279 VanDerWaalsContact OG1-O 3.06Å; L230-Y279 HydrophobicContact CD1-CD2 4.3Å; L230-Y279 HydrophobicContact CD1-CE2 3.87Å; F248-Y279 VanDerWaalsContact C-OH 3.3Å; F248-Y279 WeakPolarHBondContact CA-OH 3.25Å; F248-Y279 VanDerWaalsContact CB-OH 3.3Å; F248-Y279 WeakPolarHBondContact CB-OH 3.37Å; F248-Y279 HydrophobicContact CD1-CE2 4.32Å; F248-Y279 WeakPolarHBondContact CD1-OH 3.31Å; F248-Y279 PolarHBondContact O-OH 3.43Å; P253-Y279 WeakPolarHBondContact O-CD1 3.4Å; L254-Y279 HydrophobicContact CD2-CD1 3.67Å; L254-Y279 HydrophobicContact CD2-CD2 4.39Å; L254-Y279 HydrophobicContact CD2-CE1 3.35Å; L254-Y279 HydrophobicContact CD2-CE2 4.13Å; L254-Y279 HydrophobicContact CD2-CG 4.18Å; V277-Y279 HydrophobicContact CG1-CD2 4.47Å; V277-Y279 HydrophobicContact CG1-CE2 4.08Å; Y279-T281 WeakPolarHBondContact CB-O 3.41Å; Y279-T281 PolarHBondContact O-N 3.39Å; Y279-D284 HydrophobicContact CD1-CB 3.5Å; Y279-D284 VanDerWaalsContact CD1-CB 3.5Å; Y279-D284 HydrophobicContact CE1-CB 4.12Å; Y279-D284 HydrophobicContact CG-CB 4.03Å; Y279-A285 HydrophobicContact CD2-CB 3.64Å; Y279-A285 HydrophobicContact CE2-CB 4.38Å; Y279-A285 HydrophobicContact CG-CB 4.11Å; Y279-A288 HydrophobicContact CE2-CB 3.71Å; Y279-A288 WeakPolarHBondContact OH-CB 3.4Å
280	M	87	Confident	83.3	Confident	17 Å²	17	38.6 Å²	38.6	8%	0.084	20%	0.202	C	C	.	.	S	Bend	trans	-68.2	-26.8	171.5	-60.5	-65.8	-90.4	0	0	112.1	P253 A255 I306 P307 Y309 P310 Y459	P253-M280 HydrophobicContact CB-CG 4.15Å; P253-M280 HydrophobicContact CG-CB 4.09Å; P253-M280 HydrophobicContact CG-CG 4.04Å; P253-M280 PolarHBondContact O-N 3.41Å; P253-M280 VanDerWaalsContact O-N 3.16Å; A255-M280 VanDerWaalsContact CA-SD 3.57Å; A255-M280 HydrophobicContact CB-CG 4.41Å; A255-M280 HydrophobicContact CB-SD 3.61Å; M280-I306 HydrophobicContact CE-CG2 4.25Å; M280-I306 HydrophobicContact SD-CG2 3.73Å; M280-P307 VanDerWaalsContact CE-O 3.3Å; M280-P307 WeakPolarHBondContact CE-O 3.26Å; M280-P307 HydrophobicContact SD-CG 4.28Å; M280-Y309 VanDerWaalsContact CE-C 3.47Å; M280-P310 HydrophobicContact CE-CB 4Å; M280-P310 HydrophobicContact CE-CG 4.47Å; M280-P310 HydrophobicContact CG-CB 3.92Å; M280-P310 HydrophobicContact SD-CB 4.05Å; M280-Y459 HydrophobicContact CB-CD2 3.99Å; M280-Y459 HydrophobicContact CB-CE2 3.72Å; M280-Y459 HydrophobicContact CG-CE2 3.87Å
281	T	85	Confident	84.5	Confident	32 Å²	32	32.1 Å²	32.1	20%	0.196	19%	0.187	C	C	.	.	S	Bend	trans	-133.1	146.4	178.3	84.7	0	0	0	0	112.4	Y279 K283 D284 A285 Y459	Y279-T281 WeakPolarHBondContact CB-O 3.41Å; Y279-T281 PolarHBondContact O-N 3.39Å; T281-K283 VanDerWaalsContact C-N 3.31Å; T281-K283 PolarHBondContact O-N 3.18Å; T281-D284 PolarHBondContact O-N 3.36Å; T281-D284 PolarHBondContact OG1-N 2.63Å; T281-D284 PolarHBondContact OG1-OD1 3.26Å; T281-D284 PolarHBondContact OG1-OD2 3.11Å; T281-A285 PolarHBondContact O-N 2.9Å; T281-Y459 HydrophobicContact CG2-CD2 4.05Å
282	R	85.7	Confident	85.3	Confident	38 Å²	38	28.7 Å²	28.7	14%	0.143	16%	0.164	C	C	.	.	H	α-helix	trans	-56.6	-43.2	177.5	173.4	67.1	-171.9	-164.2	-3.3	112.5	D224 P225 T227 T228 D284 A285 E286 W300	D224-R282 PolarHBondContact O-NH1 3.37Å; P225-R282 WeakPolarHBondContact O-CG 3.24Å; T227-R282 WeakPolarHBondContact O-CD 3.39Å; T227-R282 PolarHBondContact O-NH1 2.88Å; T227-R282 PolarHBondContact OG1-NH1 3.45Å; T228-R282 HydrophobicContact CG2-CB 4.26Å; R282-D284 PolarHBondContact O-N 3.1Å; R282-A285 WeakPolarHBondContact O-CB 3.19Å; R282-A285 PolarHBondContact O-N 2.97Å; R282-A285 VanDerWaalsContact O-N 3.14Å; R282-E286 HydrophobicContact CG-CG 4.34Å; R282-E286 WeakPolarHBondContact CG-OE1 3.38Å; R282-E286 IonicContact CZ-OE1 3.61Å; R282-E286 IonicContact NE-OE1 2.75Å; R282-E286 PolarHBondContact NE-OE1 3.48Å; R282-E286 IonicContact NH2-OE1 3.77Å; R282-E286 WeakPolarHBondContact O-CG 3.14Å; R282-E286 PolarHBondContact O-N 3.41Å; R282-W300 VanDerWaalsContact CZ-CZ3 3.4Å; R282-W300 VanDerWaalsContact NH1-CH2 3.25Å
283	K	85.5	Confident	85.3	Confident	80 Å²	80	33.1 Å²	33.1	35%	0.348	18%	0.176	S	C	.	.	H	α-helix	trans	-61.7	-30.6	-177.8	-67	-168.9	176.5	-163.4	0	112.7	T281 R287 R461	T281-K283 VanDerWaalsContact C-N 3.31Å; T281-K283 PolarHBondContact O-N 3.18Å; K283-R287 WeakPolarHBondContact O-CG 3.47Å; K283-R287 PolarHBondContact O-N 2.85Å; K283-R287 PolarHBondContact O-NH1 3.11Å; K283-R461 HydrophobicContact CD-CB 4.43Å; K283-R461 HydrophobicContact CD-CG 4.25Å; K283-R461 WeakPolarHBondContact CD-O 3.37Å
284	D	88.2	Confident	84.5	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-75.4	-39.2	178.7	-55.3	-24.8	0	0	0	110.6	P253 Y279 T281 R282 R287 A288	P253-D284 WeakPolarHBondContact CD-OD2 3.33Å; Y279-D284 HydrophobicContact CD1-CB 3.5Å; Y279-D284 VanDerWaalsContact CD1-CB 3.5Å; Y279-D284 HydrophobicContact CE1-CB 4.12Å; Y279-D284 HydrophobicContact CG-CB 4.03Å; T281-D284 PolarHBondContact O-N 3.36Å; T281-D284 PolarHBondContact OG1-N 2.63Å; T281-D284 PolarHBondContact OG1-OD1 3.26Å; T281-D284 PolarHBondContact OG1-OD2 3.11Å; R282-D284 PolarHBondContact O-N 3.1Å; D284-R287 PolarHBondContact O-N 3.39Å; D284-R287 IonicContact OD1-CZ 2.89Å; D284-R287 IonicContact OD1-NH1 3.82Å; D284-R287 PolarHBondContact OD1-NH1 3.11Å; D284-R287 IonicContact OD1-NH2 3.97Å; D284-R287 PolarHBondContact OD1-NH2 3.31Å; D284-A288 PolarHBondContact O-N 3.07Å
285	A	87.1	Confident	83.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62	-43.3	172.3	0	0	0	0	0	111.9	L230 Y279 T281 R282 R287 A288 V289 W300	L230-A285 HydrophobicContact CD1-CB 4.38Å; L230-A285 HydrophobicContact CD2-CB 4.33Å; L230-A285 HydrophobicContact CG-CB 4.36Å; Y279-A285 HydrophobicContact CD2-CB 3.64Å; Y279-A285 HydrophobicContact CE2-CB 4.38Å; Y279-A285 HydrophobicContact CG-CB 4.11Å; T281-A285 PolarHBondContact O-N 2.9Å; R282-A285 WeakPolarHBondContact O-CB 3.19Å; R282-A285 PolarHBondContact O-N 2.97Å; R282-A285 VanDerWaalsContact O-N 3.14Å; A285-R287 VanDerWaalsContact C-N 3.32Å; A285-R287 PolarHBondContact O-N 3.01Å; A285-A288 WeakPolarHBondContact O-CB 3.36Å; A285-A288 PolarHBondContact O-N 3.13Å; A285-A288 VanDerWaalsContact O-N 3.16Å; A285-V289 WeakPolarHBondContact O-CG2 3.38Å; A285-V289 PolarHBondContact O-N 3.09Å; A285-W300 HydrophobicContact CB-CH2 3.62Å; A285-W300 HydrophobicContact CB-CZ3 3.6Å
286	E	85.6	Confident	81.8	Confident	80 Å²	80	40.8 Å²	40.8	37%	0.374	23%	0.234	S	C	.	.	H	α-helix	trans	-62.1	-38	176.7	-72.4	170.6	176.6	0	0	112.6	R282 S290 W300	R282-E286 HydrophobicContact CG-CG 4.34Å; R282-E286 WeakPolarHBondContact CG-OE1 3.38Å; R282-E286 IonicContact CZ-OE1 3.61Å; R282-E286 IonicContact NE-OE1 2.75Å; R282-E286 PolarHBondContact NE-OE1 3.48Å; R282-E286 IonicContact NH2-OE1 3.77Å; R282-E286 WeakPolarHBondContact O-CG 3.14Å; R282-E286 PolarHBondContact O-N 3.41Å; E286-S290 WeakPolarHBondContact O-CB 3.33Å; E286-S290 PolarHBondContact O-N 2.91Å; E286-S290 PolarHBondContact O-OG 2.79Å; E286-W300 HydrophobicContact CG-CH2 3.84Å; E286-W300 HydrophobicContact CG-CZ2 3.89Å
287	R	86	Confident	80.5	Confident	46 Å²	46	43.6 Å²	43.6	17%	0.174	25%	0.251	C	S	.	.	H	α-helix	trans	-66.5	-40.2	174	-72.8	-165.7	-49.4	-82.3	11.9	111.7	Y251 K283 D284 A285 S290 G291	Y251-R287 HydrophobicContact CD1-CB 4.25Å; Y251-R287 PolarHBondContact O-NH2 3.22Å; K283-R287 WeakPolarHBondContact O-CG 3.47Å; K283-R287 PolarHBondContact O-N 2.85Å; K283-R287 PolarHBondContact O-NH1 3.11Å; D284-R287 PolarHBondContact O-N 3.39Å; D284-R287 IonicContact OD1-CZ 2.89Å; D284-R287 IonicContact OD1-NH1 3.82Å; D284-R287 PolarHBondContact OD1-NH1 3.11Å; D284-R287 IonicContact OD1-NH2 3.97Å; D284-R287 PolarHBondContact OD1-NH2 3.31Å; A285-R287 VanDerWaalsContact C-N 3.32Å; A285-R287 PolarHBondContact O-N 3.01Å; R287-S290 PolarHBondContact O-N 3.16Å; R287-G291 PolarHBondContact O-N 3.41Å
288	A	86.5	Confident	79.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-50.1	175.9	0	0	0	0	0	111.3	L230 F248 Y251 Y279 D284 A285 S290 G291 L292	L230-A288 HydrophobicContact CD1-CB 4.1Å; F248-A288 HydrophobicContact CD1-CB 4.36Å; Y251-A288 HydrophobicContact CD2-CB 3.76Å; Y251-A288 HydrophobicContact CE2-CB 4.47Å; Y251-A288 HydrophobicContact CG-CB 3.85Å; Y279-A288 HydrophobicContact CE2-CB 3.71Å; Y279-A288 WeakPolarHBondContact OH-CB 3.4Å; D284-A288 PolarHBondContact O-N 3.07Å; A285-A288 WeakPolarHBondContact O-CB 3.36Å; A285-A288 PolarHBondContact O-N 3.13Å; A285-A288 VanDerWaalsContact O-N 3.16Å; A288-S290 VanDerWaalsContact C-N 3.28Å; A288-S290 PolarHBondContact O-N 3.12Å; A288-G291 PolarHBondContact O-N 2.89Å; A288-G291 VanDerWaalsContact O-N 3.14Å; A288-L292 HydrophobicContact CB-CD1 4.36Å; A288-L292 VanDerWaalsContact O-CB 3.32Å; A288-L292 WeakPolarHBondContact O-CB 3.49Å; A288-L292 PolarHBondContact O-N 3.49Å
289	V	84	Confident	78.4	Confident	15 Å²	15	48.2 Å²	48.2	9%	0.091	27%	0.271	C	S	.	.	H	α-helix	trans	-57.8	-41.9	175.4	172	0	0	0	0	111.1	L230 A285 K293 W300	L230-V289 HydrophobicContact CD1-CG2 3.83Å; L230-V289 HydrophobicContact CD2-CG2 3.44Å; L230-V289 VanDerWaalsContact CD2-CG2 3.44Å; L230-V289 HydrophobicContact CG-CG2 4.3Å; A285-V289 WeakPolarHBondContact O-CG2 3.38Å; A285-V289 PolarHBondContact O-N 3.09Å; V289-K293 WeakPolarHBondContact O-CD 3.15Å; V289-K293 WeakPolarHBondContact O-CG 3.32Å; V289-K293 PolarHBondContact O-N 3.5Å; V289-W300 HydrophobicContact CB-CZ2 4.48Å; V289-W300 HydrophobicContact CG2-CH2 4.29Å; V289-W300 HydrophobicContact CG2-CZ2 3.92Å
290	S	83.3	Confident	77.9	Confident	85 Å²	85	49.7 Å²	49.7	59%	0.594	28%	0.276	S	S	*	.	H	α-helix	trans	-70.7	-32.6	179.1	-57.2	0	0	0	0	113.2	E286 R287 A288	E286-S290 WeakPolarHBondContact O-CB 3.33Å; E286-S290 PolarHBondContact O-N 2.91Å; E286-S290 PolarHBondContact O-OG 2.79Å; R287-S290 PolarHBondContact O-N 3.16Å; A288-S290 VanDerWaalsContact C-N 3.28Å; A288-S290 PolarHBondContact O-N 3.12Å
291	G	80.2	Confident	77.4	Confident	45 Å²	45	49 Å²	49	46%	0.464	27%	0.274	S	S	.	.	H	α-helix	trans	-90.7	-23.8	-175.6	0	0	0	0	0	115.2	Y251 R287 A288	Y251-G291 PolarHBondContact OH-O 2.89Å; R287-G291 PolarHBondContact O-N 3.41Å; A288-G291 PolarHBondContact O-N 2.89Å; A288-G291 VanDerWaalsContact O-N 3.14Å
292	L	77.6	Confident	77.1	Confident	9 Å²	9	53 Å²	53	5%	0.047	29%	0.288	C	S	.	.	H	α-helix	trans	-101.4	-9.1	-178.5	-76	155.9	0	0	0	114.3	L247 F248 Y251 A288 G294 L295 E298	L247-L292 HydrophobicContact CD1-CD2 4.43Å; L247-L292 HydrophobicContact CD2-CD2 4.22Å; L247-L292 HydrophobicContact CG-CD2 4.16Å; F248-L292 HydrophobicContact CD1-CD1 3.65Å; F248-L292 HydrophobicContact CE1-CD1 3.29Å; F248-L292 HydrophobicContact CE2-CD1 4.32Å; F248-L292 HydrophobicContact CG-CD1 4.3Å; F248-L292 HydrophobicContact CZ-CD1 3.64Å; Y251-L292 HydrophobicContact CD2-CD1 4.07Å; Y251-L292 HydrophobicContact CE2-CD1 3.48Å; Y251-L292 VanDerWaalsContact CE2-CD1 3.48Å; Y251-L292 HydrophobicContact CE2-CD2 4.39Å; Y251-L292 HydrophobicContact CE2-CG 3.65Å; A288-L292 HydrophobicContact CB-CD1 4.36Å; A288-L292 VanDerWaalsContact O-CB 3.32Å; A288-L292 WeakPolarHBondContact O-CB 3.49Å; A288-L292 PolarHBondContact O-N 3.49Å; L292-G294 PolarHBondContact O-N 2.73Å; L292-L295 HydrophobicContact CD2-CB 4.41Å; L292-L295 HydrophobicContact CD2-CD2 3.89Å; L292-L295 PolarHBondContact O-N 3.44Å; L292-E298 WeakPolarHBondContact CB-OE1 3.43Å
293	K	69	Low	76.7	Confident	156 Å²	156	53.8 Å²	53.8	68%	0.678	30%	0.298	S	S	*	.	B	Isolated β-bridge	trans	-44.5	106.4	172.5	-96.7	167.1	-173.6	-173.4	0	111	V289	V289-K293 WeakPolarHBondContact O-CD 3.15Å; V289-K293 WeakPolarHBondContact O-CG 3.32Å; V289-K293 PolarHBondContact O-N 3.5Å
294	G	62.8	Low	76.4	Confident	79 Å²	79	53.3 Å²	53.3	81%	0.814	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.7	-21	179	0	0	0	0	0	115.4	L292	L292-G294 PolarHBondContact O-N 2.73Å
295	L	59.8	Low	76.1	Confident	122 Å²	122	59.9 Å²	59.9	64%	0.639	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-42.9	176.3	-165.2	74.8	0	0	0	111.6	L247 L292	L247-L295 HydrophobicContact CD1-CD2 4.23Å; L247-L295 HydrophobicContact CD2-CD2 4.07Å; L292-L295 HydrophobicContact CD2-CB 4.41Å; L292-L295 HydrophobicContact CD2-CD2 3.89Å; L292-L295 PolarHBondContact O-N 3.44Å
296	S	58.5	Low	75.8	Confident	8 Å²	8	63.5 Å²	63.5	6%	0.056	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-132.4	162.8	171.7	32.7	0	0	0	0	109.9	E298	S296-E298 WeakPolarHBondContact CA-OE1 3.45Å; S296-E298 WeakPolarHBondContact CB-OE1 3.36Å; S296-E298 PolarHBondContact N-OE1 3.23Å; S296-E298 PolarHBondContact O-N 3.17Å; S296-E298 VanDerWaalsContact O-OE2 3.12Å; S296-E298 PolarHBondContact OG-OE1 3.37Å
297	N	63.9	Low	75.7	Confident	99 Å²	99	62.1 Å²	62.1	53%	0.529	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	94.1	169.7	-68.9	-21.5	0	0	0	107.1	A233 F299	A233-N297 HydrophobicContact CB-CB 4.27Å; A233-N297 PolarHBondContact N-O 3.46Å; N297-F299 HydrophobicContact CB-CD2 4.5Å; N297-F299 HydrophobicContact CB-CE2 3.65Å; N297-F299 HydrophobicContact CB-CZ 4.13Å
298	E	64.5	Low	75.3	Confident	21 Å²	21	67.5 Å²	67.5	10%	0.098	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	130.6	176.3	-48.1	82.9	-165.5	0	0	111.2	F231 L232 L292 S296	F231-E298 WeakPolarHBondContact O-CA 3.42Å; L232-E298 HydrophobicContact CD2-CB 4.48Å; L232-E298 HydrophobicContact CD2-CG 3.89Å; L292-E298 WeakPolarHBondContact CB-OE1 3.43Å; S296-E298 WeakPolarHBondContact CA-OE1 3.45Å; S296-E298 WeakPolarHBondContact CB-OE1 3.36Å; S296-E298 PolarHBondContact N-OE1 3.23Å; S296-E298 PolarHBondContact O-N 3.17Å; S296-E298 VanDerWaalsContact O-OE2 3.12Å; S296-E298 PolarHBondContact OG-OE1 3.37Å
299	F	74.2	Confident	75	Confident	79 Å²	79	73.9 Å²	73.9	35%	0.346	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	152.3	176.3	-60.2	-84.3	0	0	0	110.7	A218 L230 F231 N297 G301	A218-F299 HydrophobicContact CB-CD1 3.7Å; A218-F299 HydrophobicContact CB-CE1 3.81Å; L230-F299 CarbonylContact C-O 3.55Å; L230-F299 WeakPolarHBondContact CA-O 3.31Å; F231-F299 HydrophobicContact CB-CB 4.39Å; F231-F299 HydrophobicContact CD1-CB 4.47Å; F231-F299 HydrophobicContact CD1-CD2 4.03Å; F231-F299 PolarHBondContact N-O 3.36Å; F231-F299 PolarHBondContact O-N 3.43Å; N297-F299 HydrophobicContact CB-CD2 4.5Å; N297-F299 HydrophobicContact CB-CE2 3.65Å; N297-F299 HydrophobicContact CB-CZ 4.13Å; F299-G301 PolarHBondContact O-N 3.47Å
300	W	80.6	Confident	75.1	Confident	31 Å²	31	74.4 Å²	74.4	12%	0.117	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	125.7	174.2	-69.3	100	0	0	0	110.6	L230 R282 A285 E286 V289	L230-W300 HydrophobicContact CD2-CD2 3.96Å; L230-W300 HydrophobicContact CD2-CE3 3.43Å; L230-W300 VanDerWaalsContact CD2-CE3 3.43Å; L230-W300 HydrophobicContact CD2-CH2 3.95Å; L230-W300 HydrophobicContact CD2-CZ2 4.4Å; L230-W300 HydrophobicContact CD2-CZ3 3.42Å; L230-W300 VanDerWaalsContact CD2-CZ3 3.42Å; R282-W300 VanDerWaalsContact CZ-CZ3 3.4Å; R282-W300 VanDerWaalsContact NH1-CH2 3.25Å; A285-W300 HydrophobicContact CB-CH2 3.62Å; A285-W300 HydrophobicContact CB-CZ3 3.6Å; E286-W300 HydrophobicContact CG-CH2 3.84Å; E286-W300 HydrophobicContact CG-CZ2 3.89Å; V289-W300 HydrophobicContact CB-CZ2 4.48Å; V289-W300 HydrophobicContact CG2-CH2 4.29Å; V289-W300 HydrophobicContact CG2-CZ2 3.92Å
301	G	76.7	Confident	75.3	Confident	3 Å²	3	74.7 Å²	74.7	3%	0.031	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-97.6	172.5	-178.6	0	0	0	0	0	113.2	N229 F299	N229-G301 PolarHBondContact O-N 3.49Å; F299-G301 PolarHBondContact O-N 3.47Å
302	K	78.6	Confident	75.8	Confident	116 Å²	116	74.7 Å²	74.7	50%	0.504	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-54.1	137.2	173.2	-174.3	179.5	179.3	168.4	0	110.1	N229 V304	N229-K302 WeakPolarHBondContact CB-O 3.17Å; N229-K302 PolarHBondContact ND2-O 2.88Å; K302-V304 PolarHBondContact O-N 3.33Å
303	P	77.1	Confident	76.2	Confident	55 Å²	55	75.9 Å²	75.9	36%	0.357	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-57.8	138.4	174.6	19.7	-28.8	0	0	0	111.3	T227	T227-P303 HydrophobicContact CG2-CB 4.01Å; T227-P303 HydrophobicContact CG2-CG 4.09Å
304	V	80	Confident	77	Confident	69 Å²	69	69.1 Å²	69.1	42%	0.418	38%	0.378	S	S	.	.			trans	-118.2	142.7	178.5	178.9	0	0	0	0	108.3	N229 K302 I306	N229-V304 HydrophobicContact CB-CG2 4.18Å; N229-V304 WeakPolarHBondContact ND2-CG2 3.23Å; K302-V304 PolarHBondContact O-N 3.33Å; V304-I306 PolarHBondContact O-N 2.93Å
305	V	81.3	Confident	78	Confident	139 Å²	139	71.9 Å²	71.9	84%	0.842	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-62.6	119.6	173.6	-178.7	0	0	0	0	108.8
306	I	80.6	Confident	78.9	Confident	76 Å²	76	68.3 Å²	68.3	39%	0.39	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-75.4	125.3	-177.6	-60.7	165.6	0	0	0	108.4	T228 A255 M280 V304	T228-I306 HydrophobicContact CG2-CD1 4Å; A255-I306 HydrophobicContact CB-CG2 4.4Å; M280-I306 HydrophobicContact CE-CG2 4.25Å; M280-I306 HydrophobicContact SD-CG2 3.73Å; V304-I306 PolarHBondContact O-N 2.93Å
307	P	84.2	Confident	79.8	Confident	51 Å²	51	69 Å²	69	33%	0.331	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-66.2	157	175.5	29.7	-34	0	0	0	110.7	A255 M280 Y309	A255-P307 HydrophobicContact CB-CG 4.19Å; M280-P307 VanDerWaalsContact CE-O 3.3Å; M280-P307 WeakPolarHBondContact CE-O 3.26Å; M280-P307 HydrophobicContact SD-CG 4.28Å; P307-Y309 VanDerWaalsContact CG-O 3.31Å; P307-Y309 WeakPolarHBondContact CG-O 3.49Å; P307-Y309 PolarHBondContact O-N 3.32Å
308	H	78.1	Confident	80.6	Confident	160 Å²	160	67.9 Å²	67.9	74%	0.741	35%	0.352	S	S	*	.	S	Bend	trans	-61.5	-31.3	175.8	-73	-79.4	0	0	0	112.7	F457	H308-F457 WeakPolarHBondContact O-CD1 3.45Å; H308-F457 VanDerWaalsContact O-CE1 3.25Å; H308-F457 WeakPolarHBondContact O-CE1 3.5Å
309	Y	80.5	Confident	81.3	Confident	133 Å²	133	71.1 Å²	71.1	52%	0.522	37%	0.37	S	S	.	.	S	Bend	trans	-121.8	139.4	-179.3	-62.8	-85.7	0	0	0	110.3	M280 P307 F457	M280-Y309 VanDerWaalsContact CE-C 3.47Å; P307-Y309 VanDerWaalsContact CG-O 3.31Å; P307-Y309 WeakPolarHBondContact CG-O 3.49Å; P307-Y309 PolarHBondContact O-N 3.32Å; Y309-F457 AromaticContact CD1-CE1 3.57Å; Y309-F457 HydrophobicContact CD1-CE1 3.57Å; Y309-F457 AromaticContact CD1-CZ 4Å; Y309-F457 HydrophobicContact CD1-CZ 4Å; Y309-F457 AromaticContact CE1-CE1 3.49Å; Y309-F457 HydrophobicContact CE1-CE1 3.49Å; Y309-F457 VanDerWaalsContact CE1-CE1 3.49Å; Y309-F457 AromaticContact CE1-CZ 3.4Å; Y309-F457 HydrophobicContact CE1-CZ 3.4Å; Y309-F457 VanDerWaalsContact CE1-CZ 3.4Å; Y309-F457 HydrophobicContact CG-CE1 4.38Å; Y309-F457 AromaticContact CZ-CZ 3.94Å
310	P	86.1	Confident	81.3	Confident	27 Å²	27	71.2 Å²	71.2	18%	0.175	37%	0.374	C	S	.	.			trans	-65.4	144	175.9	33.2	-39.7	0	0	0	109.6	P253 L254 M280 Y312 V313 Y459	P253-P310 HydrophobicContact CB-CB 4.14Å; L254-P310 CarbonylContact O-C 3.5Å; L254-P310 WeakPolarHBondContact O-CA 3.46Å; M280-P310 HydrophobicContact CE-CB 4Å; M280-P310 HydrophobicContact CE-CG 4.47Å; M280-P310 HydrophobicContact CG-CB 3.92Å; M280-P310 HydrophobicContact SD-CB 4.05Å; P310-Y312 VanDerWaalsContact C-N 3.33Å; P310-V313 HydrophobicContact CB-CG2 3.9Å; P310-V313 HydrophobicContact CG-CG2 3.22Å; P310-Y459 VanDerWaalsContact CG-OH 3.22Å; P310-Y459 WeakPolarHBondContact CG-OH 3.45Å
311	V	87.9	Confident	81.1	Confident	91 Å²	91	74.6 Å²	74.6	55%	0.552	39%	0.393	S	S	*	.	S	Bend	trans	-73.6	-33.1	170.2	172.6	0	0	0	0	110.4	L254 A255	L254-V311 PolarHBondContact O-N 2.81Å; A255-V311 WeakPolarHBondContact O-CG2 3.45Å
312	Y	89.5	Confident	81.3	Confident	45 Å²	45	76.3 Å²	76.3	18%	0.176	41%	0.407	C	S	.	.	B	Isolated β-bridge	trans	-134.3	131.5	177.7	178.7	-92.4	0	0	0	111.4	R245 P253 L254 P310 P314	R245-Y312 HydrophobicContact CB-CD1 4.35Å; R245-Y312 HydrophobicContact CB-CD2 3.68Å; R245-Y312 HydrophobicContact CB-CE2 3.89Å; R245-Y312 HydrophobicContact CB-CG 3.89Å; R245-Y312 HydrophobicContact CG-CD2 4.02Å; R245-Y312 HydrophobicContact CG-CG 4.05Å; R245-Y312 WeakPolarHBondContact O-CE1 3.47Å; P253-Y312 WeakPolarHBondContact CA-O 3.27Å; L254-Y312 HydrophobicContact CD1-CD1 4.2Å; L254-Y312 HydrophobicContact CG-CD1 4.22Å; L254-Y312 PolarHBondContact N-O 2.77Å; L254-Y312 PolarHBondContact O-N 3.46Å; P310-Y312 VanDerWaalsContact C-N 3.33Å; Y312-P314 HydrophobicContact CE1-CB 4.05Å
313	V	86.9	Confident	81.4	Confident	34 Å²	34	74.2 Å²	74.2	21%	0.206	41%	0.405	C	S	.	.			trans	-120.4	123.9	171.3	-173.3	0	0	0	0	108.2	P310 M317 L318	P310-V313 HydrophobicContact CB-CG2 3.9Å; P310-V313 HydrophobicContact CG-CG2 3.22Å; V313-M317 HydrophobicContact CG1-CB 3.98Å; V313-L318 HydrophobicContact CB-CD2 3.95Å; V313-L318 HydrophobicContact CB-CG 4.09Å; V313-L318 HydrophobicContact CG1-CD2 3.81Å; V313-L318 HydrophobicContact CG1-CG 3.87Å
314	P	85.1	Confident	81.7	Confident	14 Å²	14	72.7 Å²	72.7	9%	0.091	40%	0.395	C	S	.	.			trans	-62.6	142.1	179.1	25.4	-34.2	0	0	0	111.3	G249 Y312 A316 M317 L318	G249-P314 WeakPolarHBondContact O-CB 3.47Å; G249-P314 WeakPolarHBondContact O-CG 3.18Å; Y312-P314 HydrophobicContact CE1-CB 4.05Å; P314-A316 VanDerWaalsContact C-N 3.25Å; P314-A316 PolarHBondContact O-N 3.39Å; P314-A316 VanDerWaalsContact O-N 3.15Å; P314-M317 HydrophobicContact CG-CB 4.21Å; P314-M317 HydrophobicContact CG-CE 3.22Å; P314-M317 HydrophobicContact CG-CG 4.08Å; P314-M317 HydrophobicContact CG-SD 4.39Å; P314-M317 WeakPolarHBondContact O-CB 3.38Å; P314-M317 PolarHBondContact O-N 3.4Å; P314-L318 PolarHBondContact O-N 3.26Å
315	K	83.2	Confident	81.8	Confident	136 Å²	136	74.3 Å²	74.3	59%	0.591	41%	0.407	S	S	*	.	H	α-helix	trans	-51.2	-42.1	-176.1	178.6	59	-175.8	-75.1	0	113.2	M317 L318 D319	K315-M317 PolarHBondContact O-N 2.93Å; K315-L318 WeakPolarHBondContact O-CB 3.41Å; K315-L318 PolarHBondContact O-N 2.91Å; K315-D319 WeakPolarHBondContact CE-OD1 3.31Å; K315-D319 WeakPolarHBondContact CE-OD2 3.14Å; K315-D319 VanDerWaalsContact O-CG 3.29Å; K315-D319 PolarHBondContact O-N 3.43Å
316	A	79.5	Confident	81.9	Confident	48 Å²	48	71.7 Å²	71.7	40%	0.397	40%	0.4	S	S	.	.	H	α-helix	trans	-59.7	-30	178.4	0	0	0	0	0	113.5	P314 L320 I467	P314-A316 VanDerWaalsContact C-N 3.25Å; P314-A316 PolarHBondContact O-N 3.39Å; P314-A316 VanDerWaalsContact O-N 3.15Å; A316-L320 WeakPolarHBondContact O-CG 3.4Å; A316-I467 HydrophobicContact CB-CD1 3.77Å
317	M	78.1	Confident	81.9	Confident	23 Å²	23	70 Å²	70	11%	0.113	40%	0.395	C	S	.	.	H	α-helix	trans	-81.5	-34.4	173.6	-75.5	-160.8	-104.6	0	0	112.6	P253 V313 P314 K315 D319 L320 I321 Y459	P253-M317 HydrophobicContact CG-CE 4.46Å; V313-M317 HydrophobicContact CG1-CB 3.98Å; P314-M317 HydrophobicContact CG-CB 4.21Å; P314-M317 HydrophobicContact CG-CE 3.22Å; P314-M317 HydrophobicContact CG-CG 4.08Å; P314-M317 HydrophobicContact CG-SD 4.39Å; P314-M317 WeakPolarHBondContact O-CB 3.38Å; P314-M317 PolarHBondContact O-N 3.4Å; K315-M317 PolarHBondContact O-N 2.93Å; M317-D319 VanDerWaalsContact C-N 3.3Å; M317-D319 PolarHBondContact O-N 3.47Å; M317-L320 PolarHBondContact O-N 3.04Å; M317-I321 PolarHBondContact O-N 3.43Å; M317-Y459 HydrophobicContact SD-CD1 4.13Å; M317-Y459 HydrophobicContact SD-CE1 4.5Å
318	L	79.5	Confident	81.6	Confident	75 Å²	75	70.7 Å²	70.7	39%	0.393	41%	0.411	S	S	.	.	H	α-helix	trans	-61.2	-41.4	173.3	-68.9	174.3	0	0	0	111.2	V313 P314 K315 L320 I321 A322	V313-L318 HydrophobicContact CB-CD2 3.95Å; V313-L318 HydrophobicContact CB-CG 4.09Å; V313-L318 HydrophobicContact CG1-CD2 3.81Å; V313-L318 HydrophobicContact CG1-CG 3.87Å; P314-L318 PolarHBondContact O-N 3.26Å; K315-L318 WeakPolarHBondContact O-CB 3.41Å; K315-L318 PolarHBondContact O-N 2.91Å; L318-L320 PolarHBondContact O-N 3.38Å; L318-I321 HydrophobicContact CD2-CD1 4.18Å; L318-I321 WeakPolarHBondContact O-CG1 3.23Å; L318-I321 PolarHBondContact O-N 2.88Å; L318-I321 VanDerWaalsContact O-N 3.13Å; L318-A322 PolarHBondContact O-N 3.36Å
319	D	80.1	Confident	81.7	Confident	89 Å²	89	64.4 Å²	64.4	48%	0.476	38%	0.383	S	S	.	.	H	α-helix	trans	-63.8	-30.7	178.2	-64.3	-25.1	0	0	0	112.3	K315 M317 I321	K315-D319 WeakPolarHBondContact CE-OD1 3.31Å; K315-D319 WeakPolarHBondContact CE-OD2 3.14Å; K315-D319 VanDerWaalsContact O-CG 3.29Å; K315-D319 PolarHBondContact O-N 3.43Å; M317-D319 VanDerWaalsContact C-N 3.3Å; M317-D319 PolarHBondContact O-N 3.47Å; D319-I321 VanDerWaalsContact C-N 3.34Å
320	L	74.4	Confident	81.4	Confident	81 Å²	81	60.8 Å²	60.8	42%	0.424	38%	0.376	S	S	.	.	H	α-helix	trans	-70.5	-28.9	176.4	-70.8	172.1	0	0	0	112.9	A316 M317 L318 K367	A316-L320 WeakPolarHBondContact O-CG 3.4Å; M317-L320 PolarHBondContact O-N 3.04Å; L318-L320 PolarHBondContact O-N 3.38Å; L320-K367 VanDerWaalsContact O-CE 3.22Å; L320-K367 WeakPolarHBondContact O-CE 3.31Å; L320-K367 PolarHBondContact O-NZ 3.2Å
321	I	75	Confident	81	Confident	102 Å²	102	61.8 Å²	61.8	52%	0.523	38%	0.377	S	S	.	.	H	α-helix	trans	-95.3	-15.4	178.3	62.6	169.9	0	0	0	113.3	M317 L318 D319 V369	M317-I321 PolarHBondContact O-N 3.43Å; L318-I321 HydrophobicContact CD2-CD1 4.18Å; L318-I321 WeakPolarHBondContact O-CG1 3.23Å; L318-I321 PolarHBondContact O-N 2.88Å; L318-I321 VanDerWaalsContact O-N 3.13Å; D319-I321 VanDerWaalsContact C-N 3.34Å; I321-V369 WeakPolarHBondContact O-CG1 3.38Å; I321-V369 WeakPolarHBondContact O-CG2 3.22Å
322	A	81.5	Confident	80.8	Confident	38 Å²	38	58.5 Å²	58.5	31%	0.314	36%	0.357	S	S	.	.	S	Bend	trans	-60.8	147	177.5	0	0	0	0	0	112.3	L318 K367	L318-A322 PolarHBondContact O-N 3.36Å; A322-K367 WeakPolarHBondContact O-CE 3.44Å; A322-K367 PolarHBondContact O-NZ 3.14Å
323	P	81.2	Confident	80.4	Confident	73 Å²	73	56.4 Å²	56.4	47%	0.474	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-61.1	144.8	173.9	26.8	-33.7	0	0	0	110.5	V369	P323-V369 HydrophobicContact CB-CG2 4.21Å
324	P	82.4	Confident	80.2	Confident	22 Å²	22	56.7 Å²	56.7	14%	0.143	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-72.7	160.1	179	33.5	-30.2	0	0	0	110.1	N332 Q334 K367	P324-N332 PolarHBondContact O-ND2 2.9Å; P324-Q334 HydrophobicContact CB-CG 3.85Å; P324-Q334 HydrophobicContact CG-CG 3.89Å; P324-K367 HydrophobicContact CG-CB 4.09Å; P324-K367 HydrophobicContact CG-CD 4.28Å
325	P	83.8	Confident	80	Confident	104 Å²	104	57.1 Å²	57.1	68%	0.675	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-52.9	145.5	173.6	-23.9	33.9	0	0	0	111.7	S327 N332 Q334	P325-S327 PolarHBondContact O-N 3.11Å; P325-S327 VanDerWaalsContact O-N 3.09Å; P325-N332 PolarHBondContact O-OD1 3.19Å; P325-N332 VanDerWaalsContact O-OD1 3.11Å; P325-Q334 PolarHBondContact O-NE2 3.26Å
326	A	82.7	Confident	79.8	Confident	84 Å²	84	54.3 Å²	54.3	69%	0.694	34%	0.342	S	S	*	.			trans	-58.9	113.9	179	0	0	0	0	0	110.3	N332	A326-N332 VanDerWaalsContact CA-OD1 3.3Å; A326-N332 WeakPolarHBondContact CA-OD1 3.04Å
327	S	80.5	Confident	79.7	Confident	40 Å²	40	55.5 Å²	55.5	28%	0.28	35%	0.346	S	S	.	.			trans	-86.8	-15.3	-179	62.3	0	0	0	0	113.8	P325 L329 N332 A333	P325-S327 PolarHBondContact O-N 3.11Å; P325-S327 VanDerWaalsContact O-N 3.09Å; S327-L329 PolarHBondContact O-N 3Å; S327-L329 PolarHBondContact OG-N 3.09Å; S327-N332 PolarHBondContact N-OD1 3.08Å; S327-N332 PolarHBondContact OG-OD1 3.34Å; S327-A333 WeakPolarHBondContact CB-O 3.43Å; S327-A333 PolarHBondContact OG-O 2.83Å
328	G	77	Confident	79.6	Confident	66 Å²	66	57.4 Å²	57.4	68%	0.68	37%	0.365	S	S	*	.	S	Bend	trans	73.5	-5.9	-169.2	0	0	0	0	0	114.3
329	L	81	Confident	79.5	Confident	28 Å²	28	55.6 Å²	55.6	15%	0.147	35%	0.353	C	S	.	.	S	Bend	trans	-81.1	154.8	173	-61.6	-175.7	0	0	0	110.7	S327 N332 A333 P335 M360 A364	S327-L329 PolarHBondContact O-N 3Å; S327-L329 PolarHBondContact OG-N 3.09Å; L329-N332 WeakPolarHBondContact O-CA 3.49Å; L329-N332 PolarHBondContact O-N 3.19Å; L329-A333 HydrophobicContact CB-CB 3.96Å; L329-A333 WeakPolarHBondContact CB-O 3.4Å; L329-A333 HydrophobicContact CD1-CB 4.42Å; L329-A333 WeakPolarHBondContact CD1-O 3.4Å; L329-P335 HydrophobicContact CD1-CB 4.39Å; L329-P335 HydrophobicContact CD1-CG 4.38Å; L329-M360 HydrophobicContact CD2-CE 4.38Å; L329-A364 HydrophobicContact CD1-CB 4.34Å
330	P	74.9	Confident	79.2	Confident	57 Å²	57	53.5 Å²	53.5	37%	0.37	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-56.8	142.2	178.4	21.1	-32.2	0	0	0	111.8	N332 A333 C445	P330-N332 PolarHBondContact O-N 3.08Å; P330-N332 VanDerWaalsContact O-N 3.17Å; P330-A333 WeakPolarHBondContact O-CB 3.18Å; P330-A333 PolarHBondContact O-N 3.23Å; P330-A333 VanDerWaalsContact O-N 3.11Å; P330-C445 HydrophobicContact CG-CB 4.2Å; P330-C445 WeakPolarHBondContact CG-SG 2.9Å
331	F	77	Confident	79.3	Confident	47 Å²	47	58.3 Å²	58.3	21%	0.206	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	54.6	26.6	-173.9	-52.5	-64.7	0	0	0	114.3	A333 V366 H419 V420 R423 F449	F331-A333 PolarHBondContact O-N 2.75Å; F331-V366 HydrophobicContact CB-CG1 4.16Å; F331-V366 HydrophobicContact CB-CG2 3.81Å; F331-H419 AromaticContact CE1-CD2 3.98Å; F331-H419 AromaticContact CE1-NE2 3.83Å; F331-V420 HydrophobicContact CB-CG2 4.16Å; F331-R423 HydrophobicContact CE1-CB 4.08Å; F331-R423 HydrophobicContact CE1-CG 3.86Å; F331-F449 HydrophobicContact CB-CE1 4.48Å; F331-F449 HydrophobicContact CD2-CE1 4.39Å; F331-F449 AromaticContact CD2-CZ 3.89Å; F331-F449 HydrophobicContact CD2-CZ 3.89Å; F331-F449 HydrophobicContact CE2-CZ 4.1Å; F331-F449 HydrophobicContact CG-CE1 4.27Å; F331-F449 HydrophobicContact CG-CZ 4.19Å
332	N	82.7	Confident	79.3	Confident	23 Å²	23	59 Å²	59	12%	0.123	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	54.2	36.7	-175.3	-165	23.8	0	0	0	112.6	P324 P325 A326 S327 L329 P330 Q334	P324-N332 PolarHBondContact O-ND2 2.9Å; P325-N332 PolarHBondContact O-OD1 3.19Å; P325-N332 VanDerWaalsContact O-OD1 3.11Å; A326-N332 VanDerWaalsContact CA-OD1 3.3Å; A326-N332 WeakPolarHBondContact CA-OD1 3.04Å; S327-N332 PolarHBondContact N-OD1 3.08Å; S327-N332 PolarHBondContact OG-OD1 3.34Å; L329-N332 WeakPolarHBondContact O-CA 3.49Å; L329-N332 PolarHBondContact O-N 3.19Å; P330-N332 PolarHBondContact O-N 3.08Å; P330-N332 VanDerWaalsContact O-N 3.17Å; N332-Q334 PolarHBondContact O-N 2.85Å; N332-Q334 PolarHBondContact O-NE2 2.91Å; N332-Q334 PolarHBondContact OD1-NE2 3.14Å
333	A	82	Confident	78.7	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.008	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-58.9	134.4	-179.9	0	0	0	0	0	110.6	S327 L329 P330 F331 A364 V366 V447	S327-A333 WeakPolarHBondContact CB-O 3.43Å; S327-A333 PolarHBondContact OG-O 2.83Å; L329-A333 HydrophobicContact CB-CB 3.96Å; L329-A333 WeakPolarHBondContact CB-O 3.4Å; L329-A333 HydrophobicContact CD1-CB 4.42Å; L329-A333 WeakPolarHBondContact CD1-O 3.4Å; P330-A333 WeakPolarHBondContact O-CB 3.18Å; P330-A333 PolarHBondContact O-N 3.23Å; P330-A333 VanDerWaalsContact O-N 3.11Å; F331-A333 PolarHBondContact O-N 2.75Å; A333-A364 HydrophobicContact CB-CB 4.06Å; A333-V366 HydrophobicContact CB-CG2 3.58Å; A333-V447 HydrophobicContact CB-CG1 4.13Å
334	Q	83.5	Confident	78.3	Confident	39 Å²	39	61.5 Å²	61.5	18%	0.182	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-97	117.3	-180	-59.8	-62.5	-56.4	0	0	108.8	P324 P325 N332 A364 V365	P324-Q334 HydrophobicContact CB-CG 3.85Å; P324-Q334 HydrophobicContact CG-CG 3.89Å; P325-Q334 PolarHBondContact O-NE2 3.26Å; N332-Q334 PolarHBondContact O-N 2.85Å; N332-Q334 PolarHBondContact O-NE2 2.91Å; N332-Q334 PolarHBondContact OD1-NE2 3.14Å; Q334-A364 WeakPolarHBondContact O-CA 3.44Å; Q334-V365 PolarHBondContact N-O 3.24Å; Q334-V365 PolarHBondContact O-N 3.41Å
335	P	79.2	Confident	77.6	Confident	24 Å²	24	69 Å²	69	16%	0.156	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-66.5	154.5	172.7	29.9	-34.8	0	0	0	110.1	L329 P337 L340 M360	L329-P335 HydrophobicContact CD1-CB 4.39Å; L329-P335 HydrophobicContact CD1-CG 4.38Å; P335-P337 WeakPolarHBondContact O-CD 3.4Å; P335-P337 VanDerWaalsContact O-N 3.16Å; P335-L340 HydrophobicContact CB-CD1 3.85Å; P335-L340 HydrophobicContact CB-CD2 4.36Å; P335-L340 HydrophobicContact CB-CG 4.03Å; P335-L340 HydrophobicContact CG-CD1 3.39Å; P335-L340 HydrophobicContact CG-CG 4.13Å; P335-M360 HydrophobicContact CB-CG 3.9Å; P335-M360 HydrophobicContact CB-SD 4.14Å
336	D	80.2	Confident	76.6	Confident	77 Å²	77	64.8 Å²	64.8	41%	0.412	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-62.2	116.6	176.1	175.6	4.5	0	0	0	110.4	A338 W339 L340	D336-A338 PolarHBondContact O-N 3.08Å; D336-A338 WeakPolarHBondContact OD1-CB 3.21Å; D336-A338 PolarHBondContact OD1-N 2.79Å; D336-W339 HydrophobicContact CB-CB 3.81Å; D336-W339 PolarHBondContact O-N 3.37Å; D336-L340 PolarHBondContact O-N 3.4Å
337	P	76.2	Confident	75.4	Confident	73 Å²	73	62.1 Å²	62.1	47%	0.474	35%	0.345	S	S	.	.	H	α-helix	trans	-60.5	-31.5	-179.4	-22	33.1	0	0	0	113.4	P335 K341	P335-P337 WeakPolarHBondContact O-CD 3.4Å; P335-P337 VanDerWaalsContact O-N 3.16Å; P337-K341 WeakPolarHBondContact O-CG 3.22Å; P337-K341 PolarHBondContact O-N 2.99Å
338	A	77.6	Confident	74.5	Confident	63 Å²	63	67.4 Å²	67.4	52%	0.521	36%	0.363	S	S	.	.	H	α-helix	trans	-71.9	-43.8	178.4	0	0	0	0	0	110.6	D336 K341 V342	D336-A338 PolarHBondContact O-N 3.08Å; D336-A338 WeakPolarHBondContact OD1-CB 3.21Å; D336-A338 PolarHBondContact OD1-N 2.79Å; A338-K341 PolarHBondContact O-N 2.94Å; A338-V342 PolarHBondContact O-N 3.47Å
339	W	76.4	Confident	73.6	Confident	37 Å²	37	67.8 Å²	67.8	14%	0.14	35%	0.352	C	S	.	.	H	α-helix	trans	-62.9	-42.2	176.9	-171.8	91.1	0	0	0	112.2	D336 K341 V342 N343 L347 T356 H359 M360	D336-W339 HydrophobicContact CB-CB 3.81Å; D336-W339 PolarHBondContact O-N 3.37Å; W339-K341 PolarHBondContact O-N 3.21Å; W339-V342 PolarHBondContact O-N 2.87Å; W339-N343 HydrophobicContact CD2-CB 4.19Å; W339-N343 HydrophobicContact CE3-CB 4.19Å; W339-N343 HydrophobicContact CH2-CB 3.79Å; W339-N343 HydrophobicContact CZ2-CB 3.8Å; W339-N343 HydrophobicContact CZ3-CB 3.99Å; W339-N343 PolarHBondContact NE1-ND2 2.89Å; W339-N343 VanDerWaalsContact NE1-ND2 3.14Å; W339-N343 WeakPolarHBondContact O-CB 3.22Å; W339-N343 PolarHBondContact O-N 3.37Å; W339-N343 PolarHBondContact O-ND2 2.93Å; W339-N343 VanDerWaalsContact O-ND2 3.11Å; W339-L347 HydrophobicContact CH2-CD2 4.33Å; W339-L347 HydrophobicContact CZ3-CD1 4.26Å; W339-L347 HydrophobicContact CZ3-CD2 4.4Å; W339-L347 HydrophobicContact CZ3-CG 4.47Å; W339-T356 VanDerWaalsContact CH2-O 3.24Å; W339-T356 WeakPolarHBondContact CH2-O 3.12Å; W339-H359 AromaticContact CD1-CE1 3.9Å; W339-H359 AromaticContact CD1-ND1 3.94Å; W339-H359 AromaticContact CE2-ND1 3.53Å; W339-H359 AromaticContact CZ2-ND1 3.81Å; W339-H359 AromaticContact NE1-CE1 3.39Å; W339-H359 PolarHBondContact NE1-CE1 3.04Å; W339-H359 AromaticContact NE1-ND1 3.11Å; W339-H359 PolarHBondContact NE1-ND1 3.37Å; W339-H359 VanDerWaalsContact NE1-ND1 3.11Å; W339-M360 HydrophobicContact CE3-CB 4.08Å; W339-M360 HydrophobicContact CE3-CG 3.96Å; W339-M360 HydrophobicContact CH2-CB 3.71Å; W339-M360 HydrophobicContact CH2-CG 4.36Å; W339-M360 HydrophobicContact CZ2-CB 4.44Å; W339-M360 HydrophobicContact CZ3-CB 3.5Å; W339-M360 VanDerWaalsContact CZ3-CB 3.5Å; W339-M360 HydrophobicContact CZ3-CG 3.63Å; W339-M360 HydrophobicContact CZ3-SD 3.97Å
340	L	74.5	Confident	72.4	Confident	45 Å²	45	75.6 Å²	75.6	24%	0.236	39%	0.386	C	S	.	.	H	α-helix	trans	-60	-43.8	177.5	-81.1	-179.7	0	0	0	112.3	P335 D336 V342 N343 F344 L347 M360	P335-L340 HydrophobicContact CB-CD1 3.85Å; P335-L340 HydrophobicContact CB-CD2 4.36Å; P335-L340 HydrophobicContact CB-CG 4.03Å; P335-L340 HydrophobicContact CG-CD1 3.39Å; P335-L340 HydrophobicContact CG-CG 4.13Å; D336-L340 PolarHBondContact O-N 3.4Å; L340-V342 VanDerWaalsContact C-N 3.26Å; L340-V342 PolarHBondContact O-N 3.07Å; L340-N343 PolarHBondContact O-N 3.33Å; L340-F344 WeakPolarHBondContact O-CA 3.44Å; L340-F344 VanDerWaalsContact O-CB 3.25Å; L340-F344 WeakPolarHBondContact O-CB 3.42Å; L340-F344 PolarHBondContact O-N 2.87Å; L340-L347 HydrophobicContact CD2-CD1 3.81Å; L340-M360 HydrophobicContact CD2-SD 3.78Å
341	K	76.6	Confident	71.4	Confident	182 Å²	182	81.1 Å²	81.1	79%	0.791	41%	0.406	S	S	*	.	H	α-helix	trans	-59.9	-36.4	180	-74.7	176	-176.3	-176.7	0	112.9	P337 A338 W339	P337-K341 WeakPolarHBondContact O-CG 3.22Å; P337-K341 PolarHBondContact O-N 2.99Å; A338-K341 PolarHBondContact O-N 2.94Å; W339-K341 PolarHBondContact O-N 3.21Å
342	V	75.4	Confident	70.4	Confident	116 Å²	116	82.9 Å²	82.9	70%	0.703	42%	0.417	S	S	*	.	H	α-helix	trans	-79.9	-44.1	-178.8	179	0	0	0	0	111.1	A338 W339 L340	A338-V342 PolarHBondContact O-N 3.47Å; W339-V342 PolarHBondContact O-N 2.87Å; L340-V342 VanDerWaalsContact C-N 3.26Å; L340-V342 PolarHBondContact O-N 3.07Å
343	N	69	Low	69.3	Low	45 Å²	45	84.8 Å²	84.8	24%	0.241	43%	0.427	C	S	.	.	H	α-helix	trans	-99.1	7.3	-170.6	-62.4	-68.6	0	0	0	114.1	W339 L340 K345 A346 L347	W339-N343 HydrophobicContact CD2-CB 4.19Å; W339-N343 HydrophobicContact CE3-CB 4.19Å; W339-N343 HydrophobicContact CH2-CB 3.79Å; W339-N343 HydrophobicContact CZ2-CB 3.8Å; W339-N343 HydrophobicContact CZ3-CB 3.99Å; W339-N343 PolarHBondContact NE1-ND2 2.89Å; W339-N343 VanDerWaalsContact NE1-ND2 3.14Å; W339-N343 WeakPolarHBondContact O-CB 3.22Å; W339-N343 PolarHBondContact O-N 3.37Å; W339-N343 PolarHBondContact O-ND2 2.93Å; W339-N343 VanDerWaalsContact O-ND2 3.11Å; L340-N343 PolarHBondContact O-N 3.33Å; N343-K345 VanDerWaalsContact C-N 3.26Å; N343-K345 PolarHBondContact O-N 3.01Å; N343-A346 WeakPolarHBondContact O-CB 3.29Å; N343-A346 PolarHBondContact O-N 3.1Å; N343-L347 PolarHBondContact O-N 3.45Å
344	F	71.1	Confident	68.4	Low	119 Å²	119	89.9 Å²	89.9	52%	0.522	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-44	-176.5	-163.2	-103.6	0	0	0	112.4	L340 A346 L347 F348	L340-F344 WeakPolarHBondContact O-CA 3.44Å; L340-F344 VanDerWaalsContact O-CB 3.25Å; L340-F344 WeakPolarHBondContact O-CB 3.42Å; L340-F344 PolarHBondContact O-N 2.87Å; F344-A346 VanDerWaalsContact C-N 3.32Å; F344-A346 PolarHBondContact O-N 3.09Å; F344-L347 PolarHBondContact O-N 3.33Å; F344-F348 AromaticContact CD1-CE2 3.88Å; F344-F348 HydrophobicContact CD1-CE2 3.88Å; F344-F348 HydrophobicContact CE1-CD2 4.42Å; F344-F348 AromaticContact CE1-CE2 3.48Å; F344-F348 HydrophobicContact CE1-CE2 3.48Å; F344-F348 VanDerWaalsContact CE1-CE2 3.48Å; F344-F348 HydrophobicContact CE1-CZ 4.12Å; F344-F348 HydrophobicContact CE2-CE2 4.25Å; F344-F348 HydrophobicContact CG-CE2 4.43Å; F344-F348 AromaticContact CZ-CE2 3.69Å; F344-F348 HydrophobicContact CZ-CE2 3.69Å; F344-F348 AromaticContact CZ-CZ 4Å; F344-F348 HydrophobicContact CZ-CZ 4Å; F344-F348 WeakPolarHBondContact O-CD2 3.22Å
345	K	68.9	Low	67.4	Low	180 Å²	180	92.6 Å²	92.6	78%	0.783	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-34.1	178	-67.8	-172.4	178	-175.9	0	113.1	N343 L347 F348 T349	N343-K345 VanDerWaalsContact C-N 3.26Å; N343-K345 PolarHBondContact O-N 3.01Å; K345-L347 VanDerWaalsContact C-N 3.28Å; K345-L347 PolarHBondContact O-N 3.38Å; K345-F348 PolarHBondContact O-N 2.91Å; K345-T349 PolarHBondContact O-OG1 3.2Å
346	A	61.7	Low	66.9	Low	15 Å²	15	92 Å²	92	12%	0.124	47%	0.473	C	S	.	.	G	3₁₀ helix	trans	-69.4	-28.8	-178.8	0	0	0	0	0	112	N343 F344 F348 T349 L352 T356	N343-A346 WeakPolarHBondContact O-CB 3.29Å; N343-A346 PolarHBondContact O-N 3.1Å; F344-A346 VanDerWaalsContact C-N 3.32Å; F344-A346 PolarHBondContact O-N 3.09Å; A346-F348 PolarHBondContact O-N 3.36Å; A346-T349 PolarHBondContact O-N 3.14Å; A346-T349 VanDerWaalsContact O-N 3.15Å; A346-L352 HydrophobicContact CB-CD2 3.99Å; A346-T356 HydrophobicContact CB-CG2 3.97Å
347	L	57.4	Low	66.1	Low	27 Å²	27	94 Å²	94	14%	0.141	48%	0.475	C	S	.	.	G	3₁₀ helix	trans	-68	-9.1	173.8	-69.2	169.8	0	0	0	114.1	W339 L340 N343 F344 K345 L353 M360	W339-L347 HydrophobicContact CH2-CD2 4.33Å; W339-L347 HydrophobicContact CZ3-CD1 4.26Å; W339-L347 HydrophobicContact CZ3-CD2 4.4Å; W339-L347 HydrophobicContact CZ3-CG 4.47Å; L340-L347 HydrophobicContact CD2-CD1 3.81Å; N343-L347 PolarHBondContact O-N 3.45Å; F344-L347 PolarHBondContact O-N 3.33Å; K345-L347 VanDerWaalsContact C-N 3.28Å; K345-L347 PolarHBondContact O-N 3.38Å; L347-L353 WeakPolarHBondContact O-CD1 3.44Å; L347-M360 HydrophobicContact CD1-SD 4.19Å; L347-M360 HydrophobicContact CD2-SD 4.31Å
348	F	61.7	Low	65.7	Low	151 Å²	151	94 Å²	94	66%	0.662	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-109.1	0.2	173.4	-63	-84.8	0	0	0	112.5	F344 K345 A346	F344-F348 AromaticContact CD1-CE2 3.88Å; F344-F348 HydrophobicContact CD1-CE2 3.88Å; F344-F348 HydrophobicContact CE1-CD2 4.42Å; F344-F348 AromaticContact CE1-CE2 3.48Å; F344-F348 HydrophobicContact CE1-CE2 3.48Å; F344-F348 VanDerWaalsContact CE1-CE2 3.48Å; F344-F348 HydrophobicContact CE1-CZ 4.12Å; F344-F348 HydrophobicContact CE2-CE2 4.25Å; F344-F348 HydrophobicContact CG-CE2 4.43Å; F344-F348 AromaticContact CZ-CE2 3.69Å; F344-F348 HydrophobicContact CZ-CE2 3.69Å; F344-F348 AromaticContact CZ-CZ 4Å; F344-F348 HydrophobicContact CZ-CZ 4Å; F344-F348 WeakPolarHBondContact O-CD2 3.22Å; K345-F348 PolarHBondContact O-N 2.91Å; A346-F348 PolarHBondContact O-N 3.36Å
349	T	58.7	Low	65.4	Low	75 Å²	75	95.2 Å²	95.2	46%	0.46	47%	0.471	S	S	.	.			trans	-94.6	106.4	179.2	-52.4	0	0	0	0	109.1	K345 A346 H351 L352 L353	K345-T349 PolarHBondContact O-OG1 3.2Å; A346-T349 PolarHBondContact O-N 3.14Å; A346-T349 VanDerWaalsContact O-N 3.15Å; T349-H351 PolarHBondContact O-N 3.28Å; T349-L352 PolarHBondContact O-N 2.99Å; T349-L353 PolarHBondContact O-N 2.88Å
350	F	55.4	Low	65.5	Low	192 Å²	192	94.2 Å²	94.2	84%	0.842	47%	0.469	S	S	*	.	H	α-helix	trans	-45.7	-41.9	-170.9	-164.5	-97.4	0	0	0	114.6	L353	F350-L353 WeakPolarHBondContact O-CB 3.5Å
351	H	55	Low	65.3	Low	173 Å²	173	92.6 Å²	92.6	80%	0.801	46%	0.46	S	S	*	.	H	α-helix	trans	-75.8	-31.7	-177.8	-158.9	70.6	0	0	0	114.1	T349	T349-H351 PolarHBondContact O-N 3.28Å
352	L	55.7	Low	65	Low	83 Å²	83	90.9 Å²	90.9	44%	0.435	45%	0.449	S	S	.	.	H	α-helix	trans	-87.8	-13.2	176.2	-120.8	76.2	0	0	0	112.3	A346 T349 V354 T355 T356	A346-L352 HydrophobicContact CB-CD2 3.99Å; T349-L352 PolarHBondContact O-N 2.99Å; L352-V354 PolarHBondContact O-N 3.4Å; L352-T355 PolarHBondContact O-N 2.92Å; L352-T355 PolarHBondContact O-OG1 2.88Å; L352-T356 HydrophobicContact CB-CG2 4.16Å; L352-T356 HydrophobicContact CD2-CG2 3.87Å; L352-T356 HydrophobicContact CG-CG2 4.03Å; L352-T356 VanDerWaalsContact O-CB 3.31Å; L352-T356 WeakPolarHBondContact O-CB 3.29Å; L352-T356 VanDerWaalsContact O-CG2 3.26Å; L352-T356 WeakPolarHBondContact O-CG2 3.27Å; L352-T356 PolarHBondContact O-N 3.06Å; L352-T356 PolarHBondContact O-OG1 3.43Å
353	L	58.5	Low	64.9	Low	63 Å²	63	88.7 Å²	88.7	33%	0.33	43%	0.433	S	S	.	.	H	α-helix	trans	-54.1	-50.2	-172.7	-174.1	73	0	0	0	112	L347 T349 F350 T356 W357	L347-L353 WeakPolarHBondContact O-CD1 3.44Å; T349-L353 PolarHBondContact O-N 2.88Å; F350-L353 WeakPolarHBondContact O-CB 3.5Å; L353-T356 PolarHBondContact O-OG1 3.48Å; L353-W357 WeakPolarHBondContact O-CB 3.46Å; L353-W357 PolarHBondContact O-N 3.43Å
354	V	62.8	Low	65.4	Low	109 Å²	109	86.6 Å²	86.6	66%	0.661	42%	0.422	S	S	*	.	H	α-helix	trans	-66.1	-46.1	-173.1	-179.8	0	0	0	0	111.8	L352 S358	L352-V354 PolarHBondContact O-N 3.4Å; V354-S358 VanDerWaalsContact O-CB 3.29Å; V354-S358 WeakPolarHBondContact O-CB 3.11Å; V354-S358 PolarHBondContact O-N 2.88Å
355	T	64.5	Low	65.7	Low	95 Å²	95	82 Å²	82	58%	0.583	40%	0.403	S	S	*	.	H	α-helix	trans	-71.8	-42.1	-177.9	54.6	0	0	0	0	111.5	L352 H359	L352-T355 PolarHBondContact O-N 2.92Å; L352-T355 PolarHBondContact O-OG1 2.88Å; T355-H359 WeakPolarHBondContact O-CB 3.43Å; T355-H359 PolarHBondContact O-N 3.31Å
356	T	67.2	Low	66.2	Low	13 Å²	13	73.4 Å²	73.4	8%	0.08	37%	0.366	C	S	.	.	H	α-helix	trans	-66.9	-42.2	177.5	56.7	0	0	0	0	111.9	W339 A346 L352 L353 H359 M360	W339-T356 VanDerWaalsContact CH2-O 3.24Å; W339-T356 WeakPolarHBondContact CH2-O 3.12Å; A346-T356 HydrophobicContact CB-CG2 3.97Å; L352-T356 HydrophobicContact CB-CG2 4.16Å; L352-T356 HydrophobicContact CD2-CG2 3.87Å; L352-T356 HydrophobicContact CG-CG2 4.03Å; L352-T356 VanDerWaalsContact O-CB 3.31Å; L352-T356 WeakPolarHBondContact O-CB 3.29Å; L352-T356 VanDerWaalsContact O-CG2 3.26Å; L352-T356 WeakPolarHBondContact O-CG2 3.27Å; L352-T356 PolarHBondContact O-N 3.06Å; L352-T356 PolarHBondContact O-OG1 3.43Å; L353-T356 PolarHBondContact O-OG1 3.48Å; T356-H359 PolarHBondContact O-N 3.41Å; T356-M360 WeakPolarHBondContact O-CB 3.39Å; T356-M360 PolarHBondContact O-N 3.07Å
357	W	63.6	Low	67.1	Low	118 Å²	118	73.9 Å²	73.9	45%	0.447	37%	0.365	S	S	.	.	H	α-helix	trans	-65.3	-41.9	176.5	-166.6	84.4	0	0	0	112.1	L353 H359 M360 I361	L353-W357 WeakPolarHBondContact O-CB 3.46Å; L353-W357 PolarHBondContact O-N 3.43Å; W357-H359 VanDerWaalsContact C-N 3.34Å; W357-H359 PolarHBondContact O-N 3.26Å; W357-M360 HydrophobicContact CG-CE 4.23Å; W357-M360 WeakPolarHBondContact O-CB 3.24Å; W357-M360 PolarHBondContact O-N 3.06Å; W357-I361 HydrophobicContact CD2-CD1 3.55Å; W357-I361 HydrophobicContact CD2-CG1 4.32Å; W357-I361 VanDerWaalsContact CE2-CD1 3.47Å; W357-I361 HydrophobicContact CE3-CD1 3.44Å; W357-I361 VanDerWaalsContact CE3-CD1 3.44Å; W357-I361 HydrophobicContact CE3-CG1 4.46Å; W357-I361 HydrophobicContact CG-CD1 4.5Å; W357-I361 HydrophobicContact CH2-CD1 3.21Å; W357-I361 HydrophobicContact CZ2-CD1 3.34Å; W357-I361 HydrophobicContact CZ3-CD1 3.27Å; W357-I361 WeakPolarHBondContact O-CG1 3.39Å; W357-I361 PolarHBondContact O-N 2.96Å
358	S	67.5	Low	68.3	Low	72 Å²	72	72.8 Å²	72.8	50%	0.503	36%	0.36	S	S	.	.	H	α-helix	trans	-60.9	-42.5	174.2	-171.9	0	0	0	0	112.1	V354 R362	V354-S358 VanDerWaalsContact O-CB 3.29Å; V354-S358 WeakPolarHBondContact O-CB 3.11Å; V354-S358 PolarHBondContact O-N 2.88Å; S358-R362 VanDerWaalsContact O-CB 3.28Å; S358-R362 WeakPolarHBondContact O-CB 3.22Å; S358-R362 PolarHBondContact O-N 3.27Å
359	H	71.8	Confident	69.3	Low	90 Å²	90	66.8 Å²	66.8	42%	0.417	34%	0.335	S	S	.	.	H	α-helix	trans	-64.8	-42.4	175.6	-175.1	-90.6	0	0	0	112.2	W339 T355 T356 W357 N363	W339-H359 AromaticContact CD1-CE1 3.9Å; W339-H359 AromaticContact CD1-ND1 3.94Å; W339-H359 AromaticContact CE2-ND1 3.53Å; W339-H359 AromaticContact CZ2-ND1 3.81Å; W339-H359 AromaticContact NE1-CE1 3.39Å; W339-H359 PolarHBondContact NE1-CE1 3.04Å; W339-H359 AromaticContact NE1-ND1 3.11Å; W339-H359 PolarHBondContact NE1-ND1 3.37Å; W339-H359 VanDerWaalsContact NE1-ND1 3.11Å; T355-H359 WeakPolarHBondContact O-CB 3.43Å; T355-H359 PolarHBondContact O-N 3.31Å; T356-H359 PolarHBondContact O-N 3.41Å; W357-H359 VanDerWaalsContact C-N 3.34Å; W357-H359 PolarHBondContact O-N 3.26Å; H359-N363 PolarHBondContact CE1-ND2 2.92Å; H359-N363 PolarHBondContact ND1-ND2 3.07Å; H359-N363 PolarHBondContact NE2-ND2 3.27Å; H359-N363 PolarHBondContact O-N 3.01Å; H359-N363 PolarHBondContact O-ND2 3.15Å; H359-N363 VanDerWaalsContact O-ND2 3.14Å
360	M	78.2	Confident	70.6	Confident	16 Å²	16	65.1 Å²	65.1	8%	0.079	32%	0.323	C	S	.	.	H	α-helix	trans	-58.2	-51.4	175.6	-175.3	-174.6	66.3	0	0	111.6	L329 P335 W339 L340 L347 T356 W357 R362 N363 A364	L329-M360 HydrophobicContact CD2-CE 4.38Å; P335-M360 HydrophobicContact CB-CG 3.9Å; P335-M360 HydrophobicContact CB-SD 4.14Å; W339-M360 HydrophobicContact CE3-CB 4.08Å; W339-M360 HydrophobicContact CE3-CG 3.96Å; W339-M360 HydrophobicContact CH2-CB 3.71Å; W339-M360 HydrophobicContact CH2-CG 4.36Å; W339-M360 HydrophobicContact CZ2-CB 4.44Å; W339-M360 HydrophobicContact CZ3-CB 3.5Å; W339-M360 VanDerWaalsContact CZ3-CB 3.5Å; W339-M360 HydrophobicContact CZ3-CG 3.63Å; W339-M360 HydrophobicContact CZ3-SD 3.97Å; L340-M360 HydrophobicContact CD2-SD 3.78Å; L347-M360 HydrophobicContact CD1-SD 4.19Å; L347-M360 HydrophobicContact CD2-SD 4.31Å; T356-M360 WeakPolarHBondContact O-CB 3.39Å; T356-M360 PolarHBondContact O-N 3.07Å; W357-M360 HydrophobicContact CG-CE 4.23Å; W357-M360 WeakPolarHBondContact O-CB 3.24Å; W357-M360 PolarHBondContact O-N 3.06Å; M360-R362 PolarHBondContact O-N 3.09Å; M360-N363 CarbonylContact O-C 3.55Å; M360-N363 PolarHBondContact O-N 2.82Å; M360-A364 PolarHBondContact O-N 3Å
361	I	71.2	Confident	72	Confident	10 Å²	10	56.7 Å²	56.7	5%	0.051	29%	0.288	C	S	.	.	H	α-helix	trans	-64.4	-42.2	-177.8	-74.9	-178.4	0	0	0	111.8	W357 N363 A364 C445 V447	W357-I361 HydrophobicContact CD2-CD1 3.55Å; W357-I361 HydrophobicContact CD2-CG1 4.32Å; W357-I361 VanDerWaalsContact CE2-CD1 3.47Å; W357-I361 HydrophobicContact CE3-CD1 3.44Å; W357-I361 VanDerWaalsContact CE3-CD1 3.44Å; W357-I361 HydrophobicContact CE3-CG1 4.46Å; W357-I361 HydrophobicContact CG-CD1 4.5Å; W357-I361 HydrophobicContact CH2-CD1 3.21Å; W357-I361 HydrophobicContact CZ2-CD1 3.34Å; W357-I361 HydrophobicContact CZ3-CD1 3.27Å; W357-I361 WeakPolarHBondContact O-CG1 3.39Å; W357-I361 PolarHBondContact O-N 2.96Å; I361-N363 PolarHBondContact O-N 3.3Å; I361-A364 WeakPolarHBondContact O-CB 3.42Å; I361-A364 PolarHBondContact O-N 3.16Å; I361-A364 VanDerWaalsContact O-N 3.08Å; I361-C445 WeakPolarHBondContact CG2-SG 3.47Å; I361-V447 HydrophobicContact CG2-CG2 4.4Å
362	R	70.4	Confident	73.2	Confident	147 Å²	147	54 Å²	54	56%	0.555	28%	0.284	S	S	*	.	H	α-helix	trans	-61.5	-28.5	-179.9	-171.2	175.9	-179.2	170.6	-1.2	112.5	S358 M360	S358-R362 VanDerWaalsContact O-CB 3.28Å; S358-R362 WeakPolarHBondContact O-CB 3.22Å; S358-R362 PolarHBondContact O-N 3.27Å; M360-R362 PolarHBondContact O-N 3.09Å
363	N	73.5	Confident	74.5	Confident	69 Å²	69	55.5 Å²	55.5	37%	0.369	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-0	178.4	-60.6	-30.7	0	0	0	112.9	H359 M360 I361	H359-N363 PolarHBondContact CE1-ND2 2.92Å; H359-N363 PolarHBondContact ND1-ND2 3.07Å; H359-N363 PolarHBondContact NE2-ND2 3.27Å; H359-N363 PolarHBondContact O-N 3.01Å; H359-N363 PolarHBondContact O-ND2 3.15Å; H359-N363 VanDerWaalsContact O-ND2 3.14Å; M360-N363 CarbonylContact O-C 3.55Å; M360-N363 PolarHBondContact O-N 2.82Å; I361-N363 PolarHBondContact O-N 3.3Å
364	A	79.2	Confident	75.8	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.008	31%	0.306	C	S	.	.			trans	-71.1	143.1	177.5	0	0	0	0	0	110.6	L329 A333 Q334 M360 I361	L329-A364 HydrophobicContact CD1-CB 4.34Å; A333-A364 HydrophobicContact CB-CB 4.06Å; Q334-A364 WeakPolarHBondContact O-CA 3.44Å; M360-A364 PolarHBondContact O-N 3Å; I361-A364 WeakPolarHBondContact O-CB 3.42Å; I361-A364 PolarHBondContact O-N 3.16Å; I361-A364 VanDerWaalsContact O-N 3.08Å
365	V	77.7	Confident	77.1	Confident	22 Å²	22	60.4 Å²	60.4	13%	0.133	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	127.4	-173.2	174.6	0	0	0	0	109.9	Q334 V450 W474	Q334-V365 PolarHBondContact N-O 3.24Å; Q334-V365 PolarHBondContact O-N 3.41Å; V365-V450 HydrophobicContact CG1-CB 3.82Å; V365-V450 HydrophobicContact CG1-CG2 3.55Å; V365-W474 HydrophobicContact CG1-CB 4.41Å; V365-W474 HydrophobicContact CG1-CD2 3.97Å; V365-W474 HydrophobicContact CG1-CE3 4.13Å; V365-W474 HydrophobicContact CG1-CG 4.1Å; V365-W474 HydrophobicContact CG2-CB 4.47Å
366	V	78.5	Confident	78.4	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	118.5	171.7	169.1	0	0	0	0	109.9	F331 A333 V368 V420 V447 I448 F449 V450	F331-V366 HydrophobicContact CB-CG1 4.16Å; F331-V366 HydrophobicContact CB-CG2 3.81Å; A333-V366 HydrophobicContact CB-CG2 3.58Å; V366-V368 HydrophobicContact CG1-CG2 4.13Å; V366-V368 PolarHBondContact O-N 2.87Å; V366-V420 HydrophobicContact CG1-CG1 3.46Å; V366-V420 VanDerWaalsContact CG1-CG1 3.46Å; V366-V447 HydrophobicContact CB-CG1 4.05Å; V366-V447 HydrophobicContact CG2-CG1 3.14Å; V366-I448 PolarHBondContact N-O 2.91Å; V366-F449 HydrophobicContact CB-CD1 4.12Å; V366-F449 HydrophobicContact CG1-CD1 3.8Å; V366-F449 HydrophobicContact CG1-CE1 4.06Å; V366-V450 CarbonylContact O-C 3.57Å; V366-V450 PolarHBondContact O-N 3.24Å
367	K	79.8	Confident	79.4	Confident	26 Å²	26	59.3 Å²	59.3	11%	0.113	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	112	169.6	-176.8	-175	-166	179.5	0	109.1	L320 A322 P324 V369 L452 W474	L320-K367 VanDerWaalsContact O-CE 3.22Å; L320-K367 WeakPolarHBondContact O-CE 3.31Å; L320-K367 PolarHBondContact O-NZ 3.2Å; A322-K367 WeakPolarHBondContact O-CE 3.44Å; A322-K367 PolarHBondContact O-NZ 3.14Å; P324-K367 HydrophobicContact CG-CB 4.09Å; P324-K367 HydrophobicContact CG-CD 4.28Å; K367-V369 HydrophobicContact CD-CG2 4.4Å; K367-V369 HydrophobicContact CG-CG2 4.4Å; K367-L452 HydrophobicContact CG-CD1 4.28Å; K367-W474 HydrophobicContact CB-CH2 3.67Å; K367-W474 HydrophobicContact CB-CZ2 4.25Å; K367-W474 HydrophobicContact CB-CZ3 4.31Å; K367-W474 HydrophobicContact CD-CH2 3.64Å; K367-W474 HydrophobicContact CD-CZ2 4.32Å; K367-W474 HydrophobicContact CG-CH2 3.54Å; K367-W474 HydrophobicContact CG-CZ2 4.46Å; K367-W474 HydrophobicContact CG-CZ3 4.16Å
368	V	83.3	Confident	80.6	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.024	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	116.9	175.9	-174.2	0	0	0	0	109.8	V366 V420 Y421 W424 F449 V450 C451	V366-V368 HydrophobicContact CG1-CG2 4.13Å; V366-V368 PolarHBondContact O-N 2.87Å; V368-V420 HydrophobicContact CG2-CG1 4.2Å; V368-Y421 HydrophobicContact CG1-CD2 3.83Å; V368-W424 HydrophobicContact CB-CD2 4.39Å; V368-W424 HydrophobicContact CB-CG 4.34Å; V368-W424 HydrophobicContact CG1-CB 4.04Å; V368-W424 HydrophobicContact CG1-CD2 3.94Å; V368-W424 HydrophobicContact CG1-CE3 3.76Å; V368-W424 HydrophobicContact CG1-CG 4.05Å; V368-W424 HydrophobicContact CG2-CB 3.76Å; V368-W424 HydrophobicContact CG2-CD2 4.1Å; V368-W424 HydrophobicContact CG2-CG 3.59Å; V368-F449 HydrophobicContact CG2-CD1 4.17Å; V368-V450 PolarHBondContact N-O 3.43Å; V368-C451 HydrophobicContact CB-CB 4.24Å; V368-C451 HydrophobicContact CG2-CB 4.46Å
369	V	83.9	Confident	81.8	Confident	25 Å²	25	54.2 Å²	54.2	15%	0.152	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-99.7	132.1	174.2	178.7	0	0	0	0	109.5	I321 P323 K367 P417	I321-V369 WeakPolarHBondContact O-CG1 3.38Å; I321-V369 WeakPolarHBondContact O-CG2 3.22Å; P323-V369 HydrophobicContact CB-CG2 4.21Å; K367-V369 HydrophobicContact CD-CG2 4.4Å; K367-V369 HydrophobicContact CG-CG2 4.4Å; V369-P417 HydrophobicContact CB-CB 4.22Å
370	I	84.1	Confident	82.7	Confident	39 Å²	39	50 Å²	50	20%	0.2	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-86.3	128.6	-175.8	-58.4	-175.2	0	0	0	108.5	T372 L377 Y421 T454	I370-T372 PolarHBondContact O-N 3.4Å; I370-L377 HydrophobicContact CG2-CD1 4.15Å; I370-Y421 HydrophobicContact CB-CD2 4.35Å; I370-Y421 HydrophobicContact CB-CE2 4.2Å; I370-Y421 HydrophobicContact CD1-CE2 4.11Å; I370-Y421 HydrophobicContact CG1-CD2 3.86Å; I370-Y421 HydrophobicContact CG1-CE2 3.66Å; I370-Y421 HydrophobicContact CG2-CD2 4.47Å; I370-Y421 HydrophobicContact CG2-CE2 3.99Å; I370-T454 HydrophobicContact CB-CG2 4.49Å; I370-T454 HydrophobicContact CD1-CG2 3.21Å; I370-T454 HydrophobicContact CG1-CG2 4.33Å; I370-T454 HydrophobicContact CG2-CG2 4.39Å
371	P	85.6	Confident	83.2	Confident	16 Å²	16	52 Å²	52	10%	0.104	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-51.1	128.3	178.2	-28.3	33.5	0	0	0	112	L376 L377 I380 Y421	P371-L376 HydrophobicContact CB-CD2 4.16Å; P371-L376 HydrophobicContact CB-CG 4.34Å; P371-L377 HydrophobicContact CB-CB 4.34Å; P371-L377 HydrophobicContact CG-CD1 4.38Å; P371-I380 HydrophobicContact CG-CD1 3.81Å; P371-Y421 VanDerWaalsContact CD-CG 3.42Å; P371-Y421 HydrophobicContact CG-CD1 3.86Å; P371-Y421 HydrophobicContact CG-CG 4.12Å
372	T	79.8	Confident	84.1	Confident	117 Å²	117	56.2 Å²	56.2	72%	0.718	28%	0.279	S	S	*	.	S	Bend	trans	-74.1	-34.7	176.8	50.3	0	0	0	0	111.7	I370 R374	I370-T372 PolarHBondContact O-N 3.4Å; T372-R374 PolarHBondContact O-N 2.94Å
373	E	84.1	Confident	84.9	Confident	114 Å²	114	49.2 Å²	49.2	53%	0.533	25%	0.253	S	S	.	.			trans	-70	115.5	178.8	-58.1	-46.9	121	0	0	110.6	S375 L376 L377	E373-S375 VanDerWaalsContact C-N 3.31Å; E373-S375 PolarHBondContact O-N 3.31Å; E373-L376 HydrophobicContact CB-CB 3.88Å; E373-L376 PolarHBondContact O-N 3.41Å; E373-L377 WeakPolarHBondContact O-CB 3.18Å; E373-L377 PolarHBondContact O-N 3.1Å
374	R	84.4	Confident	85.5	Confident	183 Å²	183	46.3 Å²	46.3	69%	0.691	24%	0.237	S	C	*	.	H	α-helix	trans	-62.7	-38.9	-177.9	-173.2	177	-176.9	171.8	1.1	112	T372 L377 C378	T372-R374 PolarHBondContact O-N 2.94Å; R374-L377 PolarHBondContact O-N 3.1Å; R374-C378 WeakPolarHBondContact O-CB 3.39Å; R374-C378 PolarHBondContact O-N 3.31Å; R374-C378 PolarHBondContact O-SG 2.84Å
375	S	90.1	Very high	85.8	Confident	92 Å²	92	50.7 Å²	50.7	64%	0.643	26%	0.258	S	S	*	.	H	α-helix	trans	-60.7	-49.4	176.7	48.8	0	0	0	0	111.3	E373 C378 L379	E373-S375 VanDerWaalsContact C-N 3.31Å; E373-S375 PolarHBondContact O-N 3.31Å; S375-C378 PolarHBondContact O-N 3.08Å; S375-L379 VanDerWaalsContact O-CB 3.31Å; S375-L379 WeakPolarHBondContact O-CB 3.24Å; S375-L379 PolarHBondContact O-N 3.31Å
376	L	91.7	Very high	86.1	Confident	45 Å²	45	50.2 Å²	50.2	24%	0.236	25%	0.254	C	S	.	.	H	α-helix	trans	-62.1	-44.2	176.5	179.3	60.3	0	0	0	111.8	P371 E373 L379 I380 F410	P371-L376 HydrophobicContact CB-CD2 4.16Å; P371-L376 HydrophobicContact CB-CG 4.34Å; E373-L376 HydrophobicContact CB-CB 3.88Å; E373-L376 PolarHBondContact O-N 3.41Å; L376-L379 PolarHBondContact O-N 3.02Å; L376-I380 HydrophobicContact CD1-CD1 3.98Å; L376-I380 HydrophobicContact CD1-CG1 4.2Å; L376-I380 HydrophobicContact CG-CD1 3.89Å; L376-I380 WeakPolarHBondContact O-CB 3.39Å; L376-I380 VanDerWaalsContact O-CG1 3.31Å; L376-I380 WeakPolarHBondContact O-CG1 3.44Å; L376-I380 PolarHBondContact O-N 3.11Å; L376-F410 HydrophobicContact CD1-CD1 3.81Å; L376-F410 HydrophobicContact CD1-CE1 4.41Å; L376-F410 HydrophobicContact CD1-CG 4.46Å
377	L	88.8	Confident	86.2	Confident	39 Å²	39	50.8 Å²	50.8	20%	0.204	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-47.3	178.3	-177.8	63	0	0	0	111.7	I370 P371 E373 R374 L379 I380 H381 Y421	I370-L377 HydrophobicContact CG2-CD1 4.15Å; P371-L377 HydrophobicContact CB-CB 4.34Å; P371-L377 HydrophobicContact CG-CD1 4.38Å; E373-L377 WeakPolarHBondContact O-CB 3.18Å; E373-L377 PolarHBondContact O-N 3.1Å; R374-L377 PolarHBondContact O-N 3.1Å; L377-L379 VanDerWaalsContact C-N 3.33Å; L377-I380 PolarHBondContact O-N 2.93Å; L377-H381 WeakPolarHBondContact CD1-NE2 3.24Å; L377-H381 PolarHBondContact O-N 2.99Å; L377-Y421 HydrophobicContact CD1-CD1 4.28Å; L377-Y421 HydrophobicContact CD1-CE1 3.42Å; L377-Y421 VanDerWaalsContact CD1-CE1 3.42Å
378	C	89.1	Confident	86.2	Confident	64 Å²	64	52.8 Å²	52.8	43%	0.432	27%	0.268	S	S	.	.	H	α-helix	trans	-61.9	-42.2	176.3	-73.4	0	0	0	0	111.4	R374 S375 H381 R382	R374-C378 WeakPolarHBondContact O-CB 3.39Å; R374-C378 PolarHBondContact O-N 3.31Å; R374-C378 PolarHBondContact O-SG 2.84Å; S375-C378 PolarHBondContact O-N 3.08Å; C378-H381 PolarHBondContact O-N 3.18Å; C378-R382 VanDerWaalsContact O-CG 3.28Å; C378-R382 WeakPolarHBondContact O-CG 3.03Å; C378-R382 PolarHBondContact O-N 3.43Å
379	L	92.8	Very high	86.1	Confident	20 Å²	20	58.9 Å²	58.9	11%	0.105	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-46.7	177.2	-175	150.1	0	0	0	111.3	F84 S375 L376 L377 H381 R382 V383 F408 F410	F84-L379 HydrophobicContact CE1-CD1 4.39Å; F84-L379 HydrophobicContact CZ-CG 4.4Å; S375-L379 VanDerWaalsContact O-CB 3.31Å; S375-L379 WeakPolarHBondContact O-CB 3.24Å; S375-L379 PolarHBondContact O-N 3.31Å; L376-L379 PolarHBondContact O-N 3.02Å; L377-L379 VanDerWaalsContact C-N 3.33Å; L379-H381 VanDerWaalsContact C-N 3.34Å; L379-H381 PolarHBondContact O-N 3.14Å; L379-R382 PolarHBondContact O-N 2.93Å; L379-V383 HydrophobicContact CD2-CG2 4.13Å; L379-V383 WeakPolarHBondContact O-CG2 3.48Å; L379-V383 PolarHBondContact O-N 3.21Å; L379-F408 HydrophobicContact CD1-CE1 4.22Å; L379-F408 HydrophobicContact CD1-CE2 4.24Å; L379-F408 HydrophobicContact CD1-CZ 3.92Å; L379-F408 HydrophobicContact CD2-CD1 3.96Å; L379-F408 HydrophobicContact CD2-CE1 3.74Å; L379-F408 HydrophobicContact CD2-CZ 4.3Å; L379-F408 HydrophobicContact CG-CE1 4.22Å; L379-F408 HydrophobicContact CG-CZ 4.34Å; L379-F410 HydrophobicContact CD2-CD1 4.34Å; L379-F410 HydrophobicContact CD2-CE1 3.28Å; L379-F410 HydrophobicContact CD2-CZ 3.76Å
380	I	90.2	Very high	85.9	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-57.5	-46.8	175.6	-72.5	166.5	0	0	0	110.9	P371 L376 L377 R382 V383 I384 F410 Y421 Y422	P371-I380 HydrophobicContact CG-CD1 3.81Å; L376-I380 HydrophobicContact CD1-CD1 3.98Å; L376-I380 HydrophobicContact CD1-CG1 4.2Å; L376-I380 HydrophobicContact CG-CD1 3.89Å; L376-I380 WeakPolarHBondContact O-CB 3.39Å; L376-I380 VanDerWaalsContact O-CG1 3.31Å; L376-I380 WeakPolarHBondContact O-CG1 3.44Å; L376-I380 PolarHBondContact O-N 3.11Å; L377-I380 PolarHBondContact O-N 2.93Å; I380-R382 VanDerWaalsContact C-N 3.31Å; I380-R382 PolarHBondContact O-N 3.21Å; I380-V383 PolarHBondContact O-N 3.29Å; I380-I384 HydrophobicContact CG2-CD1 3.77Å; I380-I384 HydrophobicContact CG2-CG1 4.45Å; I380-I384 VanDerWaalsContact O-CG1 3.25Å; I380-I384 WeakPolarHBondContact O-CG1 3.19Å; I380-I384 PolarHBondContact O-N 3.46Å; I380-F410 HydrophobicContact CD1-CD2 4.22Å; I380-F410 HydrophobicContact CD1-CG 4.22Å; I380-F410 HydrophobicContact CG1-CD1 4.1Å; I380-F410 HydrophobicContact CG1-CD2 3.81Å; I380-F410 HydrophobicContact CG1-CE1 4Å; I380-F410 HydrophobicContact CG1-CE2 3.68Å; I380-F410 HydrophobicContact CG1-CG 4.02Å; I380-F410 HydrophobicContact CG1-CZ 3.78Å; I380-Y421 HydrophobicContact CD1-CD1 4.27Å; I380-Y421 HydrophobicContact CG2-CD1 3.94Å; I380-Y421 HydrophobicContact CG2-CE1 4.06Å; I380-Y422 HydrophobicContact CG2-CD2 4.12Å
381	H	89.9	Confident	85.4	Confident	58 Å²	58	60.3 Å²	60.3	27%	0.269	30%	0.3	S	S	.	.	H	α-helix	trans	-61.5	-41.1	178.1	-69.8	175.2	0	0	0	111.8	L377 C378 L379 I384 E385 Y421	L377-H381 WeakPolarHBondContact CD1-NE2 3.24Å; L377-H381 PolarHBondContact O-N 2.99Å; C378-H381 PolarHBondContact O-N 3.18Å; L379-H381 VanDerWaalsContact C-N 3.34Å; L379-H381 PolarHBondContact O-N 3.14Å; H381-I384 PolarHBondContact O-N 3.02Å; H381-E385 WeakPolarHBondContact O-CG 3.23Å; H381-E385 PolarHBondContact O-N 2.7Å; H381-Y421 AromaticContact NE2-CE1 3.56Å; H381-Y421 AromaticContact NE2-CZ 3.59Å; H381-Y421 PolarHBondContact NE2-OH 3.13Å
382	R	89.1	Confident	85.1	Confident	100 Å²	100	63.2 Å²	63.2	38%	0.377	32%	0.32	S	S	.	.	H	α-helix	trans	-64.2	-44.6	175.8	-71.1	-68.3	170.6	-169.3	3.8	112.4	F80 C378 L379 I380 I384 E385 F386	F80-R382 HydrophobicContact CE2-CB 4.35Å; C378-R382 VanDerWaalsContact O-CG 3.28Å; C378-R382 WeakPolarHBondContact O-CG 3.03Å; C378-R382 PolarHBondContact O-N 3.43Å; L379-R382 PolarHBondContact O-N 2.93Å; I380-R382 VanDerWaalsContact C-N 3.31Å; I380-R382 PolarHBondContact O-N 3.21Å; R382-I384 VanDerWaalsContact C-N 3.28Å; R382-I384 PolarHBondContact O-N 2.68Å; R382-E385 IonicContact CZ-OE2 2.61Å; R382-E385 IonicContact NE-OE2 2.69Å; R382-E385 IonicContact NH1-OE1 3.11Å; R382-E385 IonicContact NH1-OE2 2.83Å; R382-E385 PolarHBondContact NH1-OE2 3.17Å; R382-E385 PolarHBondContact O-N 2.92Å; R382-F386 WeakPolarHBondContact O-CD2 2.84Å; R382-F386 PolarHBondContact O-N 2.98Å
383	V	87.1	Confident	84.8	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58.2	-44.4	174.1	176.3	0	0	0	0	110.4	F80 L379 I380 E385 F386 V387 L398 F408 F410 Y422	F80-V383 HydrophobicContact CE2-CG2 4.1Å; F80-V383 HydrophobicContact CZ-CG2 3.75Å; L379-V383 HydrophobicContact CD2-CG2 4.13Å; L379-V383 WeakPolarHBondContact O-CG2 3.48Å; L379-V383 PolarHBondContact O-N 3.21Å; I380-V383 PolarHBondContact O-N 3.29Å; V383-E385 PolarHBondContact O-N 3.12Å; V383-F386 PolarHBondContact O-N 2.99Å; V383-V387 HydrophobicContact CG1-CG2 3.86Å; V383-V387 WeakPolarHBondContact O-CB 3.23Å; V383-V387 VanDerWaalsContact O-CG2 3.22Å; V383-V387 WeakPolarHBondContact O-CG2 3.28Å; V383-V387 PolarHBondContact O-N 3.3Å; V383-L398 HydrophobicContact CB-CD2 4.43Å; V383-L398 HydrophobicContact CG1-CD2 3.78Å; V383-L398 HydrophobicContact CG2-CD2 3.75Å; V383-F408 HydrophobicContact CG2-CE1 3.96Å; V383-F410 HydrophobicContact CB-CZ 4.49Å; V383-F410 HydrophobicContact CG2-CZ 4.14Å; V383-Y422 HydrophobicContact CG1-CE2 3.99Å
384	I	86	Confident	84.6	Confident	8 Å²	8	55.7 Å²	55.7	4%	0.041	28%	0.277	C	S	.	.	H	α-helix	trans	-61	-43.5	179.2	-69.7	169	0	0	0	111.8	I380 H381 R382 F386 V387 I388 Y422 K425 L426	I380-I384 HydrophobicContact CG2-CD1 3.77Å; I380-I384 HydrophobicContact CG2-CG1 4.45Å; I380-I384 VanDerWaalsContact O-CG1 3.25Å; I380-I384 WeakPolarHBondContact O-CG1 3.19Å; I380-I384 PolarHBondContact O-N 3.46Å; H381-I384 PolarHBondContact O-N 3.02Å; R382-I384 VanDerWaalsContact C-N 3.28Å; R382-I384 PolarHBondContact O-N 2.68Å; I384-F386 VanDerWaalsContact C-N 3.33Å; I384-F386 PolarHBondContact O-N 2.78Å; I384-V387 PolarHBondContact O-N 2.88Å; I384-I388 HydrophobicContact CG2-CD1 3.56Å; I384-I388 HydrophobicContact CG2-CG1 4.24Å; I384-I388 WeakPolarHBondContact O-CB 3.45Å; I384-I388 VanDerWaalsContact O-CG1 3.23Å; I384-I388 WeakPolarHBondContact O-CG1 3.23Å; I384-I388 PolarHBondContact O-N 2.99Å; I384-Y422 HydrophobicContact CD1-CD2 3.95Å; I384-Y422 HydrophobicContact CG1-CD2 3.59Å; I384-Y422 HydrophobicContact CG1-CE2 3.69Å; I384-K425 HydrophobicContact CD1-CB 3.61Å; I384-K425 HydrophobicContact CD1-CG 3.5Å; I384-K425 VanDerWaalsContact CD1-CG 3.5Å; I384-L426 HydrophobicContact CG1-CB 4.37Å; I384-L426 HydrophobicContact CG2-CD1 4.17Å
385	E	85.5	Confident	84.3	Confident	93 Å²	93	47.8 Å²	47.8	44%	0.435	25%	0.248	S	C	.	.	H	α-helix	trans	-56.4	-47.1	176.7	-73.6	169.9	-166.8	0	0	111.5	H381 R382 V383 R389	H381-E385 WeakPolarHBondContact O-CG 3.23Å; H381-E385 PolarHBondContact O-N 2.7Å; R382-E385 IonicContact CZ-OE2 2.61Å; R382-E385 IonicContact NE-OE2 2.69Å; R382-E385 IonicContact NH1-OE1 3.11Å; R382-E385 IonicContact NH1-OE2 2.83Å; R382-E385 PolarHBondContact NH1-OE2 3.17Å; R382-E385 PolarHBondContact O-N 2.92Å; V383-E385 PolarHBondContact O-N 3.12Å; E385-R389 WeakPolarHBondContact O-CB 3.3Å; E385-R389 PolarHBondContact O-N 3.4Å; E385-R389 VanDerWaalsContact O-N 3.08Å
386	F	83.4	Confident	83.7	Confident	12 Å²	12	45.8 Å²	45.8	5%	0.053	24%	0.237	C	C	.	.	H	α-helix	trans	-70.1	-41.9	178.1	-82.2	-103.5	0	0	0	112.5	V76 E79 F80 T83 R382 V383 I384 I388 R389 E390 F394	V76-F386 HydrophobicContact CG1-CD1 4.01Å; V76-F386 HydrophobicContact CG1-CE1 4.47Å; E79-F386 HydrophobicContact CB-CE1 4.39Å; E79-F386 HydrophobicContact CG-CE1 4.26Å; E79-F386 HydrophobicContact CG-CZ 4.37Å; F80-F386 HydrophobicContact CB-CD1 3.96Å; F80-F386 HydrophobicContact CB-CE1 3.74Å; F80-F386 HydrophobicContact CB-CG 4.47Å; F80-F386 HydrophobicContact CB-CZ 4.07Å; F80-F386 HydrophobicContact CD2-CB 4.45Å; F80-F386 HydrophobicContact CD2-CD1 4.18Å; F80-F386 AromaticContact CD2-CD2 3.66Å; F80-F386 HydrophobicContact CD2-CD2 3.66Å; F80-F386 HydrophobicContact CD2-CE1 4.34Å; F80-F386 AromaticContact CD2-CE2 3.83Å; F80-F386 HydrophobicContact CD2-CE2 3.83Å; F80-F386 AromaticContact CD2-CG 3.84Å; F80-F386 HydrophobicContact CD2-CG 3.84Å; F80-F386 HydrophobicContact CD2-CZ 4.17Å; F80-F386 HydrophobicContact CE2-CD2 4.32Å; T83-F386 HydrophobicContact CG2-CE2 4.46Å; T83-F386 HydrophobicContact CG2-CZ 4.1Å; R382-F386 WeakPolarHBondContact O-CD2 2.84Å; R382-F386 PolarHBondContact O-N 2.98Å; V383-F386 PolarHBondContact O-N 2.99Å; I384-F386 VanDerWaalsContact C-N 3.33Å; I384-F386 PolarHBondContact O-N 2.78Å; F386-I388 VanDerWaalsContact C-N 3.28Å; F386-I388 PolarHBondContact O-N 3.19Å; F386-R389 PolarHBondContact O-N 2.98Å; F386-E390 VanDerWaalsContact O-CB 3.22Å; F386-E390 WeakPolarHBondContact O-CB 3.23Å; F386-E390 WeakPolarHBondContact O-CG 3.48Å; F386-E390 PolarHBondContact O-N 3.2Å; F386-F394 HydrophobicContact CB-CD1 3.86Å; F386-F394 HydrophobicContact CB-CE1 3.37Å; F386-F394 HydrophobicContact CB-CE2 4.24Å; F386-F394 HydrophobicContact CB-CG 4.49Å; F386-F394 HydrophobicContact CB-CZ 3.58Å; F386-F394 HydrophobicContact CD1-CE2 4.14Å; F386-F394 HydrophobicContact CD1-CZ 4.09Å; F386-F394 HydrophobicContact CG-CE1 4.3Å; F386-F394 HydrophobicContact CG-CZ 4.03Å
387	V	82	Confident	83	Confident	11 Å²	11	45.1 Å²	45.1	7%	0.067	23%	0.233	C	C	.	.	H	α-helix	trans	-61.2	-37.7	176.9	172.1	0	0	0	0	111.4	V383 I384 G391 F394 E395 L426	V383-V387 HydrophobicContact CG1-CG2 3.86Å; V383-V387 WeakPolarHBondContact O-CB 3.23Å; V383-V387 VanDerWaalsContact O-CG2 3.22Å; V383-V387 WeakPolarHBondContact O-CG2 3.28Å; V383-V387 PolarHBondContact O-N 3.3Å; I384-V387 PolarHBondContact O-N 2.88Å; V387-G391 CarbonylContact O-C 3.58Å; V387-G391 WeakPolarHBondContact O-CA 3.26Å; V387-G391 PolarHBondContact O-N 3.3Å; V387-F394 HydrophobicContact CG2-CD1 3.75Å; V387-F394 HydrophobicContact CG2-CE1 4.22Å; V387-E395 HydrophobicContact CG2-CB 4Å; V387-L426 HydrophobicContact CG1-CD1 3.98Å; V387-L426 HydrophobicContact CG1-CD2 4.07Å
388	I	79.2	Confident	82.8	Confident	68 Å²	68	43.3 Å²	43.3	35%	0.349	22%	0.224	S	C	.	.	H	α-helix	trans	-70.1	-40.5	176.5	-69.7	171.7	0	0	0	111.3	I384 F386 L426 V429 L430	I384-I388 HydrophobicContact CG2-CD1 3.56Å; I384-I388 HydrophobicContact CG2-CG1 4.24Å; I384-I388 WeakPolarHBondContact O-CB 3.45Å; I384-I388 VanDerWaalsContact O-CG1 3.23Å; I384-I388 WeakPolarHBondContact O-CG1 3.23Å; I384-I388 PolarHBondContact O-N 2.99Å; F386-I388 VanDerWaalsContact C-N 3.28Å; F386-I388 PolarHBondContact O-N 3.19Å; I388-L426 HydrophobicContact CD1-CD1 4.18Å; I388-L426 HydrophobicContact CG1-CD1 3.69Å; I388-V429 HydrophobicContact CD1-CB 3.77Å; I388-V429 HydrophobicContact CD1-CG1 3.37Å; I388-L430 HydrophobicContact CG1-CD2 4.14Å; I388-L430 HydrophobicContact CG1-CG 4.5Å
389	R	81.9	Confident	82.5	Confident	132 Å²	132	42.8 Å²	42.8	50%	0.498	22%	0.215	S	C	.	.	H	α-helix	trans	-71.9	-37.5	-178.3	-168.9	178.6	74.6	167.2	8.9	112.5	E79 E385 F386	E79-R389 IonicContact OE1-CZ 3.52Å; E79-R389 IonicContact OE1-NH1 3.68Å; E79-R389 PolarHBondContact OE1-NH1 3.24Å; E79-R389 IonicContact OE1-NH2 3.77Å; E79-R389 PolarHBondContact OE1-NH2 3.36Å; E79-R389 VanDerWaalsContact OE1-NH2 3.14Å; E79-R389 IonicContact OE2-CZ 3.86Å; E79-R389 IonicContact OE2-NH1 3.84Å; E79-R389 IonicContact OE2-NH2 2.68Å; E79-R389 PolarHBondContact OE2-NH2 2.86Å; E385-R389 WeakPolarHBondContact O-CB 3.3Å; E385-R389 PolarHBondContact O-N 3.4Å; E385-R389 VanDerWaalsContact O-N 3.08Å; F386-R389 PolarHBondContact O-N 2.98Å
390	E	78.4	Confident	82	Confident	73 Å²	73	51.2 Å²	51.2	34%	0.341	25%	0.246	S	C	.	.	H	α-helix	trans	-113.3	-18.8	-164.6	-52.8	-69.7	168.6	0	0	113	V76 F386 F394	V76-E390 HydrophobicContact CB-CG 4.43Å; V76-E390 HydrophobicContact CG1-CB 4.08Å; V76-E390 VanDerWaalsContact CG1-CD 3.47Å; V76-E390 HydrophobicContact CG1-CG 3.35Å; V76-E390 VanDerWaalsContact CG2-CD 3.44Å; V76-E390 HydrophobicContact CG2-CG 4.27Å; V76-E390 VanDerWaalsContact CG2-OE2 3.29Å; V76-E390 WeakPolarHBondContact CG2-OE2 3.46Å; F386-E390 VanDerWaalsContact O-CB 3.22Å; F386-E390 WeakPolarHBondContact O-CB 3.23Å; F386-E390 WeakPolarHBondContact O-CG 3.48Å; F386-E390 PolarHBondContact O-N 3.2Å; E390-F394 HydrophobicContact CB-CB 3.93Å; E390-F394 HydrophobicContact CB-CG 4.43Å
391	G	73.6	Confident	81.7	Confident	21 Å²	21	56.9 Å²	56.9	22%	0.216	27%	0.267	C	S	.	.			trans	91.1	-176.5	179	0	0	0	0	0	114.7	V387 M393 F394	V387-G391 CarbonylContact O-C 3.58Å; V387-G391 WeakPolarHBondContact O-CA 3.26Å; V387-G391 PolarHBondContact O-N 3.3Å; G391-M393 VanDerWaalsContact C-N 3.29Å; G391-M393 PolarHBondContact O-N 3.42Å; G391-F394 WeakPolarHBondContact O-CB 3.17Å; G391-F394 PolarHBondContact O-N 3.05Å
392	P	80.9	Confident	81.7	Confident	78 Å²	78	56.3 Å²	56.3	51%	0.506	27%	0.265	S	S	.	.	H	α-helix	trans	-71.5	-17.8	-170.4	28.3	-35.9	0	0	0	114.4	F394 E395 A396	P392-F394 VanDerWaalsContact C-N 3.26Å; P392-F394 PolarHBondContact O-N 3.39Å; P392-E395 WeakPolarHBondContact O-CB 3.44Å; P392-E395 PolarHBondContact O-N 3.44Å; P392-A396 PolarHBondContact O-N 3.28Å; P392-A396 VanDerWaalsContact O-N 3.08Å
393	M	72.2	Confident	81.5	Confident	70 Å²	70	57.8 Å²	57.8	35%	0.345	27%	0.274	S	S	.	.	H	α-helix	trans	-64.4	-34.4	174.1	-71.5	-69.4	95.7	0	0	111.7	G391 A396 M397	G391-M393 VanDerWaalsContact C-N 3.29Å; G391-M393 PolarHBondContact O-N 3.42Å; M393-A396 PolarHBondContact O-N 2.96Å; M393-M397 WeakPolarHBondContact O-CB 3.5Å; M393-M397 PolarHBondContact O-N 3.43Å
394	F	79.4	Confident	81.6	Confident	2 Å²	2	64.2 Å²	64.2	1%	0.009	31%	0.308	C	S	.	.	H	α-helix	trans	-61.6	-46	172.8	174	-96.9	0	0	0	111.4	V76 L77 F80 F386 V387 E390 G391 P392 A396 M397 L398	V76-F394 HydrophobicContact CG1-CD2 3.64Å; V76-F394 HydrophobicContact CG1-CE2 3.98Å; L77-F394 HydrophobicContact CD1-CE2 3.95Å; L77-F394 HydrophobicContact CD1-CZ 4.43Å; F80-F394 HydrophobicContact CB-CE2 3.97Å; F80-F394 HydrophobicContact CB-CZ 3.93Å; F80-F394 HydrophobicContact CD1-CZ 4.14Å; F80-F394 AromaticContact CD2-CZ 3.82Å; F80-F394 HydrophobicContact CD2-CZ 3.82Å; F80-F394 HydrophobicContact CE2-CZ 4.34Å; F80-F394 HydrophobicContact CG-CE2 4.23Å; F80-F394 AromaticContact CG-CZ 3.7Å; F80-F394 HydrophobicContact CG-CZ 3.7Å; F386-F394 HydrophobicContact CB-CD1 3.86Å; F386-F394 HydrophobicContact CB-CE1 3.37Å; F386-F394 HydrophobicContact CB-CE2 4.24Å; F386-F394 HydrophobicContact CB-CG 4.49Å; F386-F394 HydrophobicContact CB-CZ 3.58Å; F386-F394 HydrophobicContact CD1-CE2 4.14Å; F386-F394 HydrophobicContact CD1-CZ 4.09Å; F386-F394 HydrophobicContact CG-CE1 4.3Å; F386-F394 HydrophobicContact CG-CZ 4.03Å; V387-F394 HydrophobicContact CG2-CD1 3.75Å; V387-F394 HydrophobicContact CG2-CE1 4.22Å; E390-F394 HydrophobicContact CB-CB 3.93Å; E390-F394 HydrophobicContact CB-CG 4.43Å; G391-F394 WeakPolarHBondContact O-CB 3.17Å; G391-F394 PolarHBondContact O-N 3.05Å; P392-F394 VanDerWaalsContact C-N 3.26Å; P392-F394 PolarHBondContact O-N 3.39Å; F394-A396 PolarHBondContact O-N 2.94Å; F394-M397 HydrophobicContact CD2-CE 3.93Å; F394-M397 PolarHBondContact O-N 3.37Å; F394-L398 HydrophobicContact CE1-CD2 4.06Å; F394-L398 HydrophobicContact CZ-CD2 4.32Å; F394-L398 VanDerWaalsContact O-CB 3.29Å; F394-L398 WeakPolarHBondContact O-CB 3.3Å; F394-L398 PolarHBondContact O-N 2.97Å
395	E	79.5	Confident	81.8	Confident	17 Å²	17	66.1 Å²	66.1	8%	0.079	32%	0.319	C	S	.	.	H	α-helix	trans	-57.4	-49.2	175.8	-177.4	179.7	-168.1	0	0	111.2	V387 P392 M397 L398 M399 Y422 R423	V387-E395 HydrophobicContact CG2-CB 4Å; P392-E395 WeakPolarHBondContact O-CB 3.44Å; P392-E395 PolarHBondContact O-N 3.44Å; E395-M397 VanDerWaalsContact C-N 3.34Å; E395-M397 PolarHBondContact O-N 3.31Å; E395-L398 PolarHBondContact O-N 3.45Å; E395-M399 HydrophobicContact CG-SD 4.19Å; E395-M399 WeakPolarHBondContact O-CB 3.42Å; E395-M399 VanDerWaalsContact O-CG 3.29Å; E395-M399 WeakPolarHBondContact O-CG 3.19Å; E395-M399 PolarHBondContact O-N 3.25Å; E395-Y422 WeakPolarHBondContact OE1-CE1 3.32Å; E395-Y422 PolarHBondContact OE1-OH 3.09Å; E395-Y422 PolarHBondContact OE2-OH 3.2Å; E395-R423 IonicContact OE1-CZ 2.76Å; E395-R423 IonicContact OE1-NH1 3.74Å; E395-R423 PolarHBondContact OE1-NH1 2.87Å; E395-R423 IonicContact OE1-NH2 3.57Å; E395-R423 PolarHBondContact OE1-NH2 2.78Å; E395-R423 IonicContact OE2-NH1 3.45Å; E395-R423 PolarHBondContact OE2-NH1 2.91Å
396	A	76	Confident	82	Confident	51 Å²	51	66.4 Å²	66.4	42%	0.421	33%	0.329	S	S	.	.	H	α-helix	trans	-61.4	-41.7	-178.9	0	0	0	0	0	112.7	P392 M393 F394 W400	P392-A396 PolarHBondContact O-N 3.28Å; P392-A396 VanDerWaalsContact O-N 3.08Å; M393-A396 PolarHBondContact O-N 2.96Å; F394-A396 PolarHBondContact O-N 2.94Å; A396-W400 PolarHBondContact O-N 3.35Å
397	M	78.6	Confident	82.2	Confident	30 Å²	30	68.7 Å²	68.7	15%	0.148	35%	0.346	C	S	.	.	H	α-helix	trans	-71.2	-39.3	178	178.3	-168	48.8	0	0	112	A73 K74 L77 M393 F394 E395 M399 W400 R401	A73-M397 VanDerWaalsContact C-CE 3.5Å; A73-M397 VanDerWaalsContact C-SD 3.54Å; A73-M397 HydrophobicContact CB-CE 3.7Å; A73-M397 HydrophobicContact CB-SD 3.84Å; A73-M397 WeakPolarHBondContact O-CE 3.1Å; K74-M397 HydrophobicContact CG-SD 4.21Å; L77-M397 HydrophobicContact CB-CE 3.54Å; L77-M397 HydrophobicContact CB-SD 4.07Å; L77-M397 HydrophobicContact CD1-CE 4.4Å; L77-M397 HydrophobicContact CD2-CE 4.01Å; L77-M397 HydrophobicContact CD2-CG 4.02Å; L77-M397 HydrophobicContact CD2-SD 3.93Å; L77-M397 HydrophobicContact CG-CE 4.2Å; M393-M397 WeakPolarHBondContact O-CB 3.5Å; M393-M397 PolarHBondContact O-N 3.43Å; F394-M397 HydrophobicContact CD2-CE 3.93Å; F394-M397 PolarHBondContact O-N 3.37Å; E395-M397 VanDerWaalsContact C-N 3.34Å; E395-M397 PolarHBondContact O-N 3.31Å; M397-M399 VanDerWaalsContact C-N 3.35Å; M397-W400 PolarHBondContact O-N 3.37Å; M397-R401 PolarHBondContact O-N 2.9Å
398	L	83.1	Confident	82.7	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.005	35%	0.345	C	S	.	.	H	α-helix	trans	-60.8	-45.7	174	-179.8	64.1	0	0	0	110.5	L77 F80 V383 F394 E395 W400 R401 E402 F408 L411	L77-L398 HydrophobicContact CD1-CD1 3.85Å; F80-L398 HydrophobicContact CD1-CD1 4.16Å; F80-L398 HydrophobicContact CE1-CD1 3.7Å; F80-L398 HydrophobicContact CE1-CD2 4.36Å; F80-L398 HydrophobicContact CZ-CD1 4.5Å; F80-L398 HydrophobicContact CZ-CD2 4.39Å; V383-L398 HydrophobicContact CB-CD2 4.43Å; V383-L398 HydrophobicContact CG1-CD2 3.78Å; V383-L398 HydrophobicContact CG2-CD2 3.75Å; F394-L398 HydrophobicContact CE1-CD2 4.06Å; F394-L398 HydrophobicContact CZ-CD2 4.32Å; F394-L398 VanDerWaalsContact O-CB 3.29Å; F394-L398 WeakPolarHBondContact O-CB 3.3Å; F394-L398 PolarHBondContact O-N 2.97Å; E395-L398 PolarHBondContact O-N 3.45Å; L398-W400 VanDerWaalsContact C-N 3.3Å; L398-W400 PolarHBondContact O-N 2.93Å; L398-R401 PolarHBondContact O-N 3.11Å; L398-E402 HydrophobicContact CD1-CG 3.77Å; L398-E402 WeakPolarHBondContact O-CB 3.46Å; L398-E402 PolarHBondContact O-N 2.92Å; L398-F408 HydrophobicContact CD1-CD1 4.33Å; L398-F408 HydrophobicContact CD1-CE1 3.89Å; L398-F408 HydrophobicContact CD1-CZ 4.24Å; L398-F408 HydrophobicContact CD2-CD1 4.17Å; L398-F408 HydrophobicContact CD2-CE1 3.93Å; L398-F408 HydrophobicContact CG-CD1 4.29Å; L398-F408 HydrophobicContact CG-CE1 4.21Å; L398-L411 HydrophobicContact CD2-CD1 3.85Å; L398-L411 HydrophobicContact CG-CD1 4.04Å
399	M	83	Confident	83.3	Confident	53 Å²	53	68.4 Å²	68.4	26%	0.261	35%	0.349	S	S	.	.	H	α-helix	trans	-59	-39.5	173.6	-73.3	178.5	75	0	0	112.3	E395 M397 K403 L411 F412	E395-M399 HydrophobicContact CG-SD 4.19Å; E395-M399 WeakPolarHBondContact O-CB 3.42Å; E395-M399 VanDerWaalsContact O-CG 3.29Å; E395-M399 WeakPolarHBondContact O-CG 3.19Å; E395-M399 PolarHBondContact O-N 3.25Å; M397-M399 VanDerWaalsContact C-N 3.35Å; M399-K403 PolarHBondContact O-N 3.17Å; M399-L411 WeakPolarHBondContact CE-O 3.47Å; M399-L411 HydrophobicContact CG-CB 3.91Å; M399-L411 HydrophobicContact CG-CD1 4.03Å; M399-L411 HydrophobicContact CG-CG 4.49Å; M399-F412 HydrophobicContact CB-CE1 3.8Å; M399-F412 HydrophobicContact CB-CZ 3.97Å; M399-F412 HydrophobicContact CE-CD1 3.83Å; M399-F412 HydrophobicContact CE-CE1 3.94Å; M399-F412 HydrophobicContact CG-CE1 4.15Å; M399-F412 HydrophobicContact CG-CZ 4.25Å; M399-F412 WeakPolarHBondContact O-CE1 3.35Å; M399-F412 WeakPolarHBondContact O-CZ 3.47Å
400	W	82	Confident	83.7	Confident	197 Å²	197	62.3 Å²	62.3	75%	0.746	33%	0.326	S	S	*	.	H	α-helix	trans	-69.3	-39.7	179.5	-172.4	83.8	0	0	0	112.7	A396 M397 L398	A396-W400 PolarHBondContact O-N 3.35Å; M397-W400 PolarHBondContact O-N 3.37Å; L398-W400 VanDerWaalsContact C-N 3.3Å; L398-W400 PolarHBondContact O-N 2.93Å
401	R	85.1	Confident	84.1	Confident	119 Å²	119	58.9 Å²	58.9	45%	0.449	31%	0.31	S	S	.	.	H	α-helix	trans	-75.3	-41.2	179.8	-69.3	-133.3	-172	170.5	4.8	113.5	L77 M397 L398	L77-R401 HydrophobicContact CD2-CB 4.36Å; L77-R401 VanDerWaalsContact CD2-CD 3.48Å; L77-R401 HydrophobicContact CD2-CG 3.78Å; M397-R401 PolarHBondContact O-N 2.9Å; L398-R401 PolarHBondContact O-N 3.11Å
402	E	88.7	Confident	84.7	Confident	47 Å²	47	61.4 Å²	61.4	22%	0.22	32%	0.315	C	S	.	.	S	Bend	trans	-100.6	18.2	-170.5	-63.6	-62.5	144.9	0	0	113.5	L398 D404 N405 F408	L398-E402 HydrophobicContact CD1-CG 3.77Å; L398-E402 WeakPolarHBondContact O-CB 3.46Å; L398-E402 PolarHBondContact O-N 2.92Å; E402-D404 PolarHBondContact O-N 3.05Å; E402-D404 VanDerWaalsContact O-N 3.14Å; E402-N405 HydrophobicContact CB-CB 4.28Å; E402-N405 PolarHBondContact O-N 3.09Å; E402-N405 WeakPolarHBondContact OE2-CB 3.41Å; E402-N405 PolarHBondContact OE2-ND2 3.41Å; E402-F408 HydrophobicContact CB-CB 3.96Å; E402-F408 HydrophobicContact CB-CD1 4.48Å; E402-F408 HydrophobicContact CB-CD2 3.58Å; E402-F408 HydrophobicContact CB-CE2 4.17Å; E402-F408 HydrophobicContact CB-CG 3.75Å; E402-F408 HydrophobicContact CG-CD2 3.72Å; E402-F408 HydrophobicContact CG-CE2 3.76Å; E402-F408 HydrophobicContact CG-CG 4.17Å; E402-F408 HydrophobicContact CG-CZ 4.27Å
403	K	85.8	Confident	85	Confident	130 Å²	130	61.7 Å²	61.7	57%	0.565	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-30.6	-178.8	65.5	171.7	-168.7	168.3	0	114.5	M399 F412	M399-K403 PolarHBondContact O-N 3.17Å; K403-F412 VanDerWaalsContact CA-CZ 3.42Å; K403-F412 HydrophobicContact CB-CE1 4.13Å; K403-F412 HydrophobicContact CB-CZ 3.97Å
404	D	89.8	Confident	85.2	Confident	135 Å²	135	62.6 Å²	62.6	72%	0.722	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-3.6	-177.4	-57.2	-47.4	0	0	0	111.7	E402	E402-D404 PolarHBondContact O-N 3.05Å; E402-D404 VanDerWaalsContact O-N 3.14Å
405	N	89.2	Confident	85	Confident	48 Å²	48	68.7 Å²	68.7	26%	0.257	35%	0.348	S	S	.	.			trans	-92.3	116.4	-178.5	-174.3	-15.7	0	0	0	111.1	E402 S407 F408	E402-N405 HydrophobicContact CB-CB 4.28Å; E402-N405 PolarHBondContact O-N 3.09Å; E402-N405 WeakPolarHBondContact OE2-CB 3.41Å; E402-N405 PolarHBondContact OE2-ND2 3.41Å; N405-S407 PolarHBondContact O-N 3.14Å; N405-S407 VanDerWaalsContact O-N 3.13Å; N405-S407 VanDerWaalsContact OD1-CB 3.24Å; N405-S407 WeakPolarHBondContact OD1-CB 3.47Å; N405-S407 PolarHBondContact OD1-N 2.99Å; N405-S407 PolarHBondContact OD1-OG 2.89Å; N405-S407 VanDerWaalsContact OD1-OG 3.04Å; N405-F408 HydrophobicContact CB-CD2 4.04Å; N405-F408 PolarHBondContact O-N 3.26Å
406	P	90.4	Very high	85.4	Confident	100 Å²	100	68.8 Å²	68.8	65%	0.649	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-63.7	-22.9	-177.8	26.7	-35.4	0	0	0	113.3	F408 S409	P406-F408 PolarHBondContact O-N 3.29Å; P406-S409 WeakPolarHBondContact O-CB 3.37Å; P406-S409 PolarHBondContact O-N 3.24Å; P406-S409 VanDerWaalsContact O-N 3.11Å; P406-S409 PolarHBondContact O-OG 3.47Å
407	S	88.4	Confident	85.9	Confident	59 Å²	59	69.3 Å²	69.3	41%	0.413	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-63.2	-26.3	176.4	-50.3	0	0	0	0	112.4	N405	N405-S407 PolarHBondContact O-N 3.14Å; N405-S407 VanDerWaalsContact O-N 3.13Å; N405-S407 VanDerWaalsContact OD1-CB 3.24Å; N405-S407 WeakPolarHBondContact OD1-CB 3.47Å; N405-S407 PolarHBondContact OD1-N 2.99Å; N405-S407 PolarHBondContact OD1-OG 2.89Å; N405-S407 VanDerWaalsContact OD1-OG 3.04Å
408	F	91.5	Very high	86.3	Confident	12 Å²	12	68.2 Å²	68.2	5%	0.053	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-101.8	10.2	177.8	-66.6	-85.4	0	0	0	113.2	F80 L379 V383 L398 E402 N405 P406 F410 L411 F412	F80-F408 HydrophobicContact CE1-CE1 4.06Å; F80-F408 AromaticContact CE1-CZ 3.87Å; F80-F408 HydrophobicContact CE1-CZ 3.87Å; F80-F408 HydrophobicContact CZ-CE1 4.02Å; F80-F408 HydrophobicContact CZ-CZ 4.11Å; L379-F408 HydrophobicContact CD1-CE1 4.22Å; L379-F408 HydrophobicContact CD1-CE2 4.24Å; L379-F408 HydrophobicContact CD1-CZ 3.92Å; L379-F408 HydrophobicContact CD2-CD1 3.96Å; L379-F408 HydrophobicContact CD2-CE1 3.74Å; L379-F408 HydrophobicContact CD2-CZ 4.3Å; L379-F408 HydrophobicContact CG-CE1 4.22Å; L379-F408 HydrophobicContact CG-CZ 4.34Å; V383-F408 HydrophobicContact CG2-CE1 3.96Å; L398-F408 HydrophobicContact CD1-CD1 4.33Å; L398-F408 HydrophobicContact CD1-CE1 3.89Å; L398-F408 HydrophobicContact CD1-CZ 4.24Å; L398-F408 HydrophobicContact CD2-CD1 4.17Å; L398-F408 HydrophobicContact CD2-CE1 3.93Å; L398-F408 HydrophobicContact CG-CD1 4.29Å; L398-F408 HydrophobicContact CG-CE1 4.21Å; E402-F408 HydrophobicContact CB-CB 3.96Å; E402-F408 HydrophobicContact CB-CD1 4.48Å; E402-F408 HydrophobicContact CB-CD2 3.58Å; E402-F408 HydrophobicContact CB-CE2 4.17Å; E402-F408 HydrophobicContact CB-CG 3.75Å; E402-F408 HydrophobicContact CG-CD2 3.72Å; E402-F408 HydrophobicContact CG-CE2 3.76Å; E402-F408 HydrophobicContact CG-CG 4.17Å; E402-F408 HydrophobicContact CG-CZ 4.27Å; N405-F408 HydrophobicContact CB-CD2 4.04Å; N405-F408 PolarHBondContact O-N 3.26Å; P406-F408 PolarHBondContact O-N 3.29Å; F408-F410 HydrophobicContact CD1-CE1 4.19Å; F408-F410 PolarHBondContact O-N 2.92Å; F408-F410 VanDerWaalsContact O-N 3.08Å; F408-L411 HydrophobicContact CB-CD1 4.3Å; F408-L411 HydrophobicContact CD1-CD1 3.92Å; F408-L411 WeakPolarHBondContact O-CB 3.29Å; F408-L411 PolarHBondContact O-N 3.2Å; F408-F412 HydrophobicContact CB-CE2 4.35Å; F408-F412 VanDerWaalsContact O-CD2 3.27Å; F408-F412 WeakPolarHBondContact O-CD2 3.42Å; F408-F412 WeakPolarHBondContact O-CE2 3.3Å
409	S	91.1	Very high	86.6	Confident	62 Å²	62	68.3 Å²	68.3	43%	0.434	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-51.9	-34	178.1	55	0	0	0	0	113.3	P406 L411 F412 D413	P406-S409 WeakPolarHBondContact O-CB 3.37Å; P406-S409 PolarHBondContact O-N 3.24Å; P406-S409 VanDerWaalsContact O-N 3.11Å; P406-S409 PolarHBondContact O-OG 3.47Å; S409-L411 PolarHBondContact O-N 3.12Å; S409-L411 VanDerWaalsContact O-N 3.14Å; S409-F412 PolarHBondContact O-N 3.27Å; S409-D413 PolarHBondContact O-N 2.93Å
410	F	91.6	Very high	86.7	Confident	3 Å²	3	66 Å²	66	1%	0.013	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-62	-17.6	177	78.1	-84.6	0	0	0	114.1	L376 L379 I380 V383 F408 H419 Y422	L376-F410 HydrophobicContact CD1-CD1 3.81Å; L376-F410 HydrophobicContact CD1-CE1 4.41Å; L376-F410 HydrophobicContact CD1-CG 4.46Å; L379-F410 HydrophobicContact CD2-CD1 4.34Å; L379-F410 HydrophobicContact CD2-CE1 3.28Å; L379-F410 HydrophobicContact CD2-CZ 3.76Å; I380-F410 HydrophobicContact CD1-CD2 4.22Å; I380-F410 HydrophobicContact CD1-CG 4.22Å; I380-F410 HydrophobicContact CG1-CD1 4.1Å; I380-F410 HydrophobicContact CG1-CD2 3.81Å; I380-F410 HydrophobicContact CG1-CE1 4Å; I380-F410 HydrophobicContact CG1-CE2 3.68Å; I380-F410 HydrophobicContact CG1-CG 4.02Å; I380-F410 HydrophobicContact CG1-CZ 3.78Å; V383-F410 HydrophobicContact CB-CZ 4.49Å; V383-F410 HydrophobicContact CG2-CZ 4.14Å; F408-F410 HydrophobicContact CD1-CE1 4.19Å; F408-F410 PolarHBondContact O-N 2.92Å; F408-F410 VanDerWaalsContact O-N 3.08Å; F410-H419 WeakPolarHBondContact O-CA 3.36Å; F410-H419 WeakPolarHBondContact O-CB 3.4Å; F410-H419 PolarHBondContact O-ND1 2.8Å; F410-Y422 HydrophobicContact CD2-CD1 4.25Å; F410-Y422 AromaticContact CD2-CG 3.92Å; F410-Y422 HydrophobicContact CD2-CG 3.92Å; F410-Y422 HydrophobicContact CE2-CD1 4.16Å; F410-Y422 AromaticContact CE2-CD2 3.84Å; F410-Y422 HydrophobicContact CE2-CD2 3.84Å; F410-Y422 HydrophobicContact CE2-CE2 4.42Å; F410-Y422 AromaticContact CE2-CG 3.69Å; F410-Y422 HydrophobicContact CE2-CG 3.69Å
411	L	86.6	Confident	87	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-78.4	-23.8	173.9	-66.9	176.6	0	0	0	112.3	L398 M399 F408 S409 Y422	L398-L411 HydrophobicContact CD2-CD1 3.85Å; L398-L411 HydrophobicContact CG-CD1 4.04Å; M399-L411 WeakPolarHBondContact CE-O 3.47Å; M399-L411 HydrophobicContact CG-CB 3.91Å; M399-L411 HydrophobicContact CG-CD1 4.03Å; M399-L411 HydrophobicContact CG-CG 4.49Å; F408-L411 HydrophobicContact CB-CD1 4.3Å; F408-L411 HydrophobicContact CD1-CD1 3.92Å; F408-L411 WeakPolarHBondContact O-CB 3.29Å; F408-L411 PolarHBondContact O-N 3.2Å; S409-L411 PolarHBondContact O-N 3.12Å; S409-L411 VanDerWaalsContact O-N 3.14Å; L411-Y422 HydrophobicContact CD2-CD1 4.14Å; L411-Y422 HydrophobicContact CD2-CE1 3.68Å; L411-Y422 HydrophobicContact CD2-CE2 4.37Å
412	F	86.5	Confident	87.2	Confident	74 Å²	74	51.5 Å²	51.5	33%	0.325	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-39.2	-173.8	-52.2	-84.5	0	0	0	112.7	M399 K403 F408 S409 N414	M399-F412 HydrophobicContact CB-CE1 3.8Å; M399-F412 HydrophobicContact CB-CZ 3.97Å; M399-F412 HydrophobicContact CE-CD1 3.83Å; M399-F412 HydrophobicContact CE-CE1 3.94Å; M399-F412 HydrophobicContact CG-CE1 4.15Å; M399-F412 HydrophobicContact CG-CZ 4.25Å; M399-F412 WeakPolarHBondContact O-CE1 3.35Å; M399-F412 WeakPolarHBondContact O-CZ 3.47Å; K403-F412 VanDerWaalsContact CA-CZ 3.42Å; K403-F412 HydrophobicContact CB-CE1 4.13Å; K403-F412 HydrophobicContact CB-CZ 3.97Å; F408-F412 HydrophobicContact CB-CE2 4.35Å; F408-F412 VanDerWaalsContact O-CD2 3.27Å; F408-F412 WeakPolarHBondContact O-CD2 3.42Å; F408-F412 WeakPolarHBondContact O-CE2 3.3Å; S409-F412 PolarHBondContact O-N 3.27Å; F412-N414 PolarHBondContact O-N 3.26Å; F412-N414 VanDerWaalsContact O-N 3.12Å
413	D	85.6	Confident	87.1	Confident	84 Å²	84	52.2 Å²	52.2	45%	0.449	28%	0.281	S	S	.	.			trans	-82.2	91.9	178.4	-178.2	0.8	0	0	0	110.8	S409 Q415 S416 H419	S409-D413 PolarHBondContact O-N 2.93Å; D413-Q415 PolarHBondContact O-N 3.46Å; D413-Q415 VanDerWaalsContact O-N 3.14Å; D413-Q415 PolarHBondContact OD1-N 3.01Å; D413-S416 WeakPolarHBondContact O-CB 3.18Å; D413-S416 PolarHBondContact O-N 3.4Å; D413-S416 VanDerWaalsContact O-N 3.08Å; D413-S416 PolarHBondContact O-OG 3.41Å; D413-S416 PolarHBondContact OD1-N 3.08Å; D413-S416 WeakPolarHBondContact OD2-CB 3.48Å; D413-H419 WeakPolarHBondContact O-CB 3.17Å
414	N	77.6	Confident	87	Confident	90 Å²	90	48 Å²	48	48%	0.481	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-16.7	-179.4	-62.2	-30.9	0	0	0	114.3	F412 H419	F412-N414 PolarHBondContact O-N 3.26Å; F412-N414 VanDerWaalsContact O-N 3.12Å; N414-H419 PolarHBondContact OD1-CE1 3.39Å; N414-H419 PolarHBondContact OD1-NE2 3.27Å
415	Q	75.9	Confident	86.8	Confident	130 Å²	130	44.5 Å²	44.5	61%	0.607	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-13.6	178.3	-62	-173.1	6.3	0	0	112.4	D413	D413-Q415 PolarHBondContact O-N 3.46Å; D413-Q415 VanDerWaalsContact O-N 3.14Å; D413-Q415 PolarHBondContact OD1-N 3.01Å
416	S	86.3	Confident	86.5	Confident	18 Å²	18	42.9 Å²	42.9	13%	0.126	23%	0.231	C	C	.	.	S	Bend	trans	-61.3	142.6	178.2	70.1	0	0	0	0	111.6	D413 G418 H419 V420	D413-S416 WeakPolarHBondContact O-CB 3.18Å; D413-S416 PolarHBondContact O-N 3.4Å; D413-S416 VanDerWaalsContact O-N 3.08Å; D413-S416 PolarHBondContact O-OG 3.41Å; D413-S416 PolarHBondContact OD1-N 3.08Å; D413-S416 WeakPolarHBondContact OD2-CB 3.48Å; S416-G418 PolarHBondContact O-N 2.69Å; S416-H419 WeakPolarHBondContact O-CB 3.5Å; S416-H419 PolarHBondContact O-N 2.96Å; S416-H419 VanDerWaalsContact O-N 3.09Å; S416-H419 WeakPolarHBondContact OG-CB 3.42Å; S416-H419 PolarHBondContact OG-N 3.39Å; S416-V420 WeakPolarHBondContact O-CG2 3.48Å; S416-V420 PolarHBondContact O-N 2.93Å; S416-V420 VanDerWaalsContact O-N 3.11Å
417	P	86.6	Confident	85.8	Confident	62 Å²	62	41.6 Å²	41.6	40%	0.403	22%	0.215	S	C	.	.	H	α-helix	trans	-61.1	-29.6	173.4	24.7	-33.2	0	0	0	111.7	V369 V420 Y421	V369-P417 HydrophobicContact CB-CB 4.22Å; P417-V420 PolarHBondContact O-N 3.3Å; P417-Y421 WeakPolarHBondContact O-CB 3.41Å; P417-Y421 PolarHBondContact O-N 3.03Å
418	G	88.4	Confident	85.3	Confident	7 Å²	7	40.8 Å²	40.8	7%	0.072	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-44.2	173.1	0	0	0	0	0	112.6	S416 Y421 Y422	S416-G418 PolarHBondContact O-N 2.69Å; G418-Y421 PolarHBondContact O-N 2.85Å; G418-Y422 WeakPolarHBondContact O-CB 3.32Å; G418-Y422 PolarHBondContact O-N 3.47Å
419	H	88.8	Confident	84.5	Confident	3 Å²	3	42.6 Å²	42.6	1%	0.014	22%	0.222	C	C	.	.	H	α-helix	trans	-64.9	-45.7	176.3	-174.3	87.1	0	0	0	112.1	F331 F410 D413 N414 S416 Y421 Y422 R423	F331-H419 AromaticContact CE1-CD2 3.98Å; F331-H419 AromaticContact CE1-NE2 3.83Å; F410-H419 WeakPolarHBondContact O-CA 3.36Å; F410-H419 WeakPolarHBondContact O-CB 3.4Å; F410-H419 PolarHBondContact O-ND1 2.8Å; D413-H419 WeakPolarHBondContact O-CB 3.17Å; N414-H419 PolarHBondContact OD1-CE1 3.39Å; N414-H419 PolarHBondContact OD1-NE2 3.27Å; S416-H419 WeakPolarHBondContact O-CB 3.5Å; S416-H419 PolarHBondContact O-N 2.96Å; S416-H419 VanDerWaalsContact O-N 3.09Å; S416-H419 WeakPolarHBondContact OG-CB 3.42Å; S416-H419 PolarHBondContact OG-N 3.39Å; H419-Y421 VanDerWaalsContact C-N 3.28Å; H419-Y421 PolarHBondContact O-N 3.5Å; H419-Y422 PolarHBondContact O-N 2.98Å; H419-R423 WeakPolarHBondContact NE2-CG 3.41Å; H419-R423 PolarHBondContact O-N 2.9Å
420	V	85.8	Confident	83.6	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.024	23%	0.226	C	C	.	.	H	α-helix	trans	-58.4	-44.2	177.3	176.9	0	0	0	0	110.3	F331 V366 V368 S416 P417 W424	F331-V420 HydrophobicContact CB-CG2 4.16Å; V366-V420 HydrophobicContact CG1-CG1 3.46Å; V366-V420 VanDerWaalsContact CG1-CG1 3.46Å; V368-V420 HydrophobicContact CG2-CG1 4.2Å; S416-V420 WeakPolarHBondContact O-CG2 3.48Å; S416-V420 PolarHBondContact O-N 2.93Å; S416-V420 VanDerWaalsContact O-N 3.11Å; P417-V420 PolarHBondContact O-N 3.3Å; V420-W424 WeakPolarHBondContact O-CB 3.26Å; V420-W424 PolarHBondContact O-N 3.37Å
421	Y	86.9	Confident	82.2	Confident	12 Å²	12	48.1 Å²	48.1	5%	0.047	24%	0.243	C	C	.	.	H	α-helix	trans	-62.9	-47	174.9	-179.5	-100.1	0	0	0	112.7	V368 I370 P371 L377 I380 H381 P417 G418 H419 W424 K425	V368-Y421 HydrophobicContact CG1-CD2 3.83Å; I370-Y421 HydrophobicContact CB-CD2 4.35Å; I370-Y421 HydrophobicContact CB-CE2 4.2Å; I370-Y421 HydrophobicContact CD1-CE2 4.11Å; I370-Y421 HydrophobicContact CG1-CD2 3.86Å; I370-Y421 HydrophobicContact CG1-CE2 3.66Å; I370-Y421 HydrophobicContact CG2-CD2 4.47Å; I370-Y421 HydrophobicContact CG2-CE2 3.99Å; P371-Y421 VanDerWaalsContact CD-CG 3.42Å; P371-Y421 HydrophobicContact CG-CD1 3.86Å; P371-Y421 HydrophobicContact CG-CG 4.12Å; L377-Y421 HydrophobicContact CD1-CD1 4.28Å; L377-Y421 HydrophobicContact CD1-CE1 3.42Å; L377-Y421 VanDerWaalsContact CD1-CE1 3.42Å; I380-Y421 HydrophobicContact CD1-CD1 4.27Å; I380-Y421 HydrophobicContact CG2-CD1 3.94Å; I380-Y421 HydrophobicContact CG2-CE1 4.06Å; H381-Y421 AromaticContact NE2-CE1 3.56Å; H381-Y421 AromaticContact NE2-CZ 3.59Å; H381-Y421 PolarHBondContact NE2-OH 3.13Å; P417-Y421 WeakPolarHBondContact O-CB 3.41Å; P417-Y421 PolarHBondContact O-N 3.03Å; G418-Y421 PolarHBondContact O-N 2.85Å; H419-Y421 VanDerWaalsContact C-N 3.28Å; H419-Y421 PolarHBondContact O-N 3.5Å; Y421-W424 HydrophobicContact CD2-CE3 4.03Å; Y421-W424 HydrophobicContact CD2-CZ3 4.28Å; Y421-W424 HydrophobicContact CE2-CE3 4.01Å; Y421-W424 AromaticContact CE2-CZ3 3.81Å; Y421-W424 HydrophobicContact CE2-CZ3 3.81Å; Y421-W424 PolarHBondContact O-N 3.33Å; Y421-K425 HydrophobicContact CE1-CB 4.38Å; Y421-K425 WeakPolarHBondContact O-CB 3.45Å; Y421-K425 PolarHBondContact O-N 3.31Å
422	Y	90.2	Very high	80.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-56.4	-53.1	177.6	161.8	-112	0	0	0	111.7	I380 V383 I384 E395 F410 L411 G418 H419 K425 L426	I380-Y422 HydrophobicContact CG2-CD2 4.12Å; V383-Y422 HydrophobicContact CG1-CE2 3.99Å; I384-Y422 HydrophobicContact CD1-CD2 3.95Å; I384-Y422 HydrophobicContact CG1-CD2 3.59Å; I384-Y422 HydrophobicContact CG1-CE2 3.69Å; E395-Y422 WeakPolarHBondContact OE1-CE1 3.32Å; E395-Y422 PolarHBondContact OE1-OH 3.09Å; E395-Y422 PolarHBondContact OE2-OH 3.2Å; F410-Y422 HydrophobicContact CD2-CD1 4.25Å; F410-Y422 AromaticContact CD2-CG 3.92Å; F410-Y422 HydrophobicContact CD2-CG 3.92Å; F410-Y422 HydrophobicContact CE2-CD1 4.16Å; F410-Y422 AromaticContact CE2-CD2 3.84Å; F410-Y422 HydrophobicContact CE2-CD2 3.84Å; F410-Y422 HydrophobicContact CE2-CE2 4.42Å; F410-Y422 AromaticContact CE2-CG 3.69Å; F410-Y422 HydrophobicContact CE2-CG 3.69Å; L411-Y422 HydrophobicContact CD2-CD1 4.14Å; L411-Y422 HydrophobicContact CD2-CE1 3.68Å; L411-Y422 HydrophobicContact CD2-CE2 4.37Å; G418-Y422 WeakPolarHBondContact O-CB 3.32Å; G418-Y422 PolarHBondContact O-N 3.47Å; H419-Y422 PolarHBondContact O-N 2.98Å; Y422-K425 PolarHBondContact O-N 2.94Å; Y422-L426 VanDerWaalsContact O-CB 3.31Å; Y422-L426 WeakPolarHBondContact O-CB 3.4Å; Y422-L426 PolarHBondContact O-N 2.88Å
423	R	86.5	Confident	78	Confident	63 Å²	63	55.8 Å²	55.8	24%	0.238	29%	0.291	C	S	.	.	H	α-helix	trans	-64.2	-44.2	179.9	-71	-68.3	-166.9	-155.7	-14.5	112.2	F331 E395 H419 F427	F331-R423 HydrophobicContact CE1-CB 4.08Å; F331-R423 HydrophobicContact CE1-CG 3.86Å; E395-R423 IonicContact OE1-CZ 2.76Å; E395-R423 IonicContact OE1-NH1 3.74Å; E395-R423 PolarHBondContact OE1-NH1 2.87Å; E395-R423 IonicContact OE1-NH2 3.57Å; E395-R423 PolarHBondContact OE1-NH2 2.78Å; E395-R423 IonicContact OE2-NH1 3.45Å; E395-R423 PolarHBondContact OE2-NH1 2.91Å; H419-R423 WeakPolarHBondContact NE2-CG 3.41Å; H419-R423 PolarHBondContact O-N 2.9Å; R423-F427 VanDerWaalsContact O-CB 3.26Å; R423-F427 WeakPolarHBondContact O-CB 3.41Å; R423-F427 PolarHBondContact O-N 3.46Å
424	W	83.4	Confident	75.5	Confident	40 Å²	40	55.8 Å²	55.8	15%	0.152	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-46.8	175.4	169.8	65.5	0	0	0	111.7	V368 V420 Y421 F427 S428 F449 C451	V368-W424 HydrophobicContact CB-CD2 4.39Å; V368-W424 HydrophobicContact CB-CG 4.34Å; V368-W424 HydrophobicContact CG1-CB 4.04Å; V368-W424 HydrophobicContact CG1-CD2 3.94Å; V368-W424 HydrophobicContact CG1-CE3 3.76Å; V368-W424 HydrophobicContact CG1-CG 4.05Å; V368-W424 HydrophobicContact CG2-CB 3.76Å; V368-W424 HydrophobicContact CG2-CD2 4.1Å; V368-W424 HydrophobicContact CG2-CG 3.59Å; V420-W424 WeakPolarHBondContact O-CB 3.26Å; V420-W424 PolarHBondContact O-N 3.37Å; Y421-W424 HydrophobicContact CD2-CE3 4.03Å; Y421-W424 HydrophobicContact CD2-CZ3 4.28Å; Y421-W424 HydrophobicContact CE2-CE3 4.01Å; Y421-W424 AromaticContact CE2-CZ3 3.81Å; Y421-W424 HydrophobicContact CE2-CZ3 3.81Å; Y421-W424 PolarHBondContact O-N 3.33Å; W424-F427 PolarHBondContact O-N 3.32Å; W424-S428 VanDerWaalsContact O-CB 3.23Å; W424-S428 WeakPolarHBondContact O-CB 3.43Å; W424-S428 PolarHBondContact O-N 3.44Å; W424-F449 HydrophobicContact CB-CD1 3.76Å; W424-F449 HydrophobicContact CB-CE1 4.14Å; W424-F449 HydrophobicContact CB-CG 4.48Å; W424-F449 AromaticContact CD1-CD1 3.85Å; W424-F449 AromaticContact CD1-CG 3.78Å; W424-F449 HydrophobicContact CG-CB 4.38Å; W424-F449 HydrophobicContact CG-CD1 4.17Å; W424-C451 HydrophobicContact CD2-CB 3.89Å; W424-C451 HydrophobicContact CE3-CB 4.29Å; W424-C451 HydrophobicContact CH2-CB 3.54Å; W424-C451 WeakPolarHBondContact CH2-SG 3.44Å; W424-C451 HydrophobicContact CZ2-CB 3.07Å; W424-C451 WeakPolarHBondContact CZ2-SG 3.49Å; W424-C451 HydrophobicContact CZ3-CB 4.13Å; W424-C451 WeakPolarHBondContact CZ3-SG 3.26Å
425	K	85.6	Confident	73.4	Confident	62 Å²	62	59.3 Å²	59.3	27%	0.27	31%	0.306	S	S	.	.	H	α-helix	trans	-67.1	-43.1	-177	-176.9	63.7	177.4	175.2	0	110.6	I384 Y421 Y422 S428 V429	I384-K425 HydrophobicContact CD1-CB 3.61Å; I384-K425 HydrophobicContact CD1-CG 3.5Å; I384-K425 VanDerWaalsContact CD1-CG 3.5Å; Y421-K425 HydrophobicContact CE1-CB 4.38Å; Y421-K425 WeakPolarHBondContact O-CB 3.45Å; Y421-K425 PolarHBondContact O-N 3.31Å; Y422-K425 PolarHBondContact O-N 2.94Å; K425-S428 PolarHBondContact O-N 3.42Å; K425-V429 HydrophobicContact CD-CG2 4.37Å; K425-V429 VanDerWaalsContact O-CG2 3.31Å; K425-V429 WeakPolarHBondContact O-CG2 3.46Å; K425-V429 PolarHBondContact O-N 3.42Å
426	L	82.8	Confident	71.1	Confident	15 Å²	15	57.4 Å²	57.4	8%	0.079	30%	0.303	C	S	.	.	H	α-helix	trans	-57.2	-50.8	173.2	179.6	60.6	0	0	0	111	I384 V387 I388 Y422 S428 V429 L430	I384-L426 HydrophobicContact CG1-CB 4.37Å; I384-L426 HydrophobicContact CG2-CD1 4.17Å; V387-L426 HydrophobicContact CG1-CD1 3.98Å; V387-L426 HydrophobicContact CG1-CD2 4.07Å; I388-L426 HydrophobicContact CD1-CD1 4.18Å; I388-L426 HydrophobicContact CG1-CD1 3.69Å; Y422-L426 VanDerWaalsContact O-CB 3.31Å; Y422-L426 WeakPolarHBondContact O-CB 3.4Å; Y422-L426 PolarHBondContact O-N 2.88Å; L426-S428 PolarHBondContact O-N 3.05Å; L426-V429 PolarHBondContact O-N 2.97Å; L426-L430 HydrophobicContact CD1-CD1 3.99Å; L426-L430 HydrophobicContact CD1-CG 4.3Å; L426-L430 HydrophobicContact CG-CD1 4.01Å; L426-L430 WeakPolarHBondContact O-CB 3.43Å; L426-L430 VanDerWaalsContact O-CG 3.3Å; L426-L430 WeakPolarHBondContact O-CG 3.33Å; L426-L430 PolarHBondContact O-N 2.83Å
427	F	75.8	Confident	68.2	Low	72 Å²	72	65.5 Å²	65.5	32%	0.316	34%	0.336	S	S	.	.	H	α-helix	trans	-59.8	-44.8	176.8	178	-103.4	0	0	0	112.4	R423 W424 V429 L430 Q431 F449	R423-F427 VanDerWaalsContact O-CB 3.26Å; R423-F427 WeakPolarHBondContact O-CB 3.41Å; R423-F427 PolarHBondContact O-N 3.46Å; W424-F427 PolarHBondContact O-N 3.32Å; F427-V429 VanDerWaalsContact C-N 3.34Å; F427-V429 PolarHBondContact O-N 3.3Å; F427-L430 PolarHBondContact O-N 3.16Å; F427-Q431 HydrophobicContact CD2-CG 4.49Å; F427-Q431 HydrophobicContact CE1-CG 4.45Å; F427-Q431 HydrophobicContact CE2-CG 4.26Å; F427-Q431 VanDerWaalsContact CE2-NE2 3.33Å; F427-Q431 HydrophobicContact CZ-CG 4.29Å; F427-Q431 VanDerWaalsContact CZ-OE1 3.27Å; F427-Q431 WeakPolarHBondContact O-CB 3.23Å; F427-Q431 WeakPolarHBondContact O-CG 3.49Å; F427-Q431 PolarHBondContact O-N 3.44Å; F427-F449 HydrophobicContact CD1-CD2 4.31Å; F427-F449 HydrophobicContact CE1-CD2 4.34Å
428	S	77.5	Confident	65.3	Low	42 Å²	42	67 Å²	67	29%	0.294	35%	0.354	S	S	.	.	H	α-helix	trans	-63	-38.3	179	176.1	0	0	0	0	112.3	W424 K425 L426 A432	W424-S428 VanDerWaalsContact O-CB 3.23Å; W424-S428 WeakPolarHBondContact O-CB 3.43Å; W424-S428 PolarHBondContact O-N 3.44Å; K425-S428 PolarHBondContact O-N 3.42Å; L426-S428 PolarHBondContact O-N 3.05Å; S428-A432 PolarHBondContact O-N 3.05Å
429	V	76.2	Confident	62.2	Low	51 Å²	51	71.9 Å²	71.9	31%	0.309	38%	0.378	S	S	.	.	H	α-helix	trans	-73.5	-42.6	177.5	179.4	0	0	0	0	110.6	I388 K425 L426 F427 Q431 A432	I388-V429 HydrophobicContact CD1-CB 3.77Å; I388-V429 HydrophobicContact CD1-CG1 3.37Å; K425-V429 HydrophobicContact CD-CG2 4.37Å; K425-V429 VanDerWaalsContact O-CG2 3.31Å; K425-V429 WeakPolarHBondContact O-CG2 3.46Å; K425-V429 PolarHBondContact O-N 3.42Å; L426-V429 PolarHBondContact O-N 2.97Å; F427-V429 VanDerWaalsContact C-N 3.34Å; F427-V429 PolarHBondContact O-N 3.3Å; V429-Q431 VanDerWaalsContact C-N 3.31Å; V429-Q431 PolarHBondContact O-N 2.95Å; V429-A432 PolarHBondContact O-N 2.9Å
430	L	72.1	Confident	59.2	Low	100 Å²	100	78.6 Å²	78.6	52%	0.524	41%	0.407	S	S	.	.	H	α-helix	trans	-62.3	-36.8	177.9	-71.6	172.4	0	0	0	112.5	I388 L426 F427	I388-L430 HydrophobicContact CG1-CD2 4.14Å; I388-L430 HydrophobicContact CG1-CG 4.5Å; L426-L430 HydrophobicContact CD1-CD1 3.99Å; L426-L430 HydrophobicContact CD1-CG 4.3Å; L426-L430 HydrophobicContact CG-CD1 4.01Å; L426-L430 WeakPolarHBondContact O-CB 3.43Å; L426-L430 VanDerWaalsContact O-CG 3.3Å; L426-L430 WeakPolarHBondContact O-CG 3.33Å; L426-L430 PolarHBondContact O-N 2.83Å; F427-L430 PolarHBondContact O-N 3.16Å
431	Q	60.5	Low	56.3	Low	81 Å²	81	81 Å²	81	38%	0.379	42%	0.421	S	S	.	.	H	α-helix	trans	-76.7	-21.6	177	-76.6	-173	-29.6	0	0	114.4	F427 V429 H433 T434	F427-Q431 HydrophobicContact CD2-CG 4.49Å; F427-Q431 HydrophobicContact CE1-CG 4.45Å; F427-Q431 HydrophobicContact CE2-CG 4.26Å; F427-Q431 VanDerWaalsContact CE2-NE2 3.33Å; F427-Q431 HydrophobicContact CZ-CG 4.29Å; F427-Q431 VanDerWaalsContact CZ-OE1 3.27Å; F427-Q431 WeakPolarHBondContact O-CB 3.23Å; F427-Q431 WeakPolarHBondContact O-CG 3.49Å; F427-Q431 PolarHBondContact O-N 3.44Å; V429-Q431 VanDerWaalsContact C-N 3.31Å; V429-Q431 PolarHBondContact O-N 2.95Å; Q431-H433 VanDerWaalsContact C-N 3.26Å; Q431-H433 PolarHBondContact O-N 3.38Å; Q431-T434 PolarHBondContact O-N 2.92Å
432	A	50.6	Low	53.7	Low	67 Å²	67	83.3 Å²	83.3	55%	0.554	44%	0.439	S	S	*	.	H	α-helix	trans	-63.8	-29.6	-172.4	0	0	0	0	0	113.3	S428 V429	S428-A432 PolarHBondContact O-N 3.05Å; V429-A432 PolarHBondContact O-N 2.9Å
433	H	35.7	Very low	50.8	Low	169 Å²	169	89.9 Å²	89.9	78%	0.782	47%	0.473	S	S	*	.	S	Bend	trans	-89.7	-19.2	-177.1	-89.3	-86.5	0	0	0	115.1	Q431	Q431-H433 VanDerWaalsContact C-N 3.26Å; Q431-H433 PolarHBondContact O-N 3.38Å
434	T	33.2	Very low	48.1	Very low	83 Å²	83	93.2 Å²	93.2	51%	0.509	50%	0.495	S	S	.	.			trans	-159.5	116.9	178.9	-13.9	0	0	0	0	108.9	Q431 V436	Q431-T434 PolarHBondContact O-N 2.92Å; T434-V436 HydrophobicContact CG2-CB 3.6Å; T434-V436 HydrophobicContact CG2-CG2 3.8Å; T434-V436 PolarHBondContact O-N 3.5Å
435	F	32.6	Very low	45.8	Very low	164 Å²	164	92.5 Å²	92.5	72%	0.719	50%	0.496	S	S	*	.	S	Bend	trans	-68.3	36.1	161.1	-103.9	-92.4	0	0	0	111.1
436	V	28.2	Very low	43.2	Very low	91 Å²	91	98.4 Å²	98.4	55%	0.552	52%	0.517	S	S	*	.	S	Bend	trans	-134.8	104.3	-173.9	-178.6	0	0	0	0	107.7	T434	T434-V436 HydrophobicContact CG2-CB 3.6Å; T434-V436 HydrophobicContact CG2-CG2 3.8Å; T434-V436 PolarHBondContact O-N 3.5Å
437	F	25.8	Very low	40.8	Very low	188 Å²	188	98.5 Å²	98.5	83%	0.825	52%	0.518	S	S	*	.	S	Bend	trans	42.6	78.4	154.4	-57.7	-77.3	0	0	0	118.5
438	A	24.5	Very low	38.8	Very low	93 Å²	93	99.1 Å²	99.1	77%	0.769	52%	0.524	S	S	*	.			trans	-138.1	76	139.1	0	0	0	0	0	107.1	F440	A438-F440 VanDerWaalsContact C-N 3.29Å; A438-F440 PolarHBondContact O-N 2.93Å
439	L	24	Very low	36.7	Very low	110 Å²	110	98.9 Å²	98.9	58%	0.576	52%	0.517	S	S	*	.			trans	-60.7	101.3	163.2	-88.2	133.4	0	0	0	106.5	T441	L439-T441 HydrophobicContact CB-CG2 3.89Å; L439-T441 HydrophobicContact CD2-CG2 3.32Å; L439-T441 HydrophobicContact CG-CG2 4.12Å; L439-T441 PolarHBondContact O-N 3.31Å
440	F	26.1	Very low	34.5	Very low	143 Å²	143	97.2 Å²	97.2	63%	0.627	51%	0.507	S	S	*	.			trans	-68.6	74.2	137.8	-138.5	-92.2	0	0	0	105.5	A438 C442 W638	A438-F440 VanDerWaalsContact C-N 3.29Å; A438-F440 PolarHBondContact O-N 2.93Å; F440-C442 PolarHBondContact O-N 3.29Å; F440-W638 AromaticContact CE2-CH2 3.98Å; F440-W638 HydrophobicContact CE2-CH2 3.98Å; F440-W638 HydrophobicContact CE2-CZ2 4.26Å; F440-W638 HydrophobicContact CZ-CH2 4.43Å
441	T	24.9	Very low	32.6	Very low	54 Å²	54	93.8 Å²	93.8	33%	0.331	49%	0.492	S	S	.	.			trans	-60.3	90.2	153.2	40.8	0	0	0	0	104.4	L439 L443	L439-T441 HydrophobicContact CB-CG2 3.89Å; L439-T441 HydrophobicContact CD2-CG2 3.32Å; L439-T441 HydrophobicContact CG-CG2 4.12Å; L439-T441 PolarHBondContact O-N 3.31Å; T441-L443 PolarHBondContact O-N 3.02Å
442	C	32	Very low	31	Very low	62 Å²	62	94 Å²	94	42%	0.419	49%	0.494	S	S	.	.			trans	-55.5	101.9	135.1	-178	0	0	0	0	103.3	F440 L444 C445	F440-C442 PolarHBondContact O-N 3.29Å; C442-L444 PolarHBondContact O-N 2.98Å; C442-C445 PolarHBondContact O-N 3.39Å; C442-C445 VanDerWaalsContact O-N 3.14Å
443	L	28.9	Very low	29.7	Very low	137 Å²	137	97.8 Å²	97.8	72%	0.717	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	12.3	-174.3	-108.6	146.5	0	0	0	113.4	T441	T441-L443 PolarHBondContact O-N 3.02Å
444	L	29.3	Very low	29.4	Very low	133 Å²	133	93.3 Å²	93.3	70%	0.696	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	-13.3	179.7	-79.6	153.7	0	0	0	114.7	C442	C442-L444 PolarHBondContact O-N 2.98Å
445	C	35.7	Very low	29.3	Very low	26 Å²	26	92.1 Å²	92.1	18%	0.176	48%	0.476	C	S	.	.			trans	-151.8	100.2	-170.9	-99.6	0	0	0	0	114.9	P330 I361 C442 V447	P330-C445 HydrophobicContact CG-CB 4.2Å; P330-C445 WeakPolarHBondContact CG-SG 2.9Å; I361-C445 WeakPolarHBondContact CG2-SG 3.47Å; C442-C445 PolarHBondContact O-N 3.39Å; C442-C445 VanDerWaalsContact O-N 3.14Å; C445-V447 HydrophobicContact CB-CB 4.3Å; C445-V447 HydrophobicContact CB-CG2 3.44Å; C445-V447 VanDerWaalsContact CB-CG2 3.44Å; C445-V447 PolarHBondContact O-N 3.45Å; C445-V447 WeakPolarHBondContact SG-CG2 3.39Å
446	R	30.2	Very low	29	Very low	186 Å²	186	87.9 Å²	87.9	70%	0.702	47%	0.471	S	S	*	.			trans	-71.4	62.6	157.3	-84.3	-170	155.1	99.9	-1.5	109.7
447	V	32.4	Very low	29.2	Very low	17 Å²	17	89.4 Å²	89.4	10%	0.103	47%	0.471	C	S	.	.			trans	-87.5	127.5	-177.3	171.2	0	0	0	0	109.3	A333 I361 V366 C445 F449	A333-V447 HydrophobicContact CB-CG1 4.13Å; I361-V447 HydrophobicContact CG2-CG2 4.4Å; V366-V447 HydrophobicContact CB-CG1 4.05Å; V366-V447 HydrophobicContact CG2-CG1 3.14Å; C445-V447 HydrophobicContact CB-CB 4.3Å; C445-V447 HydrophobicContact CB-CG2 3.44Å; C445-V447 VanDerWaalsContact CB-CG2 3.44Å; C445-V447 PolarHBondContact O-N 3.45Å; C445-V447 WeakPolarHBondContact SG-CG2 3.39Å; V447-F449 PolarHBondContact O-N 2.93Å
448	I	34.5	Very low	29.2	Very low	85 Å²	85	82.4 Å²	82.4	44%	0.436	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	112.8	176.2	-59.5	172.6	0	0	0	107.2	V366 V450	V366-I448 PolarHBondContact N-O 2.91Å; I448-V450 HydrophobicContact CG2-CG2 3.95Å; I448-V450 PolarHBondContact O-N 2.98Å
449	F	33.5	Very low	29.7	Very low	36 Å²	36	79.5 Å²	79.5	16%	0.158	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	115.9	169.4	-71.2	-90.9	0	0	0	109.7	F331 V366 V368 W424 F427 V447	F331-F449 HydrophobicContact CB-CE1 4.48Å; F331-F449 HydrophobicContact CD2-CE1 4.39Å; F331-F449 AromaticContact CD2-CZ 3.89Å; F331-F449 HydrophobicContact CD2-CZ 3.89Å; F331-F449 HydrophobicContact CE2-CZ 4.1Å; F331-F449 HydrophobicContact CG-CE1 4.27Å; F331-F449 HydrophobicContact CG-CZ 4.19Å; V366-F449 HydrophobicContact CB-CD1 4.12Å; V366-F449 HydrophobicContact CG1-CD1 3.8Å; V366-F449 HydrophobicContact CG1-CE1 4.06Å; V368-F449 HydrophobicContact CG2-CD1 4.17Å; W424-F449 HydrophobicContact CB-CD1 3.76Å; W424-F449 HydrophobicContact CB-CE1 4.14Å; W424-F449 HydrophobicContact CB-CG 4.48Å; W424-F449 AromaticContact CD1-CD1 3.85Å; W424-F449 AromaticContact CD1-CG 3.78Å; W424-F449 HydrophobicContact CG-CB 4.38Å; W424-F449 HydrophobicContact CG-CD1 4.17Å; F427-F449 HydrophobicContact CD1-CD2 4.31Å; F427-F449 HydrophobicContact CE1-CD2 4.34Å; V447-F449 PolarHBondContact O-N 2.93Å
450	V	29.6	Very low	29.9	Very low	16 Å²	16	77.3 Å²	77.3	10%	0.097	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	100.9	170.9	-178.8	0	0	0	0	107.5	V365 V366 V368 I448 L452 W474 Y476	V365-V450 HydrophobicContact CG1-CB 3.82Å; V365-V450 HydrophobicContact CG1-CG2 3.55Å; V366-V450 CarbonylContact O-C 3.57Å; V366-V450 PolarHBondContact O-N 3.24Å; V368-V450 PolarHBondContact N-O 3.43Å; I448-V450 HydrophobicContact CG2-CG2 3.95Å; I448-V450 PolarHBondContact O-N 2.98Å; V450-L452 PolarHBondContact O-N 3.13Å; V450-W474 HydrophobicContact CG1-CE3 4.24Å; V450-Y476 HydrophobicContact CG2-CD2 4.3Å
451	C	31.6	Very low	30.2	Very low	29 Å²	29	79.9 Å²	79.9	20%	0.196	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	116.6	162.9	-170.3	0	0	0	0	107.6	V368 W424 K453	V368-C451 HydrophobicContact CB-CB 4.24Å; V368-C451 HydrophobicContact CG2-CB 4.46Å; W424-C451 HydrophobicContact CD2-CB 3.89Å; W424-C451 HydrophobicContact CE3-CB 4.29Å; W424-C451 HydrophobicContact CH2-CB 3.54Å; W424-C451 WeakPolarHBondContact CH2-SG 3.44Å; W424-C451 HydrophobicContact CZ2-CB 3.07Å; W424-C451 WeakPolarHBondContact CZ2-SG 3.49Å; W424-C451 HydrophobicContact CZ3-CB 4.13Å; W424-C451 WeakPolarHBondContact CZ3-SG 3.26Å; C451-K453 VanDerWaalsContact C-N 3.31Å; C451-K453 PolarHBondContact O-N 2.97Å
452	L	28.1	Very low	30.6	Very low	84 Å²	84	84.8 Å²	84.8	44%	0.44	44%	0.438	S	S	.	.			trans	-55.9	110.5	150.4	-73.9	127.4	0	0	0	103.9	K367 V450 T454 W474	K367-L452 HydrophobicContact CG-CD1 4.28Å; V450-L452 PolarHBondContact O-N 3.13Å; L452-T454 PolarHBondContact O-N 3.39Å; L452-W474 HydrophobicContact CD1-CZ3 4.08Å
453	K	23.5	Very low	30.8	Very low	148 Å²	148	83.2 Å²	83.2	64%	0.643	43%	0.426	S	S	*	.			trans	-37.9	127.2	158.9	-96	-176.5	176.4	179.2	0	104.2	C451 V455	C451-K453 VanDerWaalsContact C-N 3.31Å; C451-K453 PolarHBondContact O-N 2.97Å; K453-V455 PolarHBondContact O-N 3.18Å
454	T	28.5	Very low	31.1	Very low	75 Å²	75	80.2 Å²	80.2	46%	0.46	42%	0.415	S	S	.	.			trans	-38.4	113.5	157.9	28.8	0	0	0	0	103.5	I370 L452 A456	I370-T454 HydrophobicContact CB-CG2 4.49Å; I370-T454 HydrophobicContact CD1-CG2 3.21Å; I370-T454 HydrophobicContact CG1-CG2 4.33Å; I370-T454 HydrophobicContact CG2-CG2 4.39Å; L452-T454 PolarHBondContact O-N 3.39Å; T454-A456 VanDerWaalsContact O-CA 3.23Å; T454-A456 WeakPolarHBondContact O-CA 3.42Å; T454-A456 WeakPolarHBondContact O-CB 3.45Å; T454-A456 PolarHBondContact O-N 3.1Å
455	V	30.8	Very low	31.7	Very low	58 Å²	58	80.7 Å²	80.7	35%	0.352	42%	0.418	S	S	.	.			trans	-40.2	92.9	143.3	174.5	0	0	0	0	103.1	K453 F457 G458 Y459	K453-V455 PolarHBondContact O-N 3.18Å; V455-F457 PolarHBondContact O-N 2.73Å; V455-G458 VanDerWaalsContact CG1-O 3.24Å; V455-G458 WeakPolarHBondContact CG1-O 3.37Å; V455-Y459 HydrophobicContact CG1-CD1 4.07Å; V455-Y459 HydrophobicContact CG1-CG 4.26Å
456	A	26.9	Very low	31.6	Very low	75 Å²	75	90 Å²	90	62%	0.62	45%	0.449	S	S	*	.			trans	-78.5	66.5	-153.1	0	0	0	0	0	107.3	T454 G458	T454-A456 VanDerWaalsContact O-CA 3.23Å; T454-A456 WeakPolarHBondContact O-CA 3.42Å; T454-A456 WeakPolarHBondContact O-CB 3.45Å; T454-A456 PolarHBondContact O-N 3.1Å; A456-G458 PolarHBondContact O-N 3.42Å
457	F	32.2	Very low	31.9	Very low	123 Å²	123	84.4 Å²	84.4	54%	0.539	43%	0.433	S	S	.	.	S	Bend	trans	44.4	10.3	-156.8	-73.3	-85.7	0	0	0	115.1	H308 Y309 V455	H308-F457 WeakPolarHBondContact O-CD1 3.45Å; H308-F457 VanDerWaalsContact O-CE1 3.25Å; H308-F457 WeakPolarHBondContact O-CE1 3.5Å; Y309-F457 AromaticContact CD1-CE1 3.57Å; Y309-F457 HydrophobicContact CD1-CE1 3.57Å; Y309-F457 AromaticContact CD1-CZ 4Å; Y309-F457 HydrophobicContact CD1-CZ 4Å; Y309-F457 AromaticContact CE1-CE1 3.49Å; Y309-F457 HydrophobicContact CE1-CE1 3.49Å; Y309-F457 VanDerWaalsContact CE1-CE1 3.49Å; Y309-F457 AromaticContact CE1-CZ 3.4Å; Y309-F457 HydrophobicContact CE1-CZ 3.4Å; Y309-F457 VanDerWaalsContact CE1-CZ 3.4Å; Y309-F457 HydrophobicContact CG-CE1 4.38Å; Y309-F457 AromaticContact CZ-CZ 3.94Å; V455-F457 PolarHBondContact O-N 2.73Å
458	G	27	Very low	31.6	Very low	41 Å²	41	86.6 Å²	86.6	42%	0.423	45%	0.447	S	S	.	.	S	Bend	trans	-117.8	94.5	175.4	0	0	0	0	0	106.2	V455 A456	V455-G458 VanDerWaalsContact CG1-O 3.24Å; V455-G458 WeakPolarHBondContact CG1-O 3.37Å; A456-G458 PolarHBondContact O-N 3.42Å
459	Y	34	Very low	31.5	Very low	32 Å²	32	93.3 Å²	93.3	13%	0.125	47%	0.467	C	S	.	.			trans	-37	142.5	172.7	-67.5	-82.3	0	0	0	111.9	P253 M280 T281 P310 M317 V455 R461	P253-Y459 HydrophobicContact CB-CD1 4.48Å; P253-Y459 HydrophobicContact CB-CE1 3.91Å; P253-Y459 HydrophobicContact CB-CE2 4.05Å; P253-Y459 HydrophobicContact CG-CD1 3.66Å; P253-Y459 HydrophobicContact CG-CD2 3.5Å; P253-Y459 VanDerWaalsContact CG-CD2 3.5Å; P253-Y459 HydrophobicContact CG-CE1 3.54Å; P253-Y459 HydrophobicContact CG-CE2 3.38Å; P253-Y459 HydrophobicContact CG-CG 3.63Å; M280-Y459 HydrophobicContact CB-CD2 3.99Å; M280-Y459 HydrophobicContact CB-CE2 3.72Å; M280-Y459 HydrophobicContact CG-CE2 3.87Å; T281-Y459 HydrophobicContact CG2-CD2 4.05Å; P310-Y459 VanDerWaalsContact CG-OH 3.22Å; P310-Y459 WeakPolarHBondContact CG-OH 3.45Å; M317-Y459 HydrophobicContact SD-CD1 4.13Å; M317-Y459 HydrophobicContact SD-CE1 4.5Å; V455-Y459 HydrophobicContact CG1-CD1 4.07Å; V455-Y459 HydrophobicContact CG1-CG 4.26Å; Y459-R461 PolarHBondContact O-N 3.32Å
460	P	27.6	Very low	31.4	Very low	64 Å²	64	97.6 Å²	97.6	42%	0.416	49%	0.492	S	S	.	.			trans	-47.8	120.4	176.1	20.3	-30.5	0	0	0	106.9	Q462	P460-Q462 CarbonylContact O-C 3.47Å; P460-Q462 PolarHBondContact O-N 3.49Å
461	R	32.8	Very low	31.4	Very low	197 Å²	197	100 Å²	100	74%	0.743	50%	0.504	S	S	*	.	S	Bend	trans	-57.9	-5.4	-169.1	-103.6	-178.1	173.4	-165.8	0.4	113.6	K283 Y459	K283-R461 HydrophobicContact CD-CB 4.43Å; K283-R461 HydrophobicContact CD-CG 4.25Å; K283-R461 WeakPolarHBondContact CD-O 3.37Å; Y459-R461 PolarHBondContact O-N 3.32Å
462	Q	32.9	Very low	31.4	Very low	157 Å²	157	104.4 Å²	104.4	73%	0.734	53%	0.525	S	S	*	.			trans	-142	108.9	173.8	-67.6	171.6	-7.7	0	0	107.3	P460 P464	P460-Q462 CarbonylContact O-C 3.47Å; P460-Q462 PolarHBondContact O-N 3.49Å; Q462-P464 WeakPolarHBondContact O-CD 3.46Å
463	V	37.4	Very low	31.4	Very low	29 Å²	29	106.5 Å²	106.5	18%	0.176	53%	0.534	C	S	.	.			trans	-92.8	108.4	158.8	-158.5	0	0	0	0	104.8
464	P	33.7	Very low	31.4	Very low	73 Å²	73	103.3 Å²	103.3	47%	0.474	52%	0.518	S	S	.	.			trans	-61.1	141.8	179.3	-19.8	31.4	0	0	0	110.4	Q462 R466	Q462-P464 WeakPolarHBondContact O-CD 3.46Å; P464-R466 CarbonylContact O-C 3.58Å; P464-R466 VanDerWaalsContact O-C 3.3Å; P464-R466 PolarHBondContact O-N 2.68Å
465	N	41.9	Very low	31.2	Very low	143 Å²	143	104.4 Å²	104.4	77%	0.765	52%	0.521	S	S	*	.	S	Bend	trans	-55.6	-12.2	-176.1	-77.7	-20.1	0	0	0	115.2
466	R	35.2	Very low	31	Very low	222 Å²	222	109.2 Å²	109.2	84%	0.838	53%	0.534	S	S	*	.	S	Bend	trans	-133.8	127.5	161.5	-70.5	-178.8	177.9	-164.7	-1.7	105.3	P464 P468	P464-R466 CarbonylContact O-C 3.58Å; P464-R466 VanDerWaalsContact O-C 3.3Å; P464-R466 PolarHBondContact O-N 2.68Å; R466-P468 WeakPolarHBondContact O-CD 3.21Å; R466-P468 VanDerWaalsContact O-N 3.13Å
467	I	35.1	Very low	31.1	Very low	68 Å²	68	113.9 Å²	113.9	35%	0.349	54%	0.536	S	S	.	.			trans	-71.4	100.4	165	-60.2	166.3	0	0	0	104.3	A316 R469 L471	A316-I467 HydrophobicContact CB-CD1 3.77Å; I467-R469 PolarHBondContact O-N 2.9Å; I467-L471 HydrophobicContact CB-CD1 4.48Å; I467-L471 HydrophobicContact CG2-CD1 3.66Å
468	P	27	Very low	31.1	Very low	63 Å²	63	110.6 Å²	110.6	41%	0.409	53%	0.528	S	S	.	.			trans	-58.2	135.6	174.7	25.3	-34.8	0	0	0	107.7	R466 N470 L471	R466-P468 WeakPolarHBondContact O-CD 3.21Å; R466-P468 VanDerWaalsContact O-N 3.13Å; P468-N470 PolarHBondContact O-N 3.39Å; P468-L471 HydrophobicContact CG-CD1 4.13Å; P468-L471 HydrophobicContact CG-CG 4.33Å; P468-L471 WeakPolarHBondContact O-CB 3.48Å; P468-L471 PolarHBondContact O-N 3.22Å
469	R	32.5	Very low	31.7	Very low	227 Å²	227	115.6 Å²	115.6	86%	0.857	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-52.6	-18.7	172.1	-68.9	-176.6	-145	-125.5	2	112.3	I467 L471 L472	I467-R469 PolarHBondContact O-N 2.9Å; R469-L471 VanDerWaalsContact C-N 3.28Å; R469-L471 PolarHBondContact O-N 2.9Å; R469-L472 PolarHBondContact O-N 2.76Å
470	N	31.4	Very low	32.3	Very low	125 Å²	125	115.5 Å²	115.5	67%	0.668	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-79.8	1.7	177.1	-58.6	-10.2	0	0	0	114.2	P468 L472 M473	P468-N470 PolarHBondContact O-N 3.39Å; N470-L472 PolarHBondContact O-N 3.11Å; N470-M473 VanDerWaalsContact O-CB 3.23Å; N470-M473 WeakPolarHBondContact O-CB 3.33Å; N470-M473 PolarHBondContact O-N 3.27Å
471	L	30.3	Very low	33.5	Very low	68 Å²	68	118.8 Å²	118.8	36%	0.356	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-64	-10.6	163.8	-99.2	152.8	0	0	0	112.7	I467 P468 R469 M473	I467-L471 HydrophobicContact CB-CD1 4.48Å; I467-L471 HydrophobicContact CG2-CD1 3.66Å; P468-L471 HydrophobicContact CG-CD1 4.13Å; P468-L471 HydrophobicContact CG-CG 4.33Å; P468-L471 WeakPolarHBondContact O-CB 3.48Å; P468-L471 PolarHBondContact O-N 3.22Å; R469-L471 VanDerWaalsContact C-N 3.28Å; R469-L471 PolarHBondContact O-N 2.9Å; L471-M473 PolarHBondContact O-N 3.25Å
472	L	31.6	Very low	34.7	Very low	121 Å²	121	110 Å²	110	63%	0.634	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-73.3	-6.4	166.1	-65.3	173.9	0	0	0	113.4	R469 N470 W474	R469-L472 PolarHBondContact O-N 2.76Å; N470-L472 PolarHBondContact O-N 3.11Å; L472-W474 PolarHBondContact O-N 2.9Å
473	M	26.9	Very low	36.7	Very low	128 Å²	128	104.7 Å²	104.7	63%	0.631	51%	0.508	S	S	*	.	S	Bend	trans	-79.6	96.9	165.9	-167.1	164.8	64.4	0	0	107	N470 L471 N475	N470-M473 VanDerWaalsContact O-CB 3.23Å; N470-M473 WeakPolarHBondContact O-CB 3.33Å; N470-M473 PolarHBondContact O-N 3.27Å; L471-M473 PolarHBondContact O-N 3.25Å; M473-N475 PolarHBondContact O-N 3.33Å
474	W	22.8	Very low	38.4	Very low	80 Å²	80	107.7 Å²	107.7	30%	0.303	53%	0.53	S	S	.	.			trans	-61.5	65.9	-175.1	-67.5	92.5	0	0	0	112.9	V365 K367 V450 L452 L472 Y476	V365-W474 HydrophobicContact CG1-CB 4.41Å; V365-W474 HydrophobicContact CG1-CD2 3.97Å; V365-W474 HydrophobicContact CG1-CE3 4.13Å; V365-W474 HydrophobicContact CG1-CG 4.1Å; V365-W474 HydrophobicContact CG2-CB 4.47Å; K367-W474 HydrophobicContact CB-CH2 3.67Å; K367-W474 HydrophobicContact CB-CZ2 4.25Å; K367-W474 HydrophobicContact CB-CZ3 4.31Å; K367-W474 HydrophobicContact CD-CH2 3.64Å; K367-W474 HydrophobicContact CD-CZ2 4.32Å; K367-W474 HydrophobicContact CG-CH2 3.54Å; K367-W474 HydrophobicContact CG-CZ2 4.46Å; K367-W474 HydrophobicContact CG-CZ3 4.16Å; V450-W474 HydrophobicContact CG1-CE3 4.24Å; L452-W474 HydrophobicContact CD1-CZ3 4.08Å; L472-W474 PolarHBondContact O-N 2.9Å; W474-Y476 PolarHBondContact O-N 2.81Å
475	N	26.2	Very low	40.8	Very low	98 Å²	98	107.4 Å²	107.4	52%	0.524	53%	0.53	S	S	.	.			trans	-76.7	98.3	171.7	-72.9	-14.7	0	0	0	106.9	M473 Y477	M473-N475 PolarHBondContact O-N 3.33Å; N475-Y477 VanDerWaalsContact O-CD2 3.26Å; N475-Y477 WeakPolarHBondContact O-CD2 3.46Å; N475-Y477 WeakPolarHBondContact O-CE2 3.49Å; N475-Y477 PolarHBondContact O-N 3.34Å; N475-Y477 VanDerWaalsContact O-N 3.12Å
476	Y	26.7	Very low	42.9	Very low	160 Å²	160	102.7 Å²	102.7	63%	0.627	50%	0.503	S	S	*	.			trans	-29	116.6	151.3	-152.8	-103.4	0	0	0	107.6	V450 W474 P478	V450-Y476 HydrophobicContact CG2-CD2 4.3Å; W474-Y476 PolarHBondContact O-N 2.81Å; Y476-P478 HydrophobicContact CD1-CB 4.48Å; Y476-P478 WeakPolarHBondContact O-CD 3.12Å
477	Y	28.3	Very low	45.3	Very low	172 Å²	172	97.8 Å²	97.8	68%	0.675	49%	0.485	S	S	*	.			trans	-92.9	85.7	169.9	-66.7	-87.5	0	0	0	106.4	N475	N475-Y477 VanDerWaalsContact O-CD2 3.26Å; N475-Y477 WeakPolarHBondContact O-CD2 3.46Å; N475-Y477 WeakPolarHBondContact O-CE2 3.49Å; N475-Y477 PolarHBondContact O-N 3.34Å; N475-Y477 VanDerWaalsContact O-N 3.12Å
478	P	31.4	Very low	47.8	Very low	55 Å²	55	102.3 Å²	102.3	36%	0.357	50%	0.497	S	S	.	.			trans	-58	146.7	158.6	28.1	-29.3	0	0	0	107.2	Y476 S480	Y476-P478 HydrophobicContact CD1-CB 4.48Å; Y476-P478 WeakPolarHBondContact O-CD 3.12Å; P478-S480 PolarHBondContact O-N 3.04Å
479	L	40.6	Very low	50.9	Low	146 Å²	146	103.9 Å²	103.9	76%	0.764	50%	0.499	S	S	*	.	S	Bend	trans	-61.8	2.4	-157.8	-95.3	130.9	0	0	0	117.2
480	S	45.6	Very low	53.8	Low	30 Å²	30	93.2 Å²	93.2	21%	0.21	46%	0.459	C	S	.	.			trans	-164.7	123.5	164.7	57.6	0	0	0	0	109.7	P478 F482 E516 A517	P478-S480 PolarHBondContact O-N 3.04Å; S480-F482 PolarHBondContact O-N 2.61Å; S480-F482 VanDerWaalsContact O-N 3.1Å; S480-E516 PolarHBondContact OG-O 2.77Å; S480-E516 VanDerWaalsContact OG-O 3.13Å; S480-A517 WeakPolarHBondContact OG-CA 3.02Å
481	I	53	Low	56.7	Low	133 Å²	133	90.5 Å²	90.5	68%	0.682	44%	0.443	S	S	*	.			trans	-69.1	106.8	167.4	-74.1	165	0	0	0	106.8	S483	I481-S483 PolarHBondContact O-N 3.11Å; I481-S483 VanDerWaalsContact O-N 3.16Å
482	F	59.4	Low	59.6	Low	13 Å²	13	90.7 Å²	90.7	6%	0.057	45%	0.449	C	S	.	.			trans	-56.2	118	162.5	-166.9	-132.3	0	0	0	107.9	S480 Q486 R487 L490 W510 A517 E520 I521 I524	S480-F482 PolarHBondContact O-N 2.61Å; S480-F482 VanDerWaalsContact O-N 3.1Å; F482-Q486 HydrophobicContact CD2-CB 3.74Å; F482-Q486 HydrophobicContact CE2-CB 3.51Å; F482-Q486 HydrophobicContact CG-CB 4.35Å; F482-Q486 VanDerWaalsContact CZ-C 3.47Å; F482-Q486 HydrophobicContact CZ-CB 3.96Å; F482-Q486 WeakPolarHBondContact CZ-O 3.44Å; F482-R487 HydrophobicContact CD1-CB 3.54Å; F482-R487 HydrophobicContact CD1-CG 4.16Å; F482-R487 HydrophobicContact CE1-CB 3.39Å; F482-R487 HydrophobicContact CE1-CG 3.87Å; F482-R487 VanDerWaalsContact CE1-N 3.34Å; F482-R487 HydrophobicContact CZ-CB 4.39Å; F482-L490 HydrophobicContact CE1-CD2 4.45Å; F482-L490 HydrophobicContact CZ-CB 4.05Å; F482-L490 HydrophobicContact CZ-CD2 3.95Å; F482-W510 AromaticContact CE2-CH2 3.56Å; F482-W510 HydrophobicContact CE2-CH2 3.56Å; F482-W510 HydrophobicContact CE2-CZ3 4.1Å; F482-W510 AromaticContact CZ-CH2 3.62Å; F482-W510 HydrophobicContact CZ-CH2 3.62Å; F482-W510 HydrophobicContact CZ-CZ3 4.14Å; F482-A517 HydrophobicContact CB-CB 4.44Å; F482-A517 HydrophobicContact CD2-CB 3.96Å; F482-E520 WeakPolarHBondContact CB-OE2 3.39Å; F482-I521 HydrophobicContact CE2-CG1 4.15Å; F482-I521 HydrophobicContact CZ-CG1 4.39Å; F482-I524 HydrophobicContact CD1-CD1 4.02Å; F482-I524 HydrophobicContact CE1-CD1 3.41Å; F482-I524 VanDerWaalsContact CE1-CD1 3.41Å; F482-I524 HydrophobicContact CZ-CD1 4.27Å
483	S	73.5	Confident	62.5	Low	45 Å²	45	86.8 Å²	86.8	32%	0.315	44%	0.435	S	S	.	.			trans	-62.4	148.1	-178.8	69.5	0	0	0	0	109.7	I481 S485 Q486 R487	I481-S483 PolarHBondContact O-N 3.11Å; I481-S483 VanDerWaalsContact O-N 3.16Å; S483-S485 PolarHBondContact O-N 3.22Å; S483-Q486 PolarHBondContact O-N 3.38Å; S483-Q486 WeakPolarHBondContact OG-CB 3.47Å; S483-Q486 VanDerWaalsContact OG-CD 3.3Å; S483-Q486 VanDerWaalsContact OG-CG 3.22Å; S483-Q486 WeakPolarHBondContact OG-CG 3.34Å; S483-Q486 PolarHBondContact OG-N 3.42Å; S483-Q486 VanDerWaalsContact OG-N 3.07Å; S483-Q486 PolarHBondContact OG-OE1 3.21Å; S483-R487 PolarHBondContact O-N 2.93Å
484	S	74.4	Confident	65.7	Low	91 Å²	91	81 Å²	81	64%	0.636	41%	0.407	S	S	*	.	H	α-helix	trans	-59	-18.7	174.2	62.2	0	0	0	0	112.8	R488	S484-R488 WeakPolarHBondContact O-CG 3.33Å; S484-R488 PolarHBondContact O-N 2.95Å; S484-R488 PolarHBondContact O-NE 3.35Å
485	S	83.2	Confident	68.9	Low	67 Å²	67	84.1 Å²	84.1	47%	0.469	42%	0.422	S	S	.	.	H	α-helix	trans	-73.9	-53.8	171.2	-163.6	0	0	0	0	111.8	S483 R487 R488 E489	S483-S485 PolarHBondContact O-N 3.22Å; S485-R487 PolarHBondContact O-N 3.23Å; S485-R488 PolarHBondContact O-N 2.92Å; S485-R488 VanDerWaalsContact O-N 3.09Å; S485-E489 PolarHBondContact O-N 2.97Å
486	Q	85.8	Confident	72	Confident	44 Å²	44	83.9 Å²	83.9	21%	0.206	42%	0.424	C	S	.	.	H	α-helix	trans	-58.3	-36.7	178.1	-73.3	162.2	-41.5	0	0	111.5	F482 S483 E489 L490 W510 H514	F482-Q486 HydrophobicContact CD2-CB 3.74Å; F482-Q486 HydrophobicContact CE2-CB 3.51Å; F482-Q486 HydrophobicContact CG-CB 4.35Å; F482-Q486 VanDerWaalsContact CZ-C 3.47Å; F482-Q486 HydrophobicContact CZ-CB 3.96Å; F482-Q486 WeakPolarHBondContact CZ-O 3.44Å; S483-Q486 PolarHBondContact O-N 3.38Å; S483-Q486 WeakPolarHBondContact OG-CB 3.47Å; S483-Q486 VanDerWaalsContact OG-CD 3.3Å; S483-Q486 VanDerWaalsContact OG-CG 3.22Å; S483-Q486 WeakPolarHBondContact OG-CG 3.34Å; S483-Q486 PolarHBondContact OG-N 3.42Å; S483-Q486 VanDerWaalsContact OG-N 3.07Å; S483-Q486 PolarHBondContact OG-OE1 3.21Å; Q486-E489 WeakPolarHBondContact O-CB 3.37Å; Q486-E489 PolarHBondContact O-N 2.89Å; Q486-L490 PolarHBondContact O-N 3.41Å; Q486-W510 HydrophobicContact CB-CH2 4.18Å; Q486-W510 HydrophobicContact CB-CZ2 4.2Å; Q486-W510 WeakPolarHBondContact O-CH2 3.38Å; Q486-H514 PolarHBondContact NE2-CD2 3.4Å; Q486-H514 PolarHBondContact NE2-NE2 2.81Å
487	R	85.7	Confident	75.2	Confident	120 Å²	120	76.5 Å²	76.5	45%	0.453	40%	0.395	S	S	.	.	H	α-helix	trans	-59.7	-48.7	173.4	-173.5	168.6	-180	145.4	0.3	114	F482 S483 S485 E489 L490 E491 I524	F482-R487 HydrophobicContact CD1-CB 3.54Å; F482-R487 HydrophobicContact CD1-CG 4.16Å; F482-R487 HydrophobicContact CE1-CB 3.39Å; F482-R487 HydrophobicContact CE1-CG 3.87Å; F482-R487 VanDerWaalsContact CE1-N 3.34Å; F482-R487 HydrophobicContact CZ-CB 4.39Å; S483-R487 PolarHBondContact O-N 2.93Å; S485-R487 PolarHBondContact O-N 3.23Å; R487-E489 VanDerWaalsContact C-N 3.26Å; R487-E489 PolarHBondContact O-N 3.29Å; R487-L490 PolarHBondContact O-N 3.34Å; R487-E491 HydrophobicContact CG-CG 4.45Å; R487-E491 WeakPolarHBondContact CG-OE1 3.45Å; R487-E491 IonicContact CZ-OE1 2.79Å; R487-E491 IonicContact NE-OE1 3.82Å; R487-E491 PolarHBondContact NE-OE1 3.48Å; R487-E491 IonicContact NH2-OE1 3.86Å; R487-E491 WeakPolarHBondContact O-CB 3.19Å; R487-E491 WeakPolarHBondContact O-CG 3.32Å; R487-E491 PolarHBondContact O-N 3.31Å; R487-I524 HydrophobicContact CG-CD1 4.05Å
488	R	88.5	Confident	78.3	Confident	162 Å²	162	70.8 Å²	70.8	61%	0.611	38%	0.377	S	S	*	.	H	α-helix	trans	-64.5	-35.4	177.4	-75	-178.2	-70.8	161.7	-1	111.5	S484 S485 S492	S484-R488 WeakPolarHBondContact O-CG 3.33Å; S484-R488 PolarHBondContact O-N 2.95Å; S484-R488 PolarHBondContact O-NE 3.35Å; S485-R488 PolarHBondContact O-N 2.92Å; S485-R488 VanDerWaalsContact O-N 3.09Å; R488-S492 WeakPolarHBondContact O-CB 3.47Å; R488-S492 PolarHBondContact O-N 2.95Å
489	E	91.3	Very high	81.3	Confident	96 Å²	96	71 Å²	71	45%	0.449	38%	0.375	S	S	.	.	H	α-helix	trans	-64.4	-48.5	176.8	-166.5	178.8	167.6	0	0	111.9	S485 Q486 R487 S492 A493 W510	S485-E489 PolarHBondContact O-N 2.97Å; Q486-E489 WeakPolarHBondContact O-CB 3.37Å; Q486-E489 PolarHBondContact O-N 2.89Å; R487-E489 VanDerWaalsContact C-N 3.26Å; R487-E489 PolarHBondContact O-N 3.29Å; E489-S492 WeakPolarHBondContact O-CB 3.39Å; E489-S492 PolarHBondContact O-N 3.31Å; E489-A493 WeakPolarHBondContact O-CB 3.45Å; E489-A493 PolarHBondContact O-N 3.37Å; E489-W510 HydrophobicContact CB-CZ2 4.11Å; E489-W510 HydrophobicContact CG-CZ2 4.25Å; E489-W510 PolarHBondContact OE1-NE1 3.42Å
490	L	93.4	Very high	83.8	Confident	4 Å²	4	69.5 Å²	69.5	2%	0.021	36%	0.363	C	S	.	.	H	α-helix	trans	-62	-47.8	175.2	-179.4	60.3	0	0	0	112	F482 Q486 R487 S492 A493 L494 W510 I521 I524	F482-L490 HydrophobicContact CE1-CD2 4.45Å; F482-L490 HydrophobicContact CZ-CB 4.05Å; F482-L490 HydrophobicContact CZ-CD2 3.95Å; Q486-L490 PolarHBondContact O-N 3.41Å; R487-L490 PolarHBondContact O-N 3.34Å; L490-S492 VanDerWaalsContact C-N 3.28Å; L490-S492 PolarHBondContact O-N 3.32Å; L490-A493 PolarHBondContact O-N 3.14Å; L490-L494 HydrophobicContact CD1-CD1 4.4Å; L490-L494 HydrophobicContact CD1-CG 4.29Å; L490-L494 HydrophobicContact CG-CD1 4.23Å; L490-L494 VanDerWaalsContact O-CG 3.32Å; L490-L494 WeakPolarHBondContact O-CG 3.5Å; L490-L494 PolarHBondContact O-N 2.93Å; L490-W510 HydrophobicContact CB-CE3 4.49Å; L490-W510 HydrophobicContact CB-CH2 3.72Å; L490-W510 HydrophobicContact CB-CZ2 4.44Å; L490-W510 HydrophobicContact CB-CZ3 3.76Å; L490-W510 HydrophobicContact CD1-CE3 3.98Å; L490-W510 HydrophobicContact CD1-CZ3 3.85Å; L490-W510 HydrophobicContact CD2-CZ3 4.11Å; L490-W510 HydrophobicContact CG-CZ3 4.11Å; L490-I521 HydrophobicContact CD2-CB 4.32Å; L490-I521 HydrophobicContact CD2-CG1 4.17Å; L490-I521 HydrophobicContact CD2-CG2 4.09Å; L490-I524 HydrophobicContact CD2-CB 4.07Å; L490-I524 HydrophobicContact CD2-CD1 4.06Å; L490-I524 HydrophobicContact CD2-CG2 3.88Å; L490-I524 HydrophobicContact CG-CG2 4.25Å
491	E	92	Very high	86	Confident	68 Å²	68	79.1 Å²	79.1	32%	0.318	40%	0.395	S	S	.	.	H	α-helix	trans	-61	-38.2	178.1	-73.5	174.9	-173.6	0	0	111.5	R487 K495 I524	R487-E491 HydrophobicContact CG-CG 4.45Å; R487-E491 WeakPolarHBondContact CG-OE1 3.45Å; R487-E491 IonicContact CZ-OE1 2.79Å; R487-E491 IonicContact NE-OE1 3.82Å; R487-E491 PolarHBondContact NE-OE1 3.48Å; R487-E491 IonicContact NH2-OE1 3.86Å; R487-E491 WeakPolarHBondContact O-CB 3.19Å; R487-E491 WeakPolarHBondContact O-CG 3.32Å; R487-E491 PolarHBondContact O-N 3.31Å; E491-K495 WeakPolarHBondContact O-CG 3.43Å; E491-K495 PolarHBondContact O-N 2.8Å; E491-I524 HydrophobicContact CG-CG2 4.1Å
492	S	91.8	Very high	87.8	Confident	71 Å²	71	80.4 Å²	80.4	50%	0.497	40%	0.396	S	S	.	.	H	α-helix	trans	-65.1	-45.7	173.9	-172.7	0	0	0	0	111.7	R488 E489 L490 L494 K495 V496	R488-S492 WeakPolarHBondContact O-CB 3.47Å; R488-S492 PolarHBondContact O-N 2.95Å; E489-S492 WeakPolarHBondContact O-CB 3.39Å; E489-S492 PolarHBondContact O-N 3.31Å; L490-S492 VanDerWaalsContact C-N 3.28Å; L490-S492 PolarHBondContact O-N 3.32Å; S492-L494 VanDerWaalsContact C-N 3.32Å; S492-L494 PolarHBondContact O-N 3.09Å; S492-K495 WeakPolarHBondContact O-CB 3.27Å; S492-K495 PolarHBondContact O-N 3.44Å; S492-K495 VanDerWaalsContact O-N 3.14Å; S492-V496 PolarHBondContact O-N 3.41Å
493	A	91.8	Very high	89.4	Confident	40 Å²	40	82.7 Å²	82.7	33%	0.331	41%	0.406	S	S	.	.	H	α-helix	trans	-60.2	-41.3	177.2	0	0	0	0	0	111.7	E489 L490 K495 V496 L497	E489-A493 WeakPolarHBondContact O-CB 3.45Å; E489-A493 PolarHBondContact O-N 3.37Å; L490-A493 PolarHBondContact O-N 3.14Å; A493-K495 VanDerWaalsContact C-N 3.32Å; A493-K495 PolarHBondContact O-N 3.39Å; A493-V496 WeakPolarHBondContact O-CG2 3.42Å; A493-V496 PolarHBondContact O-N 3.29Å; A493-L497 PolarHBondContact O-N 2.93Å; A493-L497 VanDerWaalsContact O-N 3.09Å
494	L	94	Very high	90.4	Very high	7 Å²	7	80.7 Å²	80.7	4%	0.037	39%	0.393	C	S	.	.	H	α-helix	trans	-67.2	-28.5	177.2	-68.2	176.4	0	0	0	113.3	L490 S492 L497 I524 I525 R542 L545	L490-L494 HydrophobicContact CD1-CD1 4.4Å; L490-L494 HydrophobicContact CD1-CG 4.29Å; L490-L494 HydrophobicContact CG-CD1 4.23Å; L490-L494 VanDerWaalsContact O-CG 3.32Å; L490-L494 WeakPolarHBondContact O-CG 3.5Å; L490-L494 PolarHBondContact O-N 2.93Å; S492-L494 VanDerWaalsContact C-N 3.32Å; S492-L494 PolarHBondContact O-N 3.09Å; L494-L497 HydrophobicContact CD2-CD2 4.19Å; L494-I524 HydrophobicContact CD1-CG2 4.02Å; L494-I525 HydrophobicContact CD1-CG1 4.07Å; L494-I525 HydrophobicContact CD2-CG1 4.26Å; L494-R542 HydrophobicContact CD2-CG 4.35Å; L494-R542 PolarHBondContact O-NH1 3.4Å; L494-R542 PolarHBondContact O-NH2 3.2Å; L494-L545 HydrophobicContact CD2-CD2 3.78Å
495	K	90.7	Very high	91.3	Very high	145 Å²	145	77.4 Å²	77.4	63%	0.63	37%	0.373	S	S	*	.	H	α-helix	trans	-67.4	-37.9	176.5	-76.7	173	-177.6	179.2	0	112.4	E491 S492 A493	E491-K495 WeakPolarHBondContact O-CG 3.43Å; E491-K495 PolarHBondContact O-N 2.8Å; S492-K495 WeakPolarHBondContact O-CB 3.27Å; S492-K495 PolarHBondContact O-N 3.44Å; S492-K495 VanDerWaalsContact O-N 3.14Å; A493-K495 VanDerWaalsContact C-N 3.32Å; A493-K495 PolarHBondContact O-N 3.39Å
496	V	90.9	Very high	91.7	Very high	92 Å²	92	78.7 Å²	78.7	56%	0.558	38%	0.375	S	S	*	.	H	α-helix	trans	-90.7	-11.5	-179.3	-62.9	0	0	0	0	113.8	S492 A493 N498	S492-V496 PolarHBondContact O-N 3.41Å; A493-V496 WeakPolarHBondContact O-CG2 3.42Å; A493-V496 PolarHBondContact O-N 3.29Å; V496-N498 PolarHBondContact O-N 3.13Å
497	L	94.5	Very high	92	Very high	5 Å²	5	77.2 Å²	77.2	3%	0.026	37%	0.371	C	S	.	.			trans	-57.5	124.7	-176.9	-168.6	71.3	0	0	0	112.8	A493 L494 Q503 V504 A541 R542 L545	A493-L497 PolarHBondContact O-N 2.93Å; A493-L497 VanDerWaalsContact O-N 3.09Å; L494-L497 HydrophobicContact CD2-CD2 4.19Å; L497-Q503 HydrophobicContact CD1-CB 4.37Å; L497-V504 HydrophobicContact CD1-CG2 4.42Å; L497-A541 HydrophobicContact CD2-CB 4.34Å; L497-A541 HydrophobicContact CG-CB 4.15Å; L497-R542 HydrophobicContact CD2-CB 4.5Å; L497-R542 HydrophobicContact CD2-CG 3.93Å; L497-L545 HydrophobicContact CD2-CB 4.13Å; L497-L545 HydrophobicContact CD2-CD2 3.98Å
498	N	93.6	Very high	92.3	Very high	53 Å²	53	72.3 Å²	72.3	28%	0.283	35%	0.354	S	S	.	.			trans	-128.8	-174.7	178.3	69.7	22.1	0	0	0	110.7	V496 E500 Q503 A541	V496-N498 PolarHBondContact O-N 3.13Å; N498-E500 PolarHBondContact O-N 3.02Å; N498-E500 WeakPolarHBondContact OD1-CB 3.3Å; N498-E500 WeakPolarHBondContact OD1-CG 3.45Å; N498-E500 PolarHBondContact OD1-N 2.98Å; N498-Q503 WeakPolarHBondContact OD1-CG 3.22Å; N498-A541 WeakPolarHBondContact O-CB 3.5Å
499	L	93.3	Very high	92.3	Very high	60 Å²	60	69 Å²	69	31%	0.314	35%	0.346	S	S	.	.	S	Bend	trans	-79.9	3.3	-176.8	-68.1	167.7	0	0	0	114.3	R501 L537 I540 A541 Y544	L499-R501 PolarHBondContact O-N 3.27Å; L499-L537 HydrophobicContact CD1-CB 4.46Å; L499-L537 HydrophobicContact CD1-CD2 3.71Å; L499-I540 HydrophobicContact CD2-CB 4.3Å; L499-I540 HydrophobicContact CD2-CG2 3.9Å; L499-A541 HydrophobicContact CD2-CB 4.16Å; L499-A541 HydrophobicContact CG-CB 4.45Å; L499-Y544 HydrophobicContact CD2-CD2 3.7Å; L499-Y544 HydrophobicContact CD2-CE2 3.61Å
500	E	93.8	Very high	92.3	Very high	113 Å²	113	65.8 Å²	65.8	53%	0.528	33%	0.33	S	S	.	.			trans	-70.8	130.3	177.7	-64.7	175.9	178.1	0	0	110.4	N498 K502 Q503 V504	N498-E500 PolarHBondContact O-N 3.02Å; N498-E500 WeakPolarHBondContact OD1-CB 3.3Å; N498-E500 WeakPolarHBondContact OD1-CG 3.45Å; N498-E500 PolarHBondContact OD1-N 2.98Å; E500-K502 PolarHBondContact O-N 3.13Å; E500-K502 VanDerWaalsContact O-N 3.13Å; E500-Q503 HydrophobicContact CB-CB 4.38Å; E500-Q503 HydrophobicContact CB-CG 4.19Å; E500-Q503 PolarHBondContact O-N 2.91Å; E500-V504 PolarHBondContact O-N 3.41Å; E500-V504 VanDerWaalsContact O-N 3.09Å
501	R	91.5	Very high	92.3	Very high	233 Å²	233	65.6 Å²	65.6	88%	0.879	33%	0.329	S	S	*	.	H	α-helix	trans	-54	-36.3	179.8	-68.7	-175.6	179.7	135.9	-1.5	113	L499 G505	L499-R501 PolarHBondContact O-N 3.27Å; R501-G505 PolarHBondContact O-N 3.44Å
502	K	91.8	Very high	92	Very high	159 Å²	159	63.7 Å²	63.7	69%	0.691	32%	0.322	S	S	*	.	H	α-helix	trans	-64.4	-41	177.8	-172.8	178	178.5	-178.5	0	111.9	E500 N506	E500-K502 PolarHBondContact O-N 3.13Å; E500-K502 VanDerWaalsContact O-N 3.13Å; K502-N506 WeakPolarHBondContact O-CB 3.21Å; K502-N506 PolarHBondContact O-N 2.63Å; K502-N506 PolarHBondContact O-OD1 2.85Å
503	Q	92.5	Very high	91.7	Very high	61 Å²	61	66.2 Å²	66.2	29%	0.285	33%	0.326	S	S	.	.	H	α-helix	trans	-69.9	-46.3	179.7	-70.3	-69.2	-32.6	0	0	111.4	L497 N498 E500 N506 G507	L497-Q503 HydrophobicContact CD1-CB 4.37Å; N498-Q503 WeakPolarHBondContact OD1-CG 3.22Å; E500-Q503 HydrophobicContact CB-CB 4.38Å; E500-Q503 HydrophobicContact CB-CG 4.19Å; E500-Q503 PolarHBondContact O-N 2.91Å; Q503-N506 PolarHBondContact O-N 3.08Å; Q503-G507 PolarHBondContact O-N 3.5Å
504	V	94.5	Very high	91.5	Very high	4 Å²	4	65.7 Å²	65.7	2%	0.024	32%	0.317	C	S	.	.	H	α-helix	trans	-61.9	-45.2	176.3	-178.1	0	0	0	0	110.9	L497 E500 N506 G507 M508 L545 D548	L497-V504 HydrophobicContact CD1-CG2 4.42Å; E500-V504 PolarHBondContact O-N 3.41Å; E500-V504 VanDerWaalsContact O-N 3.09Å; V504-N506 PolarHBondContact O-N 3.49Å; V504-G507 PolarHBondContact O-N 2.78Å; V504-M508 WeakPolarHBondContact O-CB 3.2Å; V504-M508 PolarHBondContact O-N 3.21Å; V504-L545 HydrophobicContact CG1-CB 4.33Å; V504-D548 HydrophobicContact CG1-CB 4.46Å; V504-D548 WeakPolarHBondContact CG1-OD2 3.37Å
505	G	92.1	Very high	91.2	Very high	22 Å²	22	65.9 Å²	65.9	23%	0.227	32%	0.318	C	S	.	.	H	α-helix	trans	-61.8	-42.3	177.5	0	0	0	0	0	113.3	R501 M508 M509	R501-G505 PolarHBondContact O-N 3.44Å; G505-M508 PolarHBondContact O-N 3.46Å; G505-M509 WeakPolarHBondContact O-CG 3.45Å; G505-M509 PolarHBondContact O-N 3.1Å
506	N	92	Very high	90.7	Very high	93 Å²	93	63.1 Å²	63.1	50%	0.497	31%	0.308	S	S	.	.	H	α-helix	trans	-62.5	-43.6	175	-73.4	-2.4	0	0	0	111.8	K502 Q503 V504 M508 M509 W510	K502-N506 WeakPolarHBondContact O-CB 3.21Å; K502-N506 PolarHBondContact O-N 2.63Å; K502-N506 PolarHBondContact O-OD1 2.85Å; Q503-N506 PolarHBondContact O-N 3.08Å; V504-N506 PolarHBondContact O-N 3.49Å; N506-M508 VanDerWaalsContact C-N 3.34Å; N506-M509 PolarHBondContact O-N 3.3Å; N506-W510 PolarHBondContact O-N 3.46Å
507	G	92.4	Very high	90.4	Very high	13 Å²	13	59 Å²	59	13%	0.134	28%	0.283	C	S	.	.	H	α-helix	trans	-62.6	-41.4	175.7	0	0	0	0	0	112.2	Q503 V504 W510 C511	Q503-G507 PolarHBondContact O-N 3.5Å; V504-G507 PolarHBondContact O-N 2.78Å; G507-W510 PolarHBondContact O-N 2.91Å; G507-C511 PolarHBondContact O-N 3.34Å; G507-C511 VanDerWaalsContact O-N 3.07Å; G507-C511 PolarHBondContact O-SG 3.26Å
508	M	92.9	Very high	90	Very high	17 Å²	17	58.8 Å²	58.8	8%	0.084	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-46.4	177.2	164.4	-94	125.5	0	0	111.3	V504 G505 N506 W510 C511 V512 L545 D548 I549 N552	V504-M508 WeakPolarHBondContact O-CB 3.2Å; V504-M508 PolarHBondContact O-N 3.21Å; G505-M508 PolarHBondContact O-N 3.46Å; N506-M508 VanDerWaalsContact C-N 3.34Å; M508-W510 VanDerWaalsContact C-N 3.31Å; M508-W510 PolarHBondContact O-N 3.45Å; M508-C511 PolarHBondContact O-N 2.97Å; M508-C511 VanDerWaalsContact O-N 3.15Å; M508-V512 HydrophobicContact CE-CB 3.77Å; M508-V512 HydrophobicContact CE-CG1 4.45Å; M508-V512 HydrophobicContact CE-CG2 3.3Å; M508-V512 PolarHBondContact O-N 3.33Å; M508-L545 HydrophobicContact CB-CD1 3.96Å; M508-D548 HydrophobicContact CB-CB 4.1Å; M508-D548 HydrophobicContact CG-CB 4.03Å; M508-I549 HydrophobicContact CB-CG1 4.46Å; M508-I549 HydrophobicContact CG-CG1 4.36Å; M508-N552 HydrophobicContact CE-CB 4.36Å
509	M	88.3	Confident	89.7	Confident	93 Å²	93	60.6 Å²	60.6	46%	0.458	29%	0.289	S	S	.	.	H	α-helix	trans	-56.4	-46.9	176.8	-78.1	-63.7	-57.9	0	0	111.1	G505 N506 C511 V512 E513	G505-M509 WeakPolarHBondContact O-CG 3.45Å; G505-M509 PolarHBondContact O-N 3.1Å; N506-M509 PolarHBondContact O-N 3.3Å; M509-C511 VanDerWaalsContact C-N 3.32Å; M509-C511 PolarHBondContact O-N 2.99Å; M509-V512 PolarHBondContact O-N 2.96Å; M509-V512 VanDerWaalsContact O-N 3.1Å; M509-E513 WeakPolarHBondContact O-CG 3.3Å; M509-E513 PolarHBondContact O-N 3.02Å
510	W	91.7	Very high	89.4	Confident	28 Å²	28	60.4 Å²	60.4	11%	0.106	29%	0.287	C	S	.	.	H	α-helix	trans	-58.8	-42.9	177.2	-167.3	95.8	0	0	0	112.3	F482 Q486 E489 L490 N506 G507 M508 V512 E513 H514 I521	F482-W510 AromaticContact CE2-CH2 3.56Å; F482-W510 HydrophobicContact CE2-CH2 3.56Å; F482-W510 HydrophobicContact CE2-CZ3 4.1Å; F482-W510 AromaticContact CZ-CH2 3.62Å; F482-W510 HydrophobicContact CZ-CH2 3.62Å; F482-W510 HydrophobicContact CZ-CZ3 4.14Å; Q486-W510 HydrophobicContact CB-CH2 4.18Å; Q486-W510 HydrophobicContact CB-CZ2 4.2Å; Q486-W510 WeakPolarHBondContact O-CH2 3.38Å; E489-W510 HydrophobicContact CB-CZ2 4.11Å; E489-W510 HydrophobicContact CG-CZ2 4.25Å; E489-W510 PolarHBondContact OE1-NE1 3.42Å; L490-W510 HydrophobicContact CB-CE3 4.49Å; L490-W510 HydrophobicContact CB-CH2 3.72Å; L490-W510 HydrophobicContact CB-CZ2 4.44Å; L490-W510 HydrophobicContact CB-CZ3 3.76Å; L490-W510 HydrophobicContact CD1-CE3 3.98Å; L490-W510 HydrophobicContact CD1-CZ3 3.85Å; L490-W510 HydrophobicContact CD2-CZ3 4.11Å; L490-W510 HydrophobicContact CG-CZ3 4.11Å; N506-W510 PolarHBondContact O-N 3.46Å; G507-W510 PolarHBondContact O-N 2.91Å; M508-W510 VanDerWaalsContact C-N 3.31Å; M508-W510 PolarHBondContact O-N 3.45Å; W510-V512 VanDerWaalsContact C-N 3.34Å; W510-V512 PolarHBondContact O-N 3.26Å; W510-E513 PolarHBondContact O-N 3.21Å; W510-H514 AromaticContact CD2-CE1 3.99Å; W510-H514 AromaticContact CD2-ND1 3.53Å; W510-H514 AromaticContact CE2-CE1 3.51Å; W510-H514 AromaticContact CE2-ND1 3.49Å; W510-H514 AromaticContact CE3-ND1 3.83Å; W510-H514 AromaticContact CZ2-CE1 3.76Å; W510-H514 AromaticContact CZ2-ND1 3.78Å; W510-H514 HydrophobicContact CZ3-CB 4.29Å; W510-H514 AromaticContact NE1-CE1 3.6Å; W510-H514 AromaticContact NE1-ND1 3.92Å; W510-H514 PolarHBondContact O-N 3.26Å; W510-H514 PolarHBondContact O-ND1 3.47Å; W510-I521 HydrophobicContact CZ3-CD1 4.28Å; W510-I521 HydrophobicContact CZ3-CG1 4.46Å
511	C	92	Very high	89.3	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-36.4	176	-68.4	0	0	0	0	112.5	G507 M508 M509 H514 C515 I521 I549 Y563	G507-C511 PolarHBondContact O-N 3.34Å; G507-C511 VanDerWaalsContact O-N 3.07Å; G507-C511 PolarHBondContact O-SG 3.26Å; M508-C511 PolarHBondContact O-N 2.97Å; M508-C511 VanDerWaalsContact O-N 3.15Å; M509-C511 VanDerWaalsContact C-N 3.32Å; M509-C511 PolarHBondContact O-N 2.99Å; C511-H514 CarbonylContact O-C 3.52Å; C511-H514 PolarHBondContact O-N 3.2Å; C511-C515 PolarHBondContact O-N 3.43Å; C511-I521 HydrophobicContact CB-CG2 4.3Å; C511-I549 HydrophobicContact CB-CD1 3.74Å; C511-I549 HydrophobicContact CB-CG1 4.08Å; C511-Y563 PolarHBondContact O-OH 3.05Å
512	V	86.5	Confident	89.5	Confident	29 Å²	29	44 Å²	44	18%	0.176	22%	0.22	C	C	.	.	H	α-helix	trans	-73.4	-36.2	178	170.5	0	0	0	0	111.9	M508 M509 W510 H514 C515 V560	M508-V512 HydrophobicContact CE-CB 3.77Å; M508-V512 HydrophobicContact CE-CG1 4.45Å; M508-V512 HydrophobicContact CE-CG2 3.3Å; M508-V512 PolarHBondContact O-N 3.33Å; M509-V512 PolarHBondContact O-N 2.96Å; M509-V512 VanDerWaalsContact O-N 3.1Å; W510-V512 VanDerWaalsContact C-N 3.34Å; W510-V512 PolarHBondContact O-N 3.26Å; V512-H514 PolarHBondContact O-N 2.81Å; V512-C515 WeakPolarHBondContact O-CB 3.35Å; V512-C515 PolarHBondContact O-N 3.03Å; V512-C515 PolarHBondContact O-SG 3.41Å; V512-C515 VanDerWaalsContact O-SG 3.41Å; V512-V560 HydrophobicContact CG1-CG2 4.2Å; V512-V560 HydrophobicContact CG2-CG1 4.24Å
513	E	86	Confident	89.4	Confident	123 Å²	123	38.7 Å²	38.7	58%	0.575	20%	0.199	S	C	*	.	H	α-helix	trans	-63	-29.4	173.5	-73.2	173.1	175.1	0	0	112.6	M509 W510	M509-E513 WeakPolarHBondContact O-CG 3.3Å; M509-E513 PolarHBondContact O-N 3.02Å; W510-E513 PolarHBondContact O-N 3.21Å
514	H	87.6	Confident	89.4	Confident	30 Å²	30	36.6 Å²	36.6	14%	0.139	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	28.2	-179.5	-63	95.2	0	0	0	113.4	Q486 W510 C511 V512 E516 A517 I521	Q486-H514 PolarHBondContact NE2-CD2 3.4Å; Q486-H514 PolarHBondContact NE2-NE2 2.81Å; W510-H514 AromaticContact CD2-CE1 3.99Å; W510-H514 AromaticContact CD2-ND1 3.53Å; W510-H514 AromaticContact CE2-CE1 3.51Å; W510-H514 AromaticContact CE2-ND1 3.49Å; W510-H514 AromaticContact CE3-ND1 3.83Å; W510-H514 AromaticContact CZ2-CE1 3.76Å; W510-H514 AromaticContact CZ2-ND1 3.78Å; W510-H514 HydrophobicContact CZ3-CB 4.29Å; W510-H514 AromaticContact NE1-CE1 3.6Å; W510-H514 AromaticContact NE1-ND1 3.92Å; W510-H514 PolarHBondContact O-N 3.26Å; W510-H514 PolarHBondContact O-ND1 3.47Å; C511-H514 CarbonylContact O-C 3.52Å; C511-H514 PolarHBondContact O-N 3.2Å; V512-H514 PolarHBondContact O-N 2.81Å; H514-E516 WeakPolarHBondContact CA-OE1 3.46Å; H514-E516 WeakPolarHBondContact CA-OE2 3.47Å; H514-E516 IonicContact CD2-OE1 2.9Å; H514-E516 PolarHBondContact O-N 3.28Å; H514-E516 VanDerWaalsContact O-N 3.11Å; H514-A517 PolarHBondContact O-N 3.49Å; H514-I521 HydrophobicContact CB-CD1 3.81Å; H514-I521 WeakPolarHBondContact O-CD1 3.36Å
515	C	85.8	Confident	89.5	Confident	10 Å²	10	36.4 Å²	36.4	7%	0.068	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-63.8	-15.5	-173.4	64.6	0	0	0	0	115.1	C511 V512 A517 A518 L558 V560 Y563	C511-C515 PolarHBondContact O-N 3.43Å; V512-C515 WeakPolarHBondContact O-CB 3.35Å; V512-C515 PolarHBondContact O-N 3.03Å; V512-C515 PolarHBondContact O-SG 3.41Å; V512-C515 VanDerWaalsContact O-SG 3.41Å; C515-A517 PolarHBondContact O-N 3.49Å; C515-A518 WeakPolarHBondContact O-CB 3.28Å; C515-A518 PolarHBondContact O-N 3.11Å; C515-L558 PolarHBondContact SG-O 3.08Å; C515-V560 HydrophobicContact CB-CB 4.48Å; C515-V560 HydrophobicContact CB-CG2 3.73Å; C515-Y563 HydrophobicContact CB-CE2 3.8Å
516	E	80.4	Confident	89.6	Confident	87 Å²	87	35.8 Å²	35.8	41%	0.407	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-57.4	-32.9	170.3	67.7	-73.7	173.9	0	0	112.4	S480 H514	S480-E516 PolarHBondContact OG-O 2.77Å; S480-E516 VanDerWaalsContact OG-O 3.13Å; H514-E516 WeakPolarHBondContact CA-OE1 3.46Å; H514-E516 WeakPolarHBondContact CA-OE2 3.47Å; H514-E516 IonicContact CD2-OE1 2.9Å; H514-E516 PolarHBondContact O-N 3.28Å; H514-E516 VanDerWaalsContact O-N 3.11Å
517	A	84.6	Confident	89.6	Confident	5 Å²	5	34.5 Å²	34.5	4%	0.041	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-100.6	26.6	179.9	0	0	0	0	0	112.9	S480 F482 H514 C515 E519 E520 I521	S480-A517 WeakPolarHBondContact OG-CA 3.02Å; F482-A517 HydrophobicContact CB-CB 4.44Å; F482-A517 HydrophobicContact CD2-CB 3.96Å; H514-A517 PolarHBondContact O-N 3.49Å; C515-A517 PolarHBondContact O-N 3.49Å; A517-E519 VanDerWaalsContact C-N 3.25Å; A517-E519 PolarHBondContact O-N 3.08Å; A517-E519 VanDerWaalsContact O-N 3.1Å; A517-E520 PolarHBondContact O-N 2.98Å; A517-E520 VanDerWaalsContact O-N 3.11Å; A517-I521 HydrophobicContact CB-CD1 4.28Å; A517-I521 HydrophobicContact CB-CG1 4.45Å; A517-I521 WeakPolarHBondContact O-CG1 3.33Å; A517-I521 PolarHBondContact O-N 3.29Å
518	A	87.5	Confident	89.6	Confident	2 Å²	2	34.9 Å²	34.9	2%	0.017	19%	0.185	C	C	.	.	H	α-helix	trans	-51.9	-38.1	-172.4	0	0	0	0	0	114.5	C515 V522 Y563 Y566	C515-A518 WeakPolarHBondContact O-CB 3.28Å; C515-A518 PolarHBondContact O-N 3.11Å; A518-V522 WeakPolarHBondContact O-CB 3.25Å; A518-V522 VanDerWaalsContact O-CG2 3.23Å; A518-V522 WeakPolarHBondContact O-CG2 3.38Å; A518-V522 PolarHBondContact O-N 2.9Å; A518-Y563 HydrophobicContact CB-CD1 3.87Å; A518-Y563 HydrophobicContact CB-CD2 4.17Å; A518-Y563 HydrophobicContact CB-CE1 3.66Å; A518-Y563 HydrophobicContact CB-CE2 3.99Å; A518-Y563 HydrophobicContact CB-CG 4.11Å; A518-Y566 HydrophobicContact CB-CD2 4.1Å; A518-Y566 HydrophobicContact CB-CE2 4.39Å
519	E	87.6	Confident	89.7	Confident	90 Å²	90	34.1 Å²	34.1	42%	0.421	18%	0.181	S	C	.	.	H	α-helix	trans	-62.8	-51.4	178.4	-171.9	165.3	-177.8	0	0	111.8	A517 I521 V522 D523 Y566	A517-E519 VanDerWaalsContact C-N 3.25Å; A517-E519 PolarHBondContact O-N 3.08Å; A517-E519 VanDerWaalsContact O-N 3.1Å; E519-I521 VanDerWaalsContact C-N 3.35Å; E519-I521 PolarHBondContact O-N 3.27Å; E519-V522 PolarHBondContact O-N 2.91Å; E519-D523 WeakPolarHBondContact O-CB 3.45Å; E519-D523 VanDerWaalsContact O-CG 3.28Å; E519-D523 PolarHBondContact O-N 2.94Å; E519-Y566 HydrophobicContact CB-CD1 4Å; E519-Y566 HydrophobicContact CB-CD2 4.07Å; E519-Y566 HydrophobicContact CB-CE1 3.76Å; E519-Y566 HydrophobicContact CB-CE2 3.84Å; E519-Y566 HydrophobicContact CB-CG 4.14Å; E519-Y566 HydrophobicContact CG-CD1 3.79Å; E519-Y566 HydrophobicContact CG-CE1 3.6Å; E519-Y566 HydrophobicContact CG-CG 4.36Å; E519-Y566 VanDerWaalsContact OE2-CE1 3.28Å; E519-Y566 WeakPolarHBondContact OE2-CE1 3.31Å; E519-Y566 PolarHBondContact OE2-OH 3.26Å
520	E	86.3	Confident	89.7	Confident	57 Å²	57	34.1 Å²	34.1	27%	0.266	19%	0.19	S	C	.	.	H	α-helix	trans	-65.5	-38.4	179.3	-66	-172.4	-148.4	0	0	112	F482 A517 D523 I524	F482-E520 WeakPolarHBondContact CB-OE2 3.39Å; A517-E520 PolarHBondContact O-N 2.98Å; A517-E520 VanDerWaalsContact O-N 3.11Å; E520-D523 PolarHBondContact O-N 2.92Å; E520-I524 WeakPolarHBondContact O-CB 3.23Å; E520-I524 WeakPolarHBondContact O-CD1 3.14Å; E520-I524 VanDerWaalsContact O-CG1 3.23Å; E520-I524 WeakPolarHBondContact O-CG1 3.29Å; E520-I524 PolarHBondContact O-N 3.22Å
521	I	92.5	Very high	89.4	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.3	-47.7	176.3	-69.4	170.3	0	0	0	110.1	F482 L490 W510 C511 H514 A517 E519 D523 I524 I525 Y563	F482-I521 HydrophobicContact CE2-CG1 4.15Å; F482-I521 HydrophobicContact CZ-CG1 4.39Å; L490-I521 HydrophobicContact CD2-CB 4.32Å; L490-I521 HydrophobicContact CD2-CG1 4.17Å; L490-I521 HydrophobicContact CD2-CG2 4.09Å; W510-I521 HydrophobicContact CZ3-CD1 4.28Å; W510-I521 HydrophobicContact CZ3-CG1 4.46Å; C511-I521 HydrophobicContact CB-CG2 4.3Å; H514-I521 HydrophobicContact CB-CD1 3.81Å; H514-I521 WeakPolarHBondContact O-CD1 3.36Å; A517-I521 HydrophobicContact CB-CD1 4.28Å; A517-I521 HydrophobicContact CB-CG1 4.45Å; A517-I521 WeakPolarHBondContact O-CG1 3.33Å; A517-I521 PolarHBondContact O-N 3.29Å; E519-I521 VanDerWaalsContact C-N 3.35Å; E519-I521 PolarHBondContact O-N 3.27Å; I521-D523 VanDerWaalsContact C-N 3.34Å; I521-D523 PolarHBondContact O-N 2.89Å; I521-I524 PolarHBondContact O-N 3.49Å; I521-I525 HydrophobicContact CG2-CD1 3.85Å; I521-I525 VanDerWaalsContact O-CG1 3.26Å; I521-I525 WeakPolarHBondContact O-CG1 3.28Å; I521-I525 PolarHBondContact O-N 2.97Å; I521-Y563 HydrophobicContact CB-CE1 4.3Å; I521-Y563 WeakPolarHBondContact CD1-OH 3.34Å; I521-Y563 HydrophobicContact CG2-CE1 4.03Å
522	V	94.5	Very high	89	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-64.6	-40.7	177.7	172	0	0	0	0	111.2	A518 E519 I524 I525 A526 Y563 I567 R570	A518-V522 WeakPolarHBondContact O-CB 3.25Å; A518-V522 VanDerWaalsContact O-CG2 3.23Å; A518-V522 WeakPolarHBondContact O-CG2 3.38Å; A518-V522 PolarHBondContact O-N 2.9Å; E519-V522 PolarHBondContact O-N 2.91Å; V522-I524 VanDerWaalsContact C-N 3.34Å; V522-I524 PolarHBondContact O-N 3.02Å; V522-I525 PolarHBondContact O-N 2.94Å; V522-A526 WeakPolarHBondContact O-CB 3.44Å; V522-A526 PolarHBondContact O-N 3.08Å; V522-Y563 HydrophobicContact CG2-CD1 3.65Å; V522-Y563 HydrophobicContact CG2-CE1 3.95Å; V522-I567 HydrophobicContact CG1-CG1 4.15Å; V522-I567 HydrophobicContact CG2-CD1 4.41Å; V522-I567 HydrophobicContact CG2-CG1 3.56Å; V522-R570 HydrophobicContact CG1-CB 4.28Å; V522-R570 HydrophobicContact CG1-CG 4.08Å
523	D	90.5	Very high	89	Confident	48 Å²	48	47 Å²	47	26%	0.257	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-41.7	178.3	-77.5	12.8	0	0	0	111.9	E519 E520 I521 A527 R570	E519-D523 WeakPolarHBondContact O-CB 3.45Å; E519-D523 VanDerWaalsContact O-CG 3.28Å; E519-D523 PolarHBondContact O-N 2.94Å; E520-D523 PolarHBondContact O-N 2.92Å; I521-D523 VanDerWaalsContact C-N 3.34Å; I521-D523 PolarHBondContact O-N 2.89Å; D523-A527 WeakPolarHBondContact O-CB 3.48Å; D523-A527 PolarHBondContact O-N 2.92Å; D523-R570 VanDerWaalsContact CG-CZ 3.46Å; D523-R570 IonicContact OD1-CZ 3.97Å; D523-R570 IonicContact OD1-NE 3.69Å; D523-R570 IonicContact OD1-NH1 3.75Å; D523-R570 PolarHBondContact OD1-NH1 2.82Å; D523-R570 IonicContact OD1-NH2 3.08Å; D523-R570 PolarHBondContact OD1-NH2 3.14Å; D523-R570 IonicContact OD2-CZ 2.64Å; D523-R570 IonicContact OD2-NH1 3.9Å; D523-R570 IonicContact OD2-NH2 2.84Å; D523-R570 PolarHBondContact OD2-NH2 2.71Å
524	I	92.2	Very high	89.1	Confident	16 Å²	16	41.8 Å²	41.8	8%	0.082	24%	0.242	C	C	.	.	H	α-helix	trans	-66.1	-45.9	175.8	-68.7	163.9	0	0	0	110.7	F482 R487 L490 E491 L494 E520 I521 V522 A526 A527 S528	F482-I524 HydrophobicContact CD1-CD1 4.02Å; F482-I524 HydrophobicContact CE1-CD1 3.41Å; F482-I524 VanDerWaalsContact CE1-CD1 3.41Å; F482-I524 HydrophobicContact CZ-CD1 4.27Å; R487-I524 HydrophobicContact CG-CD1 4.05Å; L490-I524 HydrophobicContact CD2-CB 4.07Å; L490-I524 HydrophobicContact CD2-CD1 4.06Å; L490-I524 HydrophobicContact CD2-CG2 3.88Å; L490-I524 HydrophobicContact CG-CG2 4.25Å; E491-I524 HydrophobicContact CG-CG2 4.1Å; L494-I524 HydrophobicContact CD1-CG2 4.02Å; E520-I524 WeakPolarHBondContact O-CB 3.23Å; E520-I524 WeakPolarHBondContact O-CD1 3.14Å; E520-I524 VanDerWaalsContact O-CG1 3.23Å; E520-I524 WeakPolarHBondContact O-CG1 3.29Å; E520-I524 PolarHBondContact O-N 3.22Å; I521-I524 PolarHBondContact O-N 3.49Å; V522-I524 VanDerWaalsContact C-N 3.34Å; V522-I524 PolarHBondContact O-N 3.02Å; I524-A526 PolarHBondContact O-N 3.07Å; I524-A527 PolarHBondContact O-N 3.21Å; I524-S528 WeakPolarHBondContact O-CB 3.41Å; I524-S528 PolarHBondContact O-N 2.93Å
525	I	95.6	Very high	89.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.6	-47.2	177.6	-65.7	166.7	0	0	0	109.9	L494 I521 V522 S528 F529 L545 L546 I549	L494-I525 HydrophobicContact CD1-CG1 4.07Å; L494-I525 HydrophobicContact CD2-CG1 4.26Å; I521-I525 HydrophobicContact CG2-CD1 3.85Å; I521-I525 VanDerWaalsContact O-CG1 3.26Å; I521-I525 WeakPolarHBondContact O-CG1 3.28Å; I521-I525 PolarHBondContact O-N 2.97Å; V522-I525 PolarHBondContact O-N 2.94Å; I525-S528 WeakPolarHBondContact O-CB 3.47Å; I525-S528 PolarHBondContact O-N 3.39Å; I525-S528 PolarHBondContact O-OG 2.85Å; I525-F529 HydrophobicContact CG2-CE2 4.01Å; I525-F529 WeakPolarHBondContact O-CD2 3.29Å; I525-L545 HydrophobicContact CD1-CD2 4.14Å; I525-L546 HydrophobicContact CB-CD2 4.33Å; I525-L546 HydrophobicContact CD1-CD2 4.09Å; I525-L546 HydrophobicContact CG2-CD1 4.01Å; I525-L546 HydrophobicContact CG2-CD2 3.72Å; I525-L546 HydrophobicContact CG2-CG 3.84Å; I525-I549 HydrophobicContact CD1-CD1 4.24Å
526	A	94.6	Very high	89.3	Confident	10 Å²	10	44.4 Å²	44.4	8%	0.083	26%	0.26	C	S	.	.	H	α-helix	trans	-61.9	-47.8	179.2	0	0	0	0	0	111.9	V522 I524 S528 F529 R570 I574	V522-A526 WeakPolarHBondContact O-CB 3.44Å; V522-A526 PolarHBondContact O-N 3.08Å; I524-A526 PolarHBondContact O-N 3.07Å; A526-S528 PolarHBondContact O-N 3.11Å; A526-F529 WeakPolarHBondContact O-CB 3.25Å; A526-F529 PolarHBondContact O-N 3.34Å; A526-R570 HydrophobicContact CB-CB 3.83Å; A526-R570 HydrophobicContact CB-CG 3.95Å; A526-I574 HydrophobicContact CB-CD1 4.14Å; A526-I574 HydrophobicContact CB-CG1 4.22Å
527	A	91.3	Very high	89.8	Confident	66 Å²	66	43.5 Å²	43.5	55%	0.545	26%	0.257	S	S	.	.	H	α-helix	trans	-59.2	-34.5	175.9	0	0	0	0	0	111.9	D523 I524 F529 S530	D523-A527 WeakPolarHBondContact O-CB 3.48Å; D523-A527 PolarHBondContact O-N 2.92Å; I524-A527 PolarHBondContact O-N 3.21Å; A527-F529 PolarHBondContact O-N 2.99Å; A527-S530 WeakPolarHBondContact O-CB 3.42Å; A527-S530 PolarHBondContact O-N 3.43Å
528	S	93.8	Very high	90.1	Very high	21 Å²	21	48.7 Å²	48.7	15%	0.147	28%	0.276	C	S	.	.	H	α-helix	trans	-66.4	-18.3	177.9	84.1	0	0	0	0	114.1	I524 I525 A526 S530 L534 R542	I524-S528 WeakPolarHBondContact O-CB 3.41Å; I524-S528 PolarHBondContact O-N 2.93Å; I525-S528 WeakPolarHBondContact O-CB 3.47Å; I525-S528 PolarHBondContact O-N 3.39Å; I525-S528 PolarHBondContact O-OG 2.85Å; A526-S528 PolarHBondContact O-N 3.11Å; S528-S530 VanDerWaalsContact C-N 3.28Å; S528-L534 VanDerWaalsContact O-CD2 3.29Å; S528-L534 WeakPolarHBondContact O-CD2 3.29Å; S528-R542 VanDerWaalsContact OG-CD 3.27Å; S528-R542 WeakPolarHBondContact OG-CD 3.49Å; S528-R542 PolarHBondContact OG-NE 3.31Å
529	F	93.8	Very high	90.5	Very high	1 Å²	1	49.3 Å²	49.3	0%	0.004	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-25	171.5	-78.5	-96.8	0	0	0	112.5	I525 A526 A527 D531 K539 R542 L543 L546 I574 S577 L578	I525-F529 HydrophobicContact CG2-CE2 4.01Å; I525-F529 WeakPolarHBondContact O-CD2 3.29Å; A526-F529 WeakPolarHBondContact O-CB 3.25Å; A526-F529 PolarHBondContact O-N 3.34Å; A527-F529 PolarHBondContact O-N 2.99Å; F529-D531 VanDerWaalsContact C-N 3.25Å; F529-D531 PolarHBondContact O-N 3.47Å; F529-K539 HydrophobicContact CD1-CB 4.1Å; F529-K539 HydrophobicContact CD1-CG 4.41Å; F529-K539 HydrophobicContact CE1-CB 4.15Å; F529-K539 VanDerWaalsContact CE1-O 3.25Å; F529-K539 WeakPolarHBondContact CE1-O 3.29Å; F529-K539 WeakPolarHBondContact O-CE 3.36Å; F529-K539 PolarHBondContact O-NZ 3.42Å; F529-R542 HydrophobicContact CE1-CB 4.13Å; F529-R542 HydrophobicContact CE2-CB 3.65Å; F529-R542 HydrophobicContact CZ-CB 3.4Å; F529-R542 VanDerWaalsContact CZ-CB 3.4Å; F529-L543 HydrophobicContact CZ-CB 4.37Å; F529-L546 HydrophobicContact CE2-CD1 4Å; F529-L546 HydrophobicContact CZ-CD1 4.3Å; F529-I574 HydrophobicContact CD1-CG2 3.88Å; F529-I574 HydrophobicContact CD2-CD1 4.44Å; F529-I574 HydrophobicContact CD2-CG1 3.95Å; F529-I574 HydrophobicContact CD2-CG2 4.15Å; F529-I574 HydrophobicContact CE1-CG2 3.69Å; F529-I574 HydrophobicContact CE2-CD1 4.28Å; F529-I574 HydrophobicContact CE2-CG1 4.19Å; F529-I574 HydrophobicContact CE2-CG2 3.98Å; F529-I574 HydrophobicContact CG-CG1 4.34Å; F529-I574 HydrophobicContact CG-CG2 4.1Å; F529-I574 HydrophobicContact CZ-CG2 3.74Å; F529-S577 PolarHBondContact O-OG 3.47Å; F529-L578 HydrophobicContact CD1-CD2 4.36Å; F529-L578 HydrophobicContact CD1-CG 4.48Å; F529-L578 HydrophobicContact CE1-CD2 4.19Å; F529-L578 HydrophobicContact CE1-CG 4.41Å
530	S	88	Confident	90.8	Very high	92 Å²	92	45 Å²	45	64%	0.643	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-7	-178.4	-59.5	0	0	0	0	113.4	A527 S528 P532	A527-S530 WeakPolarHBondContact O-CB 3.42Å; A527-S530 PolarHBondContact O-N 3.43Å; S528-S530 VanDerWaalsContact C-N 3.28Å; S530-P532 WeakPolarHBondContact O-CD 3.48Å
531	D	86.8	Confident	91.3	Very high	69 Å²	69	42.3 Å²	42.3	37%	0.369	25%	0.246	S	C	.	.			trans	-64.4	117.7	174.3	-175.7	-4.8	0	0	0	110.4	F529 D533 L534	F529-D531 VanDerWaalsContact C-N 3.25Å; F529-D531 PolarHBondContact O-N 3.47Å; D531-D533 VanDerWaalsContact C-N 3.32Å; D531-D533 PolarHBondContact OD1-N 2.85Å; D531-L534 HydrophobicContact CB-CB 4Å; D531-L534 WeakPolarHBondContact O-CB 3.36Å; D531-L534 PolarHBondContact O-N 2.96Å
532	P	82.7	Confident	91.5	Very high	115 Å²	115	42.7 Å²	42.7	75%	0.747	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-28.1	179.5	29.4	-35.1	0	0	0	112.7	S530 L534	S530-P532 WeakPolarHBondContact O-CD 3.48Å; P532-L534 PolarHBondContact O-N 3.17Å
533	D	86.3	Confident	91.6	Very high	144 Å²	144	42.7 Å²	42.7	77%	0.77	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-8.2	-178.9	-65.9	-33	0	0	0	111.8	D531 P535	D531-D533 VanDerWaalsContact C-N 3.32Å; D531-D533 PolarHBondContact OD1-N 2.85Å; D533-P535 VanDerWaalsContact O-CD 3.25Å; D533-P535 WeakPolarHBondContact O-CD 3.38Å
534	L	88.9	Confident	92	Very high	14 Å²	14	43.3 Å²	43.3	7%	0.073	25%	0.246	C	C	.	.	S	Bend	trans	-78.6	116	-176.7	-173.5	66	0	0	0	112.1	S528 D531 P532 R538 K539	S528-L534 VanDerWaalsContact O-CD2 3.29Å; S528-L534 WeakPolarHBondContact O-CD2 3.29Å; D531-L534 HydrophobicContact CB-CB 4Å; D531-L534 WeakPolarHBondContact O-CB 3.36Å; D531-L534 PolarHBondContact O-N 2.96Å; P532-L534 PolarHBondContact O-N 3.17Å; L534-R538 HydrophobicContact CD1-CB 3.66Å; L534-R538 HydrophobicContact CD1-CG 4.44Å; L534-R538 HydrophobicContact CG-CB 4.17Å; L534-K539 HydrophobicContact CD2-CG 3.67Å; L534-K539 HydrophobicContact CG-CG 4.02Å; L534-K539 WeakPolarHBondContact O-CE 3.43Å
535	P	88.5	Confident	92.2	Very high	65 Å²	65	42.7 Å²	42.7	42%	0.422	24%	0.243	S	C	.	.			trans	-61.5	142.9	179.3	-22.5	34	0	0	0	112.2	D533 L537 R538 K539	D533-P535 VanDerWaalsContact O-CD 3.25Å; D533-P535 WeakPolarHBondContact O-CD 3.38Å; P535-L537 VanDerWaalsContact C-N 3.26Å; P535-L537 PolarHBondContact O-N 2.93Å; P535-L537 VanDerWaalsContact O-N 3.12Å; P535-R538 WeakPolarHBondContact O-CA 3.43Å; P535-R538 WeakPolarHBondContact O-CB 3.4Å; P535-R538 PolarHBondContact O-N 3.31Å; P535-K539 PolarHBondContact O-N 3.05Å; P535-K539 VanDerWaalsContact O-N 3.16Å
536	L	88.3	Confident	92.3	Very high	30 Å²	30	42.7 Å²	42.7	16%	0.157	24%	0.243	C	C	.	.	H	α-helix	trans	-51.6	-40.5	-178	175	64.7	0	0	0	113.7	R538 K539 I540 A581 I585 I594	L536-R538 VanDerWaalsContact C-N 3.25Å; L536-R538 PolarHBondContact O-N 2.86Å; L536-K539 WeakPolarHBondContact O-CA 3.28Å; L536-K539 WeakPolarHBondContact O-CB 3.19Å; L536-K539 PolarHBondContact O-N 3.02Å; L536-I540 WeakPolarHBondContact O-CG1 3.34Å; L536-I540 PolarHBondContact O-N 3.14Å; L536-A581 HydrophobicContact CD1-CB 3.67Å; L536-I585 HydrophobicContact CD2-CD1 3.36Å; L536-I585 HydrophobicContact CD2-CG1 3.73Å; L536-I594 HydrophobicContact CD1-CG2 4.33Å; L536-I594 HydrophobicContact CD2-CD1 4.19Å; L536-I594 HydrophobicContact CD2-CG1 3.93Å; L536-I594 HydrophobicContact CD2-CG2 4.11Å; L536-I594 HydrophobicContact CG-CD1 4.36Å; L536-I594 HydrophobicContact CG-CG2 4.43Å
537	L	90.7	Very high	92.2	Very high	68 Å²	68	43 Å²	43	36%	0.356	24%	0.244	S	C	.	.	H	α-helix	trans	-62	-32.6	177.6	-74.9	165.4	0	0	0	112.7	L499 P535 I540 A541 I594	L499-L537 HydrophobicContact CD1-CB 4.46Å; L499-L537 HydrophobicContact CD1-CD2 3.71Å; P535-L537 VanDerWaalsContact C-N 3.26Å; P535-L537 PolarHBondContact O-N 2.93Å; P535-L537 VanDerWaalsContact O-N 3.12Å; L537-I540 PolarHBondContact O-N 3.4Å; L537-A541 PolarHBondContact O-N 3.49Å; L537-I594 HydrophobicContact CD2-CD1 4.14Å
538	R	92.9	Very high	92.4	Very high	113 Å²	113	42.7 Å²	42.7	43%	0.426	23%	0.234	S	C	.	.	H	α-helix	trans	-77.3	-26.5	174.4	-63.8	-166.2	-176.3	155.9	-1.5	112.4	L534 P535 L536 A541 R542	L534-R538 HydrophobicContact CD1-CB 3.66Å; L534-R538 HydrophobicContact CD1-CG 4.44Å; L534-R538 HydrophobicContact CG-CB 4.17Å; P535-R538 WeakPolarHBondContact O-CA 3.43Å; P535-R538 WeakPolarHBondContact O-CB 3.4Å; P535-R538 PolarHBondContact O-N 3.31Å; L536-R538 VanDerWaalsContact C-N 3.25Å; L536-R538 PolarHBondContact O-N 2.86Å; R538-A541 PolarHBondContact O-N 3.29Å; R538-R542 WeakPolarHBondContact O-CG 3.36Å; R538-R542 PolarHBondContact O-N 3.48Å; R538-R542 VanDerWaalsContact O-N 3.13Å; R538-R542 PolarHBondContact O-NH1 3.44Å
539	K	94.5	Very high	92.4	Very high	16 Å²	16	41.7 Å²	41.7	7%	0.07	23%	0.227	C	C	.	.	H	α-helix	trans	-64.4	-42.6	166.9	-61.1	-168.4	-178.3	-157.7	0	110.7	F529 L534 P535 L536 A541 R542 L543 S577 L578 A581	F529-K539 HydrophobicContact CD1-CB 4.1Å; F529-K539 HydrophobicContact CD1-CG 4.41Å; F529-K539 HydrophobicContact CE1-CB 4.15Å; F529-K539 VanDerWaalsContact CE1-O 3.25Å; F529-K539 WeakPolarHBondContact CE1-O 3.29Å; F529-K539 WeakPolarHBondContact O-CE 3.36Å; F529-K539 PolarHBondContact O-NZ 3.42Å; L534-K539 HydrophobicContact CD2-CG 3.67Å; L534-K539 HydrophobicContact CG-CG 4.02Å; L534-K539 WeakPolarHBondContact O-CE 3.43Å; P535-K539 PolarHBondContact O-N 3.05Å; P535-K539 VanDerWaalsContact O-N 3.16Å; L536-K539 WeakPolarHBondContact O-CA 3.28Å; L536-K539 WeakPolarHBondContact O-CB 3.19Å; L536-K539 PolarHBondContact O-N 3.02Å; K539-A541 PolarHBondContact O-N 3.1Å; K539-R542 PolarHBondContact O-N 3.44Å; K539-L543 PolarHBondContact O-N 2.88Å; K539-S577 PolarHBondContact NZ-OG 3.06Å; K539-L578 HydrophobicContact CB-CD2 3.94Å; K539-A581 HydrophobicContact CD-CB 4.16Å
540	I	95.1	Very high	92.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64	-39.3	174.1	-58.2	-58.2	0	0	0	111.7	L499 L536 L537 R542 L543 Y544 L578 I594 R597 V598	L499-I540 HydrophobicContact CD2-CB 4.3Å; L499-I540 HydrophobicContact CD2-CG2 3.9Å; L536-I540 WeakPolarHBondContact O-CG1 3.34Å; L536-I540 PolarHBondContact O-N 3.14Å; L537-I540 PolarHBondContact O-N 3.4Å; I540-R542 VanDerWaalsContact C-N 3.33Å; I540-R542 PolarHBondContact O-N 2.99Å; I540-L543 WeakPolarHBondContact O-CB 3.42Å; I540-L543 PolarHBondContact O-N 3.32Å; I540-L543 VanDerWaalsContact O-N 3.13Å; I540-Y544 HydrophobicContact CG2-CD1 4.47Å; I540-Y544 HydrophobicContact CG2-CD2 4.49Å; I540-Y544 HydrophobicContact CG2-CE1 4.06Å; I540-Y544 HydrophobicContact CG2-CE2 4.08Å; I540-Y544 PolarHBondContact O-N 2.92Å; I540-L578 HydrophobicContact CD1-CD2 4.22Å; I540-I594 HydrophobicContact CD1-CG2 4.09Å; I540-I594 HydrophobicContact CG1-CD1 4.16Å; I540-I594 HydrophobicContact CG1-CG2 4.45Å; I540-R597 HydrophobicContact CG2-CB 4.38Å; I540-V598 HydrophobicContact CD1-CG2 3.55Å
541	A	96.6	Very high	92.3	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.1	-40.3	174.6	0	0	0	0	0	113	L497 N498 L499 L537 R538 K539 L543 Y544 L545	L497-A541 HydrophobicContact CD2-CB 4.34Å; L497-A541 HydrophobicContact CG-CB 4.15Å; N498-A541 WeakPolarHBondContact O-CB 3.5Å; L499-A541 HydrophobicContact CD2-CB 4.16Å; L499-A541 HydrophobicContact CG-CB 4.45Å; L537-A541 PolarHBondContact O-N 3.49Å; R538-A541 PolarHBondContact O-N 3.29Å; K539-A541 PolarHBondContact O-N 3.1Å; A541-L543 VanDerWaalsContact C-N 3.35Å; A541-Y544 PolarHBondContact O-N 3.29Å; A541-L545 PolarHBondContact O-N 3.23Å
542	R	96.2	Very high	92.2	Very high	8 Å²	8	40 Å²	40	3%	0.03	22%	0.218	C	C	.	.	H	α-helix	trans	-66.2	-35.6	173.2	-69.9	165.8	173.8	62.6	-1.2	112.6	L494 L497 S528 F529 R538 K539 I540 Y544 L545 L546	L494-R542 HydrophobicContact CD2-CG 4.35Å; L494-R542 PolarHBondContact O-NH1 3.4Å; L494-R542 PolarHBondContact O-NH2 3.2Å; L497-R542 HydrophobicContact CD2-CB 4.5Å; L497-R542 HydrophobicContact CD2-CG 3.93Å; S528-R542 VanDerWaalsContact OG-CD 3.27Å; S528-R542 WeakPolarHBondContact OG-CD 3.49Å; S528-R542 PolarHBondContact OG-NE 3.31Å; F529-R542 HydrophobicContact CE1-CB 4.13Å; F529-R542 HydrophobicContact CE2-CB 3.65Å; F529-R542 HydrophobicContact CZ-CB 3.4Å; F529-R542 VanDerWaalsContact CZ-CB 3.4Å; R538-R542 WeakPolarHBondContact O-CG 3.36Å; R538-R542 PolarHBondContact O-N 3.48Å; R538-R542 VanDerWaalsContact O-N 3.13Å; R538-R542 PolarHBondContact O-NH1 3.44Å; K539-R542 PolarHBondContact O-N 3.44Å; I540-R542 VanDerWaalsContact C-N 3.33Å; I540-R542 PolarHBondContact O-N 2.99Å; R542-Y544 VanDerWaalsContact C-N 3.32Å; R542-L545 WeakPolarHBondContact O-CB 3.45Å; R542-L545 PolarHBondContact O-N 3.06Å; R542-L546 WeakPolarHBondContact O-CG 3.41Å; R542-L546 PolarHBondContact O-N 3.06Å
543	L	97.1	Very high	92.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.7	-39.5	174.2	-176	66.2	0	0	0	110.9	F529 K539 I540 A541 L546 S547 F575 L578 V598 C601 W605	F529-L543 HydrophobicContact CZ-CB 4.37Å; K539-L543 PolarHBondContact O-N 2.88Å; I540-L543 WeakPolarHBondContact O-CB 3.42Å; I540-L543 PolarHBondContact O-N 3.32Å; I540-L543 VanDerWaalsContact O-N 3.13Å; A541-L543 VanDerWaalsContact C-N 3.35Å; L543-L546 PolarHBondContact O-N 3.39Å; L543-S547 WeakPolarHBondContact O-CB 3.37Å; L543-S547 PolarHBondContact O-N 3.21Å; L543-F575 HydrophobicContact CD1-CE2 4.25Å; L543-L578 HydrophobicContact CD1-CD1 4.45Å; L543-L578 HydrophobicContact CD2-CD1 4.02Å; L543-V598 HydrophobicContact CD2-CB 4.49Å; L543-V598 HydrophobicContact CD2-CG1 4.32Å; L543-V598 HydrophobicContact CD2-CG2 4.17Å; L543-C601 HydrophobicContact CD2-CB 4.43Å; L543-W605 HydrophobicContact CD1-CH2 3.87Å; L543-W605 HydrophobicContact CD1-CZ2 4.33Å
544	Y	97.5	Very high	91.6	Very high	62 Å²	62	33.2 Å²	33.2	24%	0.243	18%	0.18	C	C	.	.	H	α-helix	trans	-65.3	-40.5	172.7	-68.9	-12.2	0	0	0	112.1	L499 I540 A541 R542 L546 S547 D548 R597 C601	L499-Y544 HydrophobicContact CD2-CD2 3.7Å; L499-Y544 HydrophobicContact CD2-CE2 3.61Å; I540-Y544 HydrophobicContact CG2-CD1 4.47Å; I540-Y544 HydrophobicContact CG2-CD2 4.49Å; I540-Y544 HydrophobicContact CG2-CE1 4.06Å; I540-Y544 HydrophobicContact CG2-CE2 4.08Å; I540-Y544 PolarHBondContact O-N 2.92Å; A541-Y544 PolarHBondContact O-N 3.29Å; R542-Y544 VanDerWaalsContact C-N 3.32Å; Y544-L546 PolarHBondContact O-N 3.02Å; Y544-S547 WeakPolarHBondContact O-CB 3.28Å; Y544-S547 PolarHBondContact O-N 3.23Å; Y544-S547 VanDerWaalsContact O-N 3.16Å; Y544-D548 PolarHBondContact O-N 3.02Å; Y544-R597 WeakPolarHBondContact OH-CG 3.46Å; Y544-C601 VanDerWaalsContact CE1-SG 3.52Å
545	L	97.3	Very high	90.7	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.016	20%	0.195	C	C	.	.	H	α-helix	trans	-56.4	-48.4	171.8	173.2	62.2	0	0	0	111.9	L494 L497 V504 M508 I525 A541 R542 S547 D548 I549	L494-L545 HydrophobicContact CD2-CD2 3.78Å; L497-L545 HydrophobicContact CD2-CB 4.13Å; L497-L545 HydrophobicContact CD2-CD2 3.98Å; V504-L545 HydrophobicContact CG1-CB 4.33Å; M508-L545 HydrophobicContact CB-CD1 3.96Å; I525-L545 HydrophobicContact CD1-CD2 4.14Å; A541-L545 PolarHBondContact O-N 3.23Å; R542-L545 WeakPolarHBondContact O-CB 3.45Å; R542-L545 PolarHBondContact O-N 3.06Å; L545-S547 VanDerWaalsContact C-N 3.31Å; L545-S547 PolarHBondContact O-N 3.27Å; L545-D548 PolarHBondContact O-N 3.5Å; L545-I549 HydrophobicContact CD1-CD1 4.04Å; L545-I549 HydrophobicContact CD1-CG1 4.35Å; L545-I549 HydrophobicContact CG-CD1 4.05Å; L545-I549 VanDerWaalsContact O-CG1 3.26Å; L545-I549 WeakPolarHBondContact O-CG1 3.24Å; L545-I549 PolarHBondContact O-N 2.87Å
546	L	96.7	Very high	89.8	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-39.7	175.9	-69.8	176.2	0	0	0	112.1	I525 F529 R542 L543 Y544 I549 L550 I567 I574	I525-L546 HydrophobicContact CB-CD2 4.33Å; I525-L546 HydrophobicContact CD1-CD2 4.09Å; I525-L546 HydrophobicContact CG2-CD1 4.01Å; I525-L546 HydrophobicContact CG2-CD2 3.72Å; I525-L546 HydrophobicContact CG2-CG 3.84Å; F529-L546 HydrophobicContact CE2-CD1 4Å; F529-L546 HydrophobicContact CZ-CD1 4.3Å; R542-L546 WeakPolarHBondContact O-CG 3.41Å; R542-L546 PolarHBondContact O-N 3.06Å; L543-L546 PolarHBondContact O-N 3.39Å; Y544-L546 PolarHBondContact O-N 3.02Å; L546-I549 PolarHBondContact O-N 3.37Å; L546-L550 WeakPolarHBondContact O-CG 3.21Å; L546-L550 PolarHBondContact O-N 2.99Å; L546-I567 HydrophobicContact CD2-CD1 3.96Å; L546-I567 HydrophobicContact CD2-CG1 4.03Å; L546-I574 HydrophobicContact CD1-CD1 3.55Å
547	S	94.3	Very high	88.7	Confident	15 Å²	15	44.2 Å²	44.2	11%	0.105	23%	0.234	C	C	.	.	H	α-helix	trans	-64.9	-40.4	177.3	-168.2	0	0	0	0	112.3	L543 Y544 L545 L550 A551 W605	L543-S547 WeakPolarHBondContact O-CB 3.37Å; L543-S547 PolarHBondContact O-N 3.21Å; Y544-S547 WeakPolarHBondContact O-CB 3.28Å; Y544-S547 PolarHBondContact O-N 3.23Å; Y544-S547 VanDerWaalsContact O-N 3.16Å; L545-S547 VanDerWaalsContact C-N 3.31Å; L545-S547 PolarHBondContact O-N 3.27Å; S547-L550 PolarHBondContact O-N 3.3Å; S547-A551 PolarHBondContact O-N 3.41Å; S547-W605 PolarHBondContact OG-NE1 3.46Å
548	D	93.7	Very high	87.6	Confident	61 Å²	61	47.8 Å²	47.8	33%	0.326	25%	0.252	S	S	.	.	H	α-helix	trans	-69.7	-36.6	177.2	-78.5	12.6	0	0	0	111.2	V504 M508 Y544 L545 A551 N552	V504-D548 HydrophobicContact CG1-CB 4.46Å; V504-D548 WeakPolarHBondContact CG1-OD2 3.37Å; M508-D548 HydrophobicContact CB-CB 4.1Å; M508-D548 HydrophobicContact CG-CB 4.03Å; Y544-D548 PolarHBondContact O-N 3.02Å; L545-D548 PolarHBondContact O-N 3.5Å; D548-A551 PolarHBondContact O-N 2.9Å; D548-N552 PolarHBondContact O-N 3.16Å; D548-N552 VanDerWaalsContact O-N 3.14Å; D548-N552 PolarHBondContact O-ND2 2.83Å
549	I	94	Very high	86.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.3	-45.6	170.8	-67.3	164.2	0	0	0	110.2	M508 C511 I525 L545 L546 N552 C553 Y563 I567	M508-I549 HydrophobicContact CB-CG1 4.46Å; M508-I549 HydrophobicContact CG-CG1 4.36Å; C511-I549 HydrophobicContact CB-CD1 3.74Å; C511-I549 HydrophobicContact CB-CG1 4.08Å; I525-I549 HydrophobicContact CD1-CD1 4.24Å; L545-I549 HydrophobicContact CD1-CD1 4.04Å; L545-I549 HydrophobicContact CD1-CG1 4.35Å; L545-I549 HydrophobicContact CG-CD1 4.05Å; L545-I549 VanDerWaalsContact O-CG1 3.26Å; L545-I549 WeakPolarHBondContact O-CG1 3.24Å; L545-I549 PolarHBondContact O-N 2.87Å; L546-I549 PolarHBondContact O-N 3.37Å; I549-N552 CarbonylContact O-C 3.52Å; I549-N552 PolarHBondContact O-N 3.09Å; I549-C553 WeakPolarHBondContact O-CB 3.43Å; I549-C553 PolarHBondContact O-N 3.38Å; I549-Y563 HydrophobicContact CG2-CD1 3.69Å; I549-Y563 HydrophobicContact CG2-CD2 3.78Å; I549-Y563 HydrophobicContact CG2-CE1 4.21Å; I549-Y563 HydrophobicContact CG2-CE2 4.28Å; I549-Y563 HydrophobicContact CG2-CG 3.45Å; I549-Y563 VanDerWaalsContact CG2-CG 3.45Å; I549-I567 HydrophobicContact CB-CD1 4.31Å; I549-I567 HydrophobicContact CG2-CD1 3.88Å
550	L	92.4	Very high	86	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-65.3	-36.5	177.6	-74	173.4	0	0	0	113	L546 S547 N552 C553 R564 I567 W605 V610 Y611	L546-L550 WeakPolarHBondContact O-CG 3.21Å; L546-L550 PolarHBondContact O-N 2.99Å; S547-L550 PolarHBondContact O-N 3.3Å; L550-N552 VanDerWaalsContact C-N 3.26Å; L550-N552 PolarHBondContact O-N 3.03Å; L550-C553 PolarHBondContact O-N 2.99Å; L550-C553 PolarHBondContact O-SG 3.49Å; L550-R564 HydrophobicContact CD2-CB 4.42Å; L550-I567 HydrophobicContact CD1-CG2 3.92Å; L550-I567 HydrophobicContact CD2-CB 4.19Å; L550-I567 HydrophobicContact CD2-CD1 3.81Å; L550-I567 HydrophobicContact CD2-CG2 4.29Å; L550-I567 HydrophobicContact CG-CD1 3.79Å; L550-I567 HydrophobicContact CG-CG2 4.27Å; L550-W605 HydrophobicContact CD1-CD2 4.35Å; L550-W605 HydrophobicContact CD1-CZ2 3.99Å; L550-V610 HydrophobicContact CB-CG1 4.42Å; L550-V610 HydrophobicContact CD1-CG1 4.37Å; L550-V610 HydrophobicContact CD2-CG1 4.01Å; L550-Y611 HydrophobicContact CD1-CE2 3.96Å; L550-Y611 HydrophobicContact CD2-CE2 4.47Å
551	A	88.1	Confident	85.4	Confident	55 Å²	55	49.7 Å²	49.7	46%	0.455	28%	0.275	S	S	.	.	H	α-helix	trans	-62.6	-37.4	175.1	0	0	0	0	0	111.4	S547 D548 T554	S547-A551 PolarHBondContact O-N 3.41Å; D548-A551 PolarHBondContact O-N 2.9Å; A551-T554 PolarHBondContact O-OG1 3.38Å
552	N	84.4	Confident	84.9	Confident	70 Å²	70	52.7 Å²	52.7	37%	0.374	29%	0.291	S	S	.	.	H	α-helix	trans	-90.4	-9.6	-179.5	-69.5	-70.8	0	0	0	114.1	M508 D548 I549 L550 T554 A555	M508-N552 HydrophobicContact CE-CB 4.36Å; D548-N552 PolarHBondContact O-N 3.16Å; D548-N552 VanDerWaalsContact O-N 3.14Å; D548-N552 PolarHBondContact O-ND2 2.83Å; I549-N552 CarbonylContact O-C 3.52Å; I549-N552 PolarHBondContact O-N 3.09Å; L550-N552 VanDerWaalsContact C-N 3.26Å; L550-N552 PolarHBondContact O-N 3.03Å; N552-T554 PolarHBondContact O-N 3.03Å; N552-T554 VanDerWaalsContact O-N 3.11Å; N552-A555 WeakPolarHBondContact O-CB 3.41Å; N552-A555 PolarHBondContact O-N 3.47Å
553	C	82.1	Confident	84.6	Confident	5 Å²	5	52.3 Å²	52.3	3%	0.034	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-8.2	-178.3	79.9	0	0	0	0	114.3	I549 L550 A555 V560 S561	I549-C553 WeakPolarHBondContact O-CB 3.43Å; I549-C553 PolarHBondContact O-N 3.38Å; L550-C553 PolarHBondContact O-N 2.99Å; L550-C553 PolarHBondContact O-SG 3.49Å; C553-A555 VanDerWaalsContact C-N 3.31Å; C553-V560 HydrophobicContact CB-CG1 4.29Å; C553-V560 WeakPolarHBondContact CB-O 3.22Å; C553-S561 WeakPolarHBondContact O-CA 3Å
554	T	75.1	Confident	84.4	Confident	112 Å²	112	57.6 Å²	57.6	69%	0.687	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-4.4	172.1	59.9	0	0	0	0	113	A551 N552	A551-T554 PolarHBondContact O-OG1 3.38Å; N552-T554 PolarHBondContact O-N 3.03Å; N552-T554 VanDerWaalsContact O-N 3.11Å
555	A	69.6	Low	83.9	Confident	46 Å²	46	59.6 Å²	59.6	38%	0.38	32%	0.319	S	S	.	.	S	Bend	trans	-65.1	149.4	176.2	0	0	0	0	0	112	N552 C553 V557	N552-A555 WeakPolarHBondContact O-CB 3.41Å; N552-A555 PolarHBondContact O-N 3.47Å; C553-A555 VanDerWaalsContact C-N 3.31Å; A555-V557 HydrophobicContact CB-CG2 4.32Å; A555-V557 PolarHBondContact O-N 3.27Å
556	K	69.4	Low	83.6	Confident	218 Å²	218	61.3 Å²	61.3	95%	0.948	33%	0.326	S	S	*	.	S	Bend	trans	-77	46.7	178.2	-63.1	-176.9	179.3	-179.2	0	112.4
557	V	65.4	Low	83.5	Confident	75 Å²	75	61.3 Å²	61.3	46%	0.455	33%	0.326	S	S	.	.	S	Bend	trans	-106.8	135.5	174.2	-176.9	0	0	0	0	107.6	A555 V560	A555-V557 HydrophobicContact CB-CG2 4.32Å; A555-V557 PolarHBondContact O-N 3.27Å; V557-V560 HydrophobicContact CB-CB 4.35Å; V557-V560 HydrophobicContact CB-CG2 3.5Å; V557-V560 HydrophobicContact CG1-CG2 3.51Å
558	L	67.5	Low	83.5	Confident	143 Å²	143	61 Å²	61	75%	0.749	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	140.5	176	-83.1	147.3	0	0	0	110.1	C515 V560	C515-L558 PolarHBondContact SG-O 3.08Å; L558-V560 PolarHBondContact O-N 3.26Å
559	H	69.4	Low	83.4	Confident	94 Å²	94	62.1 Å²	62.1	44%	0.435	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	-21.9	177.6	-54.4	-64.1	0	0	0	117.9	S561 L562	H559-S561 PolarHBondContact O-N 3.01Å; H559-S561 VanDerWaalsContact O-N 3.16Å; H559-L562 HydrophobicContact CB-CD1 4.11Å; H559-L562 WeakPolarHBondContact O-CB 3.45Å; H559-L562 VanDerWaalsContact O-CG 3.31Å; H559-L562 WeakPolarHBondContact O-CG 3.34Å; H559-L562 PolarHBondContact O-N 3.11Å
560	V	83.4	Confident	83.4	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.006	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-32.8	-178.4	-168.6	0	0	0	0	112.1	V512 C515 C553 V557 L558 L562 Y563	V512-V560 HydrophobicContact CG1-CG2 4.2Å; V512-V560 HydrophobicContact CG2-CG1 4.24Å; C515-V560 HydrophobicContact CB-CB 4.48Å; C515-V560 HydrophobicContact CB-CG2 3.73Å; C553-V560 HydrophobicContact CB-CG1 4.29Å; C553-V560 WeakPolarHBondContact CB-O 3.22Å; V557-V560 HydrophobicContact CB-CB 4.35Å; V557-V560 HydrophobicContact CB-CG2 3.5Å; V557-V560 HydrophobicContact CG1-CG2 3.51Å; L558-V560 PolarHBondContact O-N 3.26Å; V560-L562 PolarHBondContact O-N 3.14Å; V560-L562 VanDerWaalsContact O-N 3.09Å; V560-Y563 HydrophobicContact CG1-CD2 4.07Å; V560-Y563 WeakPolarHBondContact O-CB 3.18Å; V560-Y563 WeakPolarHBondContact O-CD2 3.25Å; V560-Y563 PolarHBondContact O-N 3.39Å; V560-Y563 VanDerWaalsContact O-N 3.12Å
561	S	83.3	Confident	83.6	Confident	75 Å²	75	65.5 Å²	65.5	52%	0.524	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-19.9	175.3	63.5	0	0	0	0	114	C553 H559 Y563 R564	C553-S561 WeakPolarHBondContact O-CA 3Å; H559-S561 PolarHBondContact O-N 3.01Å; H559-S561 VanDerWaalsContact O-N 3.16Å; S561-Y563 VanDerWaalsContact C-N 3.29Å; S561-Y563 PolarHBondContact O-N 3.43Å; S561-R564 PolarHBondContact O-N 2.84Å
562	L	85.3	Confident	83.8	Confident	63 Å²	63	65.6 Å²	65.6	33%	0.33	34%	0.335	S	S	.	.	H	α-helix	trans	-68.9	-26.9	177.6	-60.7	175.1	0	0	0	112.5	H559 V560 R564 K565 Y566	H559-L562 HydrophobicContact CB-CD1 4.11Å; H559-L562 WeakPolarHBondContact O-CB 3.45Å; H559-L562 VanDerWaalsContact O-CG 3.31Å; H559-L562 WeakPolarHBondContact O-CG 3.34Å; H559-L562 PolarHBondContact O-N 3.11Å; V560-L562 PolarHBondContact O-N 3.14Å; V560-L562 VanDerWaalsContact O-N 3.09Å; L562-R564 PolarHBondContact O-N 2.64Å; L562-K565 WeakPolarHBondContact O-CB 3.35Å; L562-K565 PolarHBondContact O-N 3.11Å; L562-Y566 HydrophobicContact CB-CD2 4.03Å; L562-Y566 HydrophobicContact CB-CE2 3.75Å; L562-Y566 HydrophobicContact CD1-CE2 4.5Å; L562-Y566 VanDerWaalsContact O-CD2 3.23Å; L562-Y566 WeakPolarHBondContact O-CD2 3.44Å; L562-Y566 PolarHBondContact O-N 2.98Å; L562-Y566 VanDerWaalsContact O-N 3.14Å
563	Y	91.5	Very high	84.1	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-53.7	-38.3	175.5	-83.1	-66.3	0	0	0	112	C511 C515 A518 I521 V522 I549 V560 S561 K565 Y566 I567	C511-Y563 PolarHBondContact O-OH 3.05Å; C515-Y563 HydrophobicContact CB-CE2 3.8Å; A518-Y563 HydrophobicContact CB-CD1 3.87Å; A518-Y563 HydrophobicContact CB-CD2 4.17Å; A518-Y563 HydrophobicContact CB-CE1 3.66Å; A518-Y563 HydrophobicContact CB-CE2 3.99Å; A518-Y563 HydrophobicContact CB-CG 4.11Å; I521-Y563 HydrophobicContact CB-CE1 4.3Å; I521-Y563 WeakPolarHBondContact CD1-OH 3.34Å; I521-Y563 HydrophobicContact CG2-CE1 4.03Å; V522-Y563 HydrophobicContact CG2-CD1 3.65Å; V522-Y563 HydrophobicContact CG2-CE1 3.95Å; I549-Y563 HydrophobicContact CG2-CD1 3.69Å; I549-Y563 HydrophobicContact CG2-CD2 3.78Å; I549-Y563 HydrophobicContact CG2-CE1 4.21Å; I549-Y563 HydrophobicContact CG2-CE2 4.28Å; I549-Y563 HydrophobicContact CG2-CG 3.45Å; I549-Y563 VanDerWaalsContact CG2-CG 3.45Å; V560-Y563 HydrophobicContact CG1-CD2 4.07Å; V560-Y563 WeakPolarHBondContact O-CB 3.18Å; V560-Y563 WeakPolarHBondContact O-CD2 3.25Å; V560-Y563 PolarHBondContact O-N 3.39Å; V560-Y563 VanDerWaalsContact O-N 3.12Å; S561-Y563 VanDerWaalsContact C-N 3.29Å; S561-Y563 PolarHBondContact O-N 3.43Å; Y563-K565 VanDerWaalsContact C-N 3.28Å; Y563-K565 PolarHBondContact O-N 3.31Å; Y563-Y566 PolarHBondContact O-N 3.3Å; Y563-I567 HydrophobicContact CD1-CD1 4.33Å; Y563-I567 VanDerWaalsContact O-CB 3.24Å; Y563-I567 WeakPolarHBondContact O-CB 3.3Å; Y563-I567 WeakPolarHBondContact O-CG1 3.29Å; Y563-I567 PolarHBondContact O-N 2.95Å
564	R	91.1	Very high	84.8	Confident	110 Å²	110	66.1 Å²	66.1	42%	0.415	34%	0.337	S	S	.	.	H	α-helix	trans	-55.9	-43	177.4	-172.3	178.5	179.4	178.7	2	112.5	L550 S561 L562 G568 A609 V610 Y611	L550-R564 HydrophobicContact CD2-CB 4.42Å; S561-R564 PolarHBondContact O-N 2.84Å; L562-R564 PolarHBondContact O-N 2.64Å; R564-G568 PolarHBondContact O-N 3.42Å; R564-A609 PolarHBondContact NH2-O 3.37Å; R564-V610 HydrophobicContact CG-CG1 4.28Å; R564-V610 PolarHBondContact NE-O 2.85Å; R564-V610 VanDerWaalsContact NH2-C 3.34Å; R564-V610 PolarHBondContact NH2-O 3.07Å; R564-Y611 HydrophobicContact CG-CE1 4.2Å; R564-Y611 PolarHBondContact O-OH 3.47Å
565	K	88	Confident	85.8	Confident	104 Å²	104	60.9 Å²	60.9	45%	0.452	31%	0.305	S	S	.	.	H	α-helix	trans	-68.6	-52.7	178.5	177.4	-179.6	175.6	179.7	0	110.7	L562 Y563 G568 N569	L562-K565 WeakPolarHBondContact O-CB 3.35Å; L562-K565 PolarHBondContact O-N 3.11Å; Y563-K565 VanDerWaalsContact C-N 3.28Å; Y563-K565 PolarHBondContact O-N 3.31Å; K565-G568 PolarHBondContact O-N 3.34Å; K565-N569 PolarHBondContact O-N 2.92Å; K565-N569 VanDerWaalsContact O-N 3.11Å; K565-N569 PolarHBondContact O-OD1 3.26Å
566	Y	90.7	Very high	86.9	Confident	40 Å²	40	64 Å²	64	16%	0.157	31%	0.306	C	S	.	.	H	α-helix	trans	-68.6	-41	-173.3	-63.9	-56.5	0	0	0	112.9	A518 E519 L562 Y563 G568 N569 R570	A518-Y566 HydrophobicContact CB-CD2 4.1Å; A518-Y566 HydrophobicContact CB-CE2 4.39Å; E519-Y566 HydrophobicContact CB-CD1 4Å; E519-Y566 HydrophobicContact CB-CD2 4.07Å; E519-Y566 HydrophobicContact CB-CE1 3.76Å; E519-Y566 HydrophobicContact CB-CE2 3.84Å; E519-Y566 HydrophobicContact CB-CG 4.14Å; E519-Y566 HydrophobicContact CG-CD1 3.79Å; E519-Y566 HydrophobicContact CG-CE1 3.6Å; E519-Y566 HydrophobicContact CG-CG 4.36Å; E519-Y566 VanDerWaalsContact OE2-CE1 3.28Å; E519-Y566 WeakPolarHBondContact OE2-CE1 3.31Å; E519-Y566 PolarHBondContact OE2-OH 3.26Å; L562-Y566 HydrophobicContact CB-CD2 4.03Å; L562-Y566 HydrophobicContact CB-CE2 3.75Å; L562-Y566 HydrophobicContact CD1-CE2 4.5Å; L562-Y566 VanDerWaalsContact O-CD2 3.23Å; L562-Y566 WeakPolarHBondContact O-CD2 3.44Å; L562-Y566 PolarHBondContact O-N 2.98Å; L562-Y566 VanDerWaalsContact O-N 3.14Å; Y563-Y566 PolarHBondContact O-N 3.3Å; Y566-G568 VanDerWaalsContact C-N 3.31Å; Y566-G568 PolarHBondContact O-N 3.14Å; Y566-N569 PolarHBondContact O-N 3.4Å; Y566-R570 PolarHBondContact O-N 2.89Å
567	I	95.1	Very high	88	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.3	-45.4	173.8	-65.1	173.4	0	0	0	109.3	V522 L546 I549 L550 Y563 N569 R570 L571	V522-I567 HydrophobicContact CG1-CG1 4.15Å; V522-I567 HydrophobicContact CG2-CD1 4.41Å; V522-I567 HydrophobicContact CG2-CG1 3.56Å; L546-I567 HydrophobicContact CD2-CD1 3.96Å; L546-I567 HydrophobicContact CD2-CG1 4.03Å; I549-I567 HydrophobicContact CB-CD1 4.31Å; I549-I567 HydrophobicContact CG2-CD1 3.88Å; L550-I567 HydrophobicContact CD1-CG2 3.92Å; L550-I567 HydrophobicContact CD2-CB 4.19Å; L550-I567 HydrophobicContact CD2-CD1 3.81Å; L550-I567 HydrophobicContact CD2-CG2 4.29Å; L550-I567 HydrophobicContact CG-CD1 3.79Å; L550-I567 HydrophobicContact CG-CG2 4.27Å; Y563-I567 HydrophobicContact CD1-CD1 4.33Å; Y563-I567 VanDerWaalsContact O-CB 3.24Å; Y563-I567 WeakPolarHBondContact O-CB 3.3Å; Y563-I567 WeakPolarHBondContact O-CG1 3.29Å; Y563-I567 PolarHBondContact O-N 2.95Å; I567-N569 VanDerWaalsContact C-N 3.27Å; I567-N569 PolarHBondContact O-N 3.33Å; I567-R570 CarbonylContact O-C 3.59Å; I567-R570 PolarHBondContact O-N 3.18Å; I567-L571 HydrophobicContact CG2-CD1 4.19Å; I567-L571 HydrophobicContact CG2-CD2 4.13Å; I567-L571 HydrophobicContact CG2-CG 3.94Å; I567-L571 WeakPolarHBondContact O-CG 3.45Å; I567-L571 PolarHBondContact O-N 2.74Å
568	G	93.2	Very high	89.3	Confident	9 Å²	9	50.8 Å²	50.8	9%	0.093	25%	0.245	C	C	.	.	H	α-helix	trans	-52.7	-45	177.6	0	0	0	0	0	112.8	R564 K565 Y566 R570 L571 Y611	R564-G568 PolarHBondContact O-N 3.42Å; K565-G568 PolarHBondContact O-N 3.34Å; Y566-G568 VanDerWaalsContact C-N 3.31Å; Y566-G568 PolarHBondContact O-N 3.14Å; G568-R570 PolarHBondContact O-N 3.44Å; G568-L571 PolarHBondContact O-N 3.03Å; G568-Y611 WeakPolarHBondContact CA-OH 3.33Å; G568-Y611 PolarHBondContact N-OH 2.93Å; G568-Y611 VanDerWaalsContact N-OH 3.1Å
569	N	91.3	Very high	90.5	Very high	84 Å²	84	44.8 Å²	44.8	45%	0.449	21%	0.214	S	C	.	.	H	α-helix	trans	-64.8	-23.6	178.9	-67.1	-8.5	0	0	0	114.1	K565 Y566 I567	K565-N569 PolarHBondContact O-N 2.92Å; K565-N569 VanDerWaalsContact O-N 3.11Å; K565-N569 PolarHBondContact O-OD1 3.26Å; Y566-N569 PolarHBondContact O-N 3.4Å; I567-N569 VanDerWaalsContact C-N 3.27Å; I567-N569 PolarHBondContact O-N 3.33Å
570	R	94.3	Very high	91.6	Very high	71 Å²	71	45 Å²	45	27%	0.268	22%	0.222	S	C	.	.	H	α-helix	trans	-106.1	-8.1	-178.2	-66.8	-51.2	-147.3	-65.2	-0.7	114.2	V522 D523 A526 Y566 I567 G568 E572 D573 I574	V522-R570 HydrophobicContact CG1-CB 4.28Å; V522-R570 HydrophobicContact CG1-CG 4.08Å; D523-R570 VanDerWaalsContact CG-CZ 3.46Å; D523-R570 IonicContact OD1-CZ 3.97Å; D523-R570 IonicContact OD1-NE 3.69Å; D523-R570 IonicContact OD1-NH1 3.75Å; D523-R570 PolarHBondContact OD1-NH1 2.82Å; D523-R570 IonicContact OD1-NH2 3.08Å; D523-R570 PolarHBondContact OD1-NH2 3.14Å; D523-R570 IonicContact OD2-CZ 2.64Å; D523-R570 IonicContact OD2-NH1 3.9Å; D523-R570 IonicContact OD2-NH2 2.84Å; D523-R570 PolarHBondContact OD2-NH2 2.71Å; A526-R570 HydrophobicContact CB-CB 3.83Å; A526-R570 HydrophobicContact CB-CG 3.95Å; Y566-R570 PolarHBondContact O-N 2.89Å; I567-R570 CarbonylContact O-C 3.59Å; I567-R570 PolarHBondContact O-N 3.18Å; G568-R570 PolarHBondContact O-N 3.44Å; R570-E572 VanDerWaalsContact C-N 3.3Å; R570-E572 PolarHBondContact O-N 3Å; R570-D573 PolarHBondContact O-N 2.68Å; R570-I574 HydrophobicContact CB-CD1 4.23Å; R570-I574 VanDerWaalsContact O-CG1 3.3Å; R570-I574 WeakPolarHBondContact O-CG1 3.38Å; R570-I574 PolarHBondContact O-N 2.81Å
571	L	96.4	Very high	91.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60.9	-36.6	-177.1	-83.6	172.7	0	0	0	112.9	I567 G568 D573 I574 F575 W605 Y611 F615 L619	I567-L571 HydrophobicContact CG2-CD1 4.19Å; I567-L571 HydrophobicContact CG2-CD2 4.13Å; I567-L571 HydrophobicContact CG2-CG 3.94Å; I567-L571 WeakPolarHBondContact O-CG 3.45Å; I567-L571 PolarHBondContact O-N 2.74Å; G568-L571 PolarHBondContact O-N 3.03Å; L571-D573 PolarHBondContact O-N 2.97Å; L571-I574 PolarHBondContact O-N 2.91Å; L571-F575 HydrophobicContact CD2-CD2 4.25Å; L571-F575 HydrophobicContact CD2-CE2 3.85Å; L571-F575 WeakPolarHBondContact O-CB 3.44Å; L571-F575 WeakPolarHBondContact O-CD2 3.19Å; L571-F575 PolarHBondContact O-N 3.42Å; L571-W605 HydrophobicContact CD1-CZ3 4.09Å; L571-W605 HydrophobicContact CD2-CH2 3.62Å; L571-W605 HydrophobicContact CD2-CZ3 3.81Å; L571-Y611 HydrophobicContact CD1-CD2 4.08Å; L571-Y611 HydrophobicContact CD1-CE2 3.44Å; L571-Y611 VanDerWaalsContact CD1-CE2 3.44Å; L571-F615 HydrophobicContact CB-CZ 4.3Å; L571-F615 HydrophobicContact CD1-CE1 3.98Å; L571-F615 HydrophobicContact CD1-CZ 4.46Å; L571-L619 HydrophobicContact CB-CD1 3.95Å; L571-L619 HydrophobicContact CB-CD2 3.9Å; L571-L619 HydrophobicContact CD1-CD1 3.91Å; L571-L619 HydrophobicContact CG-CD1 4.4Å
572	E	93.5	Very high	92.2	Very high	58 Å²	58	44.1 Å²	44.1	27%	0.271	21%	0.209	S	C	.	.	H	α-helix	trans	-62.1	-44.7	178.2	-65.3	-174	-160.8	0	0	111.8	R570 F575 R576 F615 K618 L619 I622	R570-E572 VanDerWaalsContact C-N 3.3Å; R570-E572 PolarHBondContact O-N 3Å; E572-F575 PolarHBondContact O-N 2.83Å; E572-R576 WeakPolarHBondContact O-CB 3.47Å; E572-R576 PolarHBondContact O-N 2.88Å; E572-F615 HydrophobicContact CG-CE2 4.48Å; E572-K618 WeakPolarHBondContact OE1-CE 3.45Å; E572-K618 IonicContact OE1-NZ 2.93Å; E572-K618 PolarHBondContact OE1-NZ 3.45Å; E572-K618 WeakPolarHBondContact OE2-CE 3.46Å; E572-K618 IonicContact OE2-NZ 3.24Å; E572-K618 PolarHBondContact OE2-NZ 2.91Å; E572-L619 HydrophobicContact CG-CD2 3.96Å; E572-I622 HydrophobicContact CB-CD1 4.12Å; E572-I622 HydrophobicContact CG-CD1 3.96Å
573	D	90.9	Very high	92.5	Very high	84 Å²	84	47.8 Å²	47.8	45%	0.449	22%	0.223	S	C	.	.	H	α-helix	trans	-67.1	-40.8	177.7	-65.7	-35.2	0	0	0	111.9	R570 L571 F575 R576 S577	R570-D573 PolarHBondContact O-N 2.68Å; L571-D573 PolarHBondContact O-N 2.97Å; D573-F575 PolarHBondContact O-N 3.41Å; D573-R576 PolarHBondContact O-N 3.21Å; D573-R576 IonicContact OD1-NH1 2.73Å; D573-R576 PolarHBondContact OD1-NH1 3.29Å; D573-R576 VanDerWaalsContact OD1-NH1 3.08Å; D573-S577 PolarHBondContact O-N 3.49Å
574	I	95.8	Very high	92.4	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-60.8	-46.3	175.6	-69	164.9	0	0	0	110.3	A526 F529 L546 R570 L571 R576 S577 L578	A526-I574 HydrophobicContact CB-CD1 4.14Å; A526-I574 HydrophobicContact CB-CG1 4.22Å; F529-I574 HydrophobicContact CD1-CG2 3.88Å; F529-I574 HydrophobicContact CD2-CD1 4.44Å; F529-I574 HydrophobicContact CD2-CG1 3.95Å; F529-I574 HydrophobicContact CD2-CG2 4.15Å; F529-I574 HydrophobicContact CE1-CG2 3.69Å; F529-I574 HydrophobicContact CE2-CD1 4.28Å; F529-I574 HydrophobicContact CE2-CG1 4.19Å; F529-I574 HydrophobicContact CE2-CG2 3.98Å; F529-I574 HydrophobicContact CG-CG1 4.34Å; F529-I574 HydrophobicContact CG-CG2 4.1Å; F529-I574 HydrophobicContact CZ-CG2 3.74Å; L546-I574 HydrophobicContact CD1-CD1 3.55Å; R570-I574 HydrophobicContact CB-CD1 4.23Å; R570-I574 VanDerWaalsContact O-CG1 3.3Å; R570-I574 WeakPolarHBondContact O-CG1 3.38Å; R570-I574 PolarHBondContact O-N 2.81Å; L571-I574 PolarHBondContact O-N 2.91Å; I574-R576 VanDerWaalsContact C-N 3.32Å; I574-R576 PolarHBondContact O-N 3.35Å; I574-S577 PolarHBondContact O-N 3.15Å; I574-L578 HydrophobicContact CG2-CD1 4.15Å; I574-L578 WeakPolarHBondContact O-CG 3.39Å; I574-L578 PolarHBondContact O-N 3.28Å
575	F	96.1	Very high	92.3	Very high	1 Å²	1	48.4 Å²	48.4	0%	0.004	24%	0.241	C	C	.	.	H	α-helix	trans	-68.3	-32.1	179.9	-86.1	-121	0	0	0	112	L543 L571 E572 D573 L578 N579 V598 V602 W605 L619 I622 F623	L543-F575 HydrophobicContact CD1-CE2 4.25Å; L571-F575 HydrophobicContact CD2-CD2 4.25Å; L571-F575 HydrophobicContact CD2-CE2 3.85Å; L571-F575 WeakPolarHBondContact O-CB 3.44Å; L571-F575 WeakPolarHBondContact O-CD2 3.19Å; L571-F575 PolarHBondContact O-N 3.42Å; E572-F575 PolarHBondContact O-N 2.83Å; D573-F575 PolarHBondContact O-N 3.41Å; F575-L578 HydrophobicContact CD2-CD1 4.45Å; F575-L578 PolarHBondContact O-N 3.12Å; F575-N579 PolarHBondContact O-N 3.44Å; F575-V598 HydrophobicContact CE1-CG1 4.07Å; F575-V598 HydrophobicContact CZ-CG1 4.32Å; F575-V602 HydrophobicContact CE1-CG2 3.83Å; F575-V602 HydrophobicContact CZ-CG2 3.8Å; F575-W605 HydrophobicContact CE2-CH2 4.17Å; F575-W605 HydrophobicContact CE2-CZ3 4.01Å; F575-W605 HydrophobicContact CZ-CH2 4.35Å; F575-W605 AromaticContact CZ-CZ3 3.92Å; F575-W605 HydrophobicContact CZ-CZ3 3.92Å; F575-L619 HydrophobicContact CB-CD2 4.43Å; F575-L619 HydrophobicContact CD1-CB 3.73Å; F575-L619 HydrophobicContact CD1-CD2 4.49Å; F575-L619 VanDerWaalsContact CD1-O 3.29Å; F575-L619 WeakPolarHBondContact CD1-O 3.37Å; F575-L619 HydrophobicContact CD2-CD2 4.35Å; F575-L619 HydrophobicContact CE1-CB 3.79Å; F575-L619 HydrophobicContact CE2-CD1 4.38Å; F575-L619 HydrophobicContact CG-CB 4.27Å; F575-L619 HydrophobicContact CG-CD2 4.17Å; F575-L619 HydrophobicContact CZ-CB 4.33Å; F575-L619 HydrophobicContact CZ-CD1 4.37Å; F575-I622 HydrophobicContact CB-CB 4.46Å; F575-I622 HydrophobicContact CB-CG2 3.94Å; F575-F623 HydrophobicContact CD1-CB 3.66Å; F575-F623 HydrophobicContact CE1-CB 4.28Å
576	R	93.1	Very high	92.5	Very high	111 Å²	111	50.3 Å²	50.3	42%	0.419	26%	0.261	S	S	.	.	H	α-helix	trans	-63.5	-44.3	170.8	-166.4	-175.3	-78.1	130.7	-12.6	111.2	E572 D573 I574 N579 V580 I622 E629	E572-R576 WeakPolarHBondContact O-CB 3.47Å; E572-R576 PolarHBondContact O-N 2.88Å; D573-R576 PolarHBondContact O-N 3.21Å; D573-R576 IonicContact OD1-NH1 2.73Å; D573-R576 PolarHBondContact OD1-NH1 3.29Å; D573-R576 VanDerWaalsContact OD1-NH1 3.08Å; I574-R576 VanDerWaalsContact C-N 3.32Å; I574-R576 PolarHBondContact O-N 3.35Å; R576-N579 WeakPolarHBondContact O-CB 3.19Å; R576-N579 PolarHBondContact O-N 2.98Å; R576-V580 PolarHBondContact O-N 3.36Å; R576-I622 HydrophobicContact CB-CG2 4.3Å; R576-E629 IonicContact CZ-OE1 2.8Å; R576-E629 IonicContact NE-OE1 2.69Å; R576-E629 IonicContact NH2-OE1 3.48Å; R576-E629 PolarHBondContact NH2-OE1 3.49Å
577	S	91.8	Very high	92.6	Very high	16 Å²	16	50.8 Å²	50.8	11%	0.112	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-39.3	174.6	179.3	0	0	0	0	112.7	F529 K539 D573 I574 N579 V580 A581	F529-S577 PolarHBondContact O-OG 3.47Å; K539-S577 PolarHBondContact NZ-OG 3.06Å; D573-S577 PolarHBondContact O-N 3.49Å; I574-S577 PolarHBondContact O-N 3.15Å; S577-N579 VanDerWaalsContact C-N 3.34Å; S577-N579 PolarHBondContact O-N 3.15Å; S577-V580 PolarHBondContact O-N 3.25Å; S577-A581 PolarHBondContact O-N 2.9Å; S577-A581 VanDerWaalsContact O-N 3.12Å
578	L	94	Very high	92.5	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-64	-37.1	173.9	-70.8	172.8	0	0	0	112.1	F529 K539 I540 L543 I574 F575 A581 Y582 F623	F529-L578 HydrophobicContact CD1-CD2 4.36Å; F529-L578 HydrophobicContact CD1-CG 4.48Å; F529-L578 HydrophobicContact CE1-CD2 4.19Å; F529-L578 HydrophobicContact CE1-CG 4.41Å; K539-L578 HydrophobicContact CB-CD2 3.94Å; I540-L578 HydrophobicContact CD1-CD2 4.22Å; L543-L578 HydrophobicContact CD1-CD1 4.45Å; L543-L578 HydrophobicContact CD2-CD1 4.02Å; I574-L578 HydrophobicContact CG2-CD1 4.15Å; I574-L578 WeakPolarHBondContact O-CG 3.39Å; I574-L578 PolarHBondContact O-N 3.28Å; F575-L578 HydrophobicContact CD2-CD1 4.45Å; F575-L578 PolarHBondContact O-N 3.12Å; L578-A581 PolarHBondContact O-N 3.16Å; L578-Y582 WeakPolarHBondContact O-CB 3.3Å; L578-Y582 PolarHBondContact O-N 3.33Å; L578-F623 HydrophobicContact CB-CD2 3.86Å; L578-F623 HydrophobicContact CB-CE2 4.03Å
579	N	92.9	Very high	92.4	Very high	16 Å²	16	66.8 Å²	66.8	9%	0.086	34%	0.341	C	S	.	.	H	α-helix	trans	-60.9	-45.8	174.5	179.7	-103.3	0	0	0	111.7	F575 R576 S577 A581 Y582 K583 F623 G625	F575-N579 PolarHBondContact O-N 3.44Å; R576-N579 WeakPolarHBondContact O-CB 3.19Å; R576-N579 PolarHBondContact O-N 2.98Å; S577-N579 VanDerWaalsContact C-N 3.34Å; S577-N579 PolarHBondContact O-N 3.15Å; N579-A581 VanDerWaalsContact C-N 3.33Å; N579-A581 PolarHBondContact O-N 3.1Å; N579-Y582 PolarHBondContact O-N 2.93Å; N579-K583 WeakPolarHBondContact O-CG 3.43Å; N579-K583 PolarHBondContact O-N 2.84Å; N579-K583 WeakPolarHBondContact OD1-CD 3.47Å; N579-K583 WeakPolarHBondContact OD1-CE 3.26Å; N579-K583 PolarHBondContact OD1-NZ 3.45Å; N579-F623 PolarHBondContact ND2-O 2.79Å; N579-G625 PolarHBondContact ND2-N 3.07Å
580	V	91	Very high	92.4	Very high	100 Å²	100	69.3 Å²	69.3	61%	0.606	34%	0.344	S	S	*	.	H	α-helix	trans	-59.1	-46.7	177.8	175	0	0	0	0	110.5	R576 S577 Y582 K583 S584	R576-V580 PolarHBondContact O-N 3.36Å; S577-V580 PolarHBondContact O-N 3.25Å; V580-Y582 VanDerWaalsContact C-N 3.34Å; V580-Y582 PolarHBondContact O-N 3.42Å; V580-K583 PolarHBondContact O-N 3.45Å; V580-S584 PolarHBondContact O-N 3.47Å
581	A	89.6	Confident	92.3	Very high	11 Å²	11	66.5 Å²	66.5	9%	0.091	34%	0.336	C	S	.	.	H	α-helix	trans	-72.1	-25.6	179	0	0	0	0	0	113.5	L536 K539 S577 L578 N579 S584	L536-A581 HydrophobicContact CD1-CB 3.67Å; K539-A581 HydrophobicContact CD-CB 4.16Å; S577-A581 PolarHBondContact O-N 2.9Å; S577-A581 VanDerWaalsContact O-N 3.12Å; L578-A581 PolarHBondContact O-N 3.16Å; N579-A581 VanDerWaalsContact C-N 3.33Å; N579-A581 PolarHBondContact O-N 3.1Å; A581-S584 PolarHBondContact O-OG 3.42Å
582	Y	91.7	Very high	92.2	Very high	45 Å²	45	69.5 Å²	69.5	18%	0.176	35%	0.352	C	S	.	.	H	α-helix	trans	-73.1	-41.3	174	174	-104.7	0	0	0	111.7	L578 N579 V580 S584 I585 A591 K595 F623	L578-Y582 WeakPolarHBondContact O-CB 3.3Å; L578-Y582 PolarHBondContact O-N 3.33Å; N579-Y582 PolarHBondContact O-N 2.93Å; V580-Y582 VanDerWaalsContact C-N 3.34Å; V580-Y582 PolarHBondContact O-N 3.42Å; Y582-S584 VanDerWaalsContact C-N 3.27Å; Y582-S584 PolarHBondContact O-N 3.33Å; Y582-I585 HydrophobicContact CD2-CD1 3.99Å; Y582-I585 WeakPolarHBondContact O-CB 3.31Å; Y582-I585 WeakPolarHBondContact O-CG1 3.29Å; Y582-I585 PolarHBondContact O-N 2.89Å; Y582-A591 HydrophobicContact CE2-CB 3.91Å; Y582-A591 WeakPolarHBondContact CE2-O 3.46Å; Y582-K595 HydrophobicContact CE2-CB 3.92Å; Y582-F623 HydrophobicContact CD2-CE2 4.44Å; Y582-F623 AromaticContact CD2-CZ 3.92Å; Y582-F623 HydrophobicContact CD2-CZ 3.92Å; Y582-F623 HydrophobicContact CE2-CZ 4.44Å; Y582-F623 HydrophobicContact CG-CE2 4.14Å; Y582-F623 AromaticContact CG-CZ 3.99Å; Y582-F623 HydrophobicContact CG-CZ 3.99Å
583	K	90.3	Very high	92.3	Very high	141 Å²	141	72.1 Å²	72.1	61%	0.613	37%	0.365	S	S	*	.	H	α-helix	trans	-65.8	-25.9	177.8	-77.1	177.1	173.6	163	0	113.6	N579 V580 I585	N579-K583 WeakPolarHBondContact O-CG 3.43Å; N579-K583 PolarHBondContact O-N 2.84Å; N579-K583 WeakPolarHBondContact OD1-CD 3.47Å; N579-K583 WeakPolarHBondContact OD1-CE 3.26Å; N579-K583 PolarHBondContact OD1-NZ 3.45Å; V580-K583 PolarHBondContact O-N 3.45Å; K583-I585 PolarHBondContact O-N 3.25Å
584	S	89.6	Confident	92.4	Very high	90 Å²	90	68.3 Å²	68.3	63%	0.629	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-6.5	177.1	67.2	0	0	0	0	113.8	V580 A581 Y582 T586	V580-S584 PolarHBondContact O-N 3.47Å; A581-S584 PolarHBondContact O-OG 3.42Å; Y582-S584 VanDerWaalsContact C-N 3.27Å; Y582-S584 PolarHBondContact O-N 3.33Å; S584-T586 PolarHBondContact O-N 3.49Å
585	I	89.8	Confident	92.4	Very high	32 Å²	32	71.5 Å²	71.5	16%	0.164	36%	0.358	C	S	.	.			trans	-77.5	114.2	178.2	-52.3	168.9	0	0	0	109.9	L536 Y582 K583 A587 R590 A591 I594	L536-I585 HydrophobicContact CD2-CD1 3.36Å; L536-I585 HydrophobicContact CD2-CG1 3.73Å; Y582-I585 HydrophobicContact CD2-CD1 3.99Å; Y582-I585 WeakPolarHBondContact O-CB 3.31Å; Y582-I585 WeakPolarHBondContact O-CG1 3.29Å; Y582-I585 PolarHBondContact O-N 2.89Å; K583-I585 PolarHBondContact O-N 3.25Å; I585-A587 WeakPolarHBondContact CG2-O 3.36Å; I585-R590 HydrophobicContact CG2-CB 4.13Å; I585-R590 HydrophobicContact CG2-CG 4.36Å; I585-A591 HydrophobicContact CB-CB 4.17Å; I585-A591 HydrophobicContact CD1-CB 4.23Å; I585-A591 HydrophobicContact CG2-CB 3.89Å; I585-I594 HydrophobicContact CD1-CB 4.27Å; I585-I594 HydrophobicContact CD1-CG1 4.23Å; I585-I594 HydrophobicContact CD1-CG2 4.5Å
586	T	92.4	Very high	92.4	Very high	144 Å²	144	78 Å²	78	88%	0.883	39%	0.389	S	S	*	.			trans	-78.9	-36.3	175.6	54.7	0	0	0	0	112.8	S584 R588	S584-T586 PolarHBondContact O-N 3.49Å; T586-R588 PolarHBondContact O-N 2.81Å
587	A	92.3	Very high	92.5	Very high	50 Å²	50	76.9 Å²	76.9	41%	0.413	38%	0.384	S	S	.	.			trans	-79.1	109.7	-176.8	0	0	0	0	0	111.9	I585 L589 R590 A591	I585-A587 WeakPolarHBondContact CG2-O 3.36Å; A587-L589 PolarHBondContact O-N 3.39Å; A587-R590 HydrophobicContact CB-CB 4.01Å; A587-R590 WeakPolarHBondContact O-CB 2.87Å; A587-R590 PolarHBondContact O-N 2.91Å; A587-A591 PolarHBondContact O-N 2.68Å
588	R	91.9	Very high	92.8	Very high	203 Å²	203	76.1 Å²	76.1	77%	0.766	38%	0.379	S	S	*	.	H	α-helix	trans	-52	-49.1	-177.4	-176	176.9	179.5	149.9	-0.4	114.1	T586 R590 A591 D592	T586-R588 PolarHBondContact O-N 2.81Å; R588-R590 VanDerWaalsContact C-N 3.26Å; R588-R590 PolarHBondContact O-N 3.39Å; R588-A591 WeakPolarHBondContact O-CB 3.37Å; R588-A591 PolarHBondContact O-N 3.12Å; R588-A591 VanDerWaalsContact O-N 3.13Å; R588-D592 PolarHBondContact O-N 2.91Å
589	L	92.7	Very high	92.9	Very high	143 Å²	143	78.2 Å²	78.2	75%	0.749	39%	0.389	S	S	*	.	H	α-helix	trans	-60.5	-38.2	-179.7	-67.9	168.6	0	0	0	111.9	A587 Q593	A587-L589 PolarHBondContact O-N 3.39Å; L589-Q593 VanDerWaalsContact O-CG 3.29Å; L589-Q593 WeakPolarHBondContact O-CG 3.44Å; L589-Q593 PolarHBondContact O-N 2.73Å; L589-Q593 VanDerWaalsContact O-N 3.1Å
590	R	91	Very high	93	Very high	136 Å²	136	81 Å²	81	51%	0.513	41%	0.41	S	S	.	.	H	α-helix	trans	-70.3	-38.5	177.3	-169.2	176.7	-176.8	168.2	1.2	111.2	I585 A587 R588 Q593 I594	I585-R590 HydrophobicContact CG2-CB 4.13Å; I585-R590 HydrophobicContact CG2-CG 4.36Å; A587-R590 HydrophobicContact CB-CB 4.01Å; A587-R590 WeakPolarHBondContact O-CB 2.87Å; A587-R590 PolarHBondContact O-N 2.91Å; R588-R590 VanDerWaalsContact C-N 3.26Å; R588-R590 PolarHBondContact O-N 3.39Å; R590-Q593 PolarHBondContact O-N 3.35Å; R590-I594 VanDerWaalsContact O-CG1 3.31Å; R590-I594 WeakPolarHBondContact O-CG1 3.48Å; R590-I594 PolarHBondContact O-N 2.84Å; R590-I594 VanDerWaalsContact O-N 3.07Å
591	A	92.3	Very high	93.3	Very high	12 Å²	12	76.6 Å²	76.6	10%	0.099	38%	0.383	C	S	.	.	H	α-helix	trans	-61.5	-49.2	174.9	0	0	0	0	0	110.8	Y582 I585 A587 R588 Q593 I594 K595	Y582-A591 HydrophobicContact CE2-CB 3.91Å; Y582-A591 WeakPolarHBondContact CE2-O 3.46Å; I585-A591 HydrophobicContact CB-CB 4.17Å; I585-A591 HydrophobicContact CD1-CB 4.23Å; I585-A591 HydrophobicContact CG2-CB 3.89Å; A587-A591 PolarHBondContact O-N 2.68Å; R588-A591 WeakPolarHBondContact O-CB 3.37Å; R588-A591 PolarHBondContact O-N 3.12Å; R588-A591 VanDerWaalsContact O-N 3.13Å; A591-Q593 VanDerWaalsContact C-N 3.33Å; A591-Q593 PolarHBondContact O-N 2.9Å; A591-I594 PolarHBondContact O-N 3.13Å; A591-I594 VanDerWaalsContact O-N 3.15Å; A591-K595 WeakPolarHBondContact O-CB 3.36Å; A591-K595 PolarHBondContact O-N 3.34Å
592	D	94.8	Very high	93.6	Very high	64 Å²	64	76 Å²	76	34%	0.342	38%	0.379	S	S	.	.	H	α-helix	trans	-60.7	-39.8	178.9	-77	-34.3	0	0	0	112.4	R588 K595 Q596	R588-D592 PolarHBondContact O-N 2.91Å; D592-K595 PolarHBondContact O-N 3.43Å; D592-Q596 WeakPolarHBondContact O-CG 3.2Å; D592-Q596 PolarHBondContact O-N 3.43Å
593	Q	93.9	Very high	93.8	Very high	112 Å²	112	79.7 Å²	79.7	52%	0.523	40%	0.396	S	S	.	.	H	α-helix	trans	-62.5	-43.1	174.3	-74.7	173.1	-5	0	0	112.9	L589 R590 A591 Q596 R597	L589-Q593 VanDerWaalsContact O-CG 3.29Å; L589-Q593 WeakPolarHBondContact O-CG 3.44Å; L589-Q593 PolarHBondContact O-N 2.73Å; L589-Q593 VanDerWaalsContact O-N 3.1Å; R590-Q593 PolarHBondContact O-N 3.35Å; A591-Q593 VanDerWaalsContact C-N 3.33Å; A591-Q593 PolarHBondContact O-N 2.9Å; Q593-Q596 PolarHBondContact O-N 2.95Å; Q593-R597 WeakPolarHBondContact O-CG 3.43Å; Q593-R597 PolarHBondContact O-N 3.48Å; Q593-R597 VanDerWaalsContact O-N 3.14Å
594	I	93.7	Very high	93.9	Very high	5 Å²	5	77.1 Å²	77.1	3%	0.026	39%	0.387	C	S	.	.	H	α-helix	trans	-67.7	-43.1	178.1	-67.1	-68.3	0	0	0	110.6	L536 L537 I540 I585 R590 A591 Q596 R597 V598	L536-I594 HydrophobicContact CD1-CG2 4.33Å; L536-I594 HydrophobicContact CD2-CD1 4.19Å; L536-I594 HydrophobicContact CD2-CG1 3.93Å; L536-I594 HydrophobicContact CD2-CG2 4.11Å; L536-I594 HydrophobicContact CG-CD1 4.36Å; L536-I594 HydrophobicContact CG-CG2 4.43Å; L537-I594 HydrophobicContact CD2-CD1 4.14Å; I540-I594 HydrophobicContact CD1-CG2 4.09Å; I540-I594 HydrophobicContact CG1-CD1 4.16Å; I540-I594 HydrophobicContact CG1-CG2 4.45Å; I585-I594 HydrophobicContact CD1-CB 4.27Å; I585-I594 HydrophobicContact CD1-CG1 4.23Å; I585-I594 HydrophobicContact CD1-CG2 4.5Å; R590-I594 VanDerWaalsContact O-CG1 3.31Å; R590-I594 WeakPolarHBondContact O-CG1 3.48Å; R590-I594 PolarHBondContact O-N 2.84Å; R590-I594 VanDerWaalsContact O-N 3.07Å; A591-I594 PolarHBondContact O-N 3.13Å; A591-I594 VanDerWaalsContact O-N 3.15Å; I594-Q596 VanDerWaalsContact C-N 3.32Å; I594-Q596 PolarHBondContact O-N 3.14Å; I594-R597 WeakPolarHBondContact O-CB 3.43Å; I594-R597 PolarHBondContact O-N 3.11Å; I594-R597 VanDerWaalsContact O-N 3.1Å; I594-V598 PolarHBondContact O-N 3.02Å
595	K	95.6	Very high	94.2	Very high	69 Å²	69	73 Å²	73	30%	0.3	36%	0.358	S	S	.	.	H	α-helix	trans	-54.9	-49.6	174.2	174.8	179.2	172	-174	0	110.5	Y582 A591 D592 R597 V598 M599 F623 L624	Y582-K595 HydrophobicContact CE2-CB 3.92Å; A591-K595 WeakPolarHBondContact O-CB 3.36Å; A591-K595 PolarHBondContact O-N 3.34Å; D592-K595 PolarHBondContact O-N 3.43Å; K595-R597 VanDerWaalsContact C-N 3.27Å; K595-R597 PolarHBondContact O-N 2.79Å; K595-V598 PolarHBondContact O-N 3.2Å; K595-M599 HydrophobicContact CG-CG 4.15Å; K595-M599 WeakPolarHBondContact O-CB 3.45Å; K595-M599 WeakPolarHBondContact O-CG 3.45Å; K595-M599 PolarHBondContact O-N 3.44Å; K595-F623 HydrophobicContact CB-CE1 4.33Å; K595-F623 HydrophobicContact CG-CE1 4.2Å; K595-L624 HydrophobicContact CD-CD2 4.15Å; K595-L624 HydrophobicContact CG-CD2 4.47Å
596	Q	96.1	Very high	94.4	Very high	138 Å²	138	75.8 Å²	75.8	65%	0.645	37%	0.37	S	S	*	.	H	α-helix	trans	-57	-39.7	176.9	-75.5	177.3	-8.8	0	0	112.7	D592 Q593 I594 S600	D592-Q596 WeakPolarHBondContact O-CG 3.2Å; D592-Q596 PolarHBondContact O-N 3.43Å; Q593-Q596 PolarHBondContact O-N 2.95Å; I594-Q596 VanDerWaalsContact C-N 3.32Å; I594-Q596 PolarHBondContact O-N 3.14Å; Q596-S600 VanDerWaalsContact O-CB 3.3Å; Q596-S600 WeakPolarHBondContact O-CB 3.43Å; Q596-S600 PolarHBondContact O-N 2.97Å
597	R	95.5	Very high	94.4	Very high	87 Å²	87	75.1 Å²	75.1	33%	0.328	36%	0.357	S	S	.	.	H	α-helix	trans	-65.4	-43.7	177.5	-71.3	178.8	-176.8	-169	-0.6	113	I540 Y544 Q593 I594 K595 S600 C601	I540-R597 HydrophobicContact CG2-CB 4.38Å; Y544-R597 WeakPolarHBondContact OH-CG 3.46Å; Q593-R597 WeakPolarHBondContact O-CG 3.43Å; Q593-R597 PolarHBondContact O-N 3.48Å; Q593-R597 VanDerWaalsContact O-N 3.14Å; I594-R597 WeakPolarHBondContact O-CB 3.43Å; I594-R597 PolarHBondContact O-N 3.11Å; I594-R597 VanDerWaalsContact O-N 3.1Å; K595-R597 VanDerWaalsContact C-N 3.27Å; K595-R597 PolarHBondContact O-N 2.79Å; R597-S600 PolarHBondContact O-N 3.44Å; R597-C601 PolarHBondContact O-N 2.65Å
598	V	97	Very high	94.2	Very high	0 Å²	0	75.6 Å²	75.6	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-65.6	-47.2	177.2	176.4	0	0	0	0	110.3	I540 L543 F575 I594 K595 S600 C601 V602 F623	I540-V598 HydrophobicContact CD1-CG2 3.55Å; L543-V598 HydrophobicContact CD2-CB 4.49Å; L543-V598 HydrophobicContact CD2-CG1 4.32Å; L543-V598 HydrophobicContact CD2-CG2 4.17Å; F575-V598 HydrophobicContact CE1-CG1 4.07Å; F575-V598 HydrophobicContact CZ-CG1 4.32Å; I594-V598 PolarHBondContact O-N 3.02Å; K595-V598 PolarHBondContact O-N 3.2Å; V598-S600 VanDerWaalsContact C-N 3.25Å; V598-S600 PolarHBondContact O-N 3.34Å; V598-C601 WeakPolarHBondContact O-CB 3.45Å; V598-C601 PolarHBondContact O-N 2.94Å; V598-C601 VanDerWaalsContact O-N 3.1Å; V598-V602 PolarHBondContact O-N 3.21Å; V598-F623 HydrophobicContact CB-CD1 4.42Å; V598-F623 HydrophobicContact CB-CE1 3.95Å; V598-F623 HydrophobicContact CB-CE2 4.33Å; V598-F623 HydrophobicContact CB-CZ 3.91Å; V598-F623 HydrophobicContact CG1-CD1 3.94Å; V598-F623 HydrophobicContact CG1-CD2 4.13Å; V598-F623 HydrophobicContact CG1-CE1 3.98Å; V598-F623 HydrophobicContact CG1-CE2 4.18Å; V598-F623 HydrophobicContact CG1-CG 4.02Å; V598-F623 HydrophobicContact CG1-CZ 4.11Å; V598-F623 HydrophobicContact CG2-CE1 4.37Å; V598-F623 HydrophobicContact CG2-CE2 3.96Å; V598-F623 HydrophobicContact CG2-CZ 3.8Å
599	M	96.3	Very high	94.2	Very high	45 Å²	45	69.1 Å²	69.1	22%	0.222	35%	0.347	C	S	.	.	H	α-helix	trans	-64.9	-29.9	179.1	-60.3	-59.6	-69.8	0	0	112.2	K595 C601 V602 K603 E620 F623	K595-M599 HydrophobicContact CG-CG 4.15Å; K595-M599 WeakPolarHBondContact O-CB 3.45Å; K595-M599 WeakPolarHBondContact O-CG 3.45Å; K595-M599 PolarHBondContact O-N 3.44Å; M599-C601 VanDerWaalsContact C-N 3.32Å; M599-C601 PolarHBondContact O-N 3.15Å; M599-V602 PolarHBondContact O-N 2.85Å; M599-K603 WeakPolarHBondContact O-CB 3.43Å; M599-K603 PolarHBondContact O-N 3.24Å; M599-E620 HydrophobicContact CE-CB 4.32Å; M599-E620 HydrophobicContact CE-CG 3.65Å; M599-E620 VanDerWaalsContact CE-OE1 3.28Å; M599-E620 WeakPolarHBondContact CE-OE1 3.41Å; M599-E620 HydrophobicContact SD-CG 4.16Å; M599-F623 HydrophobicContact SD-CD1 4.43Å
600	S	96.5	Very high	94	Very high	74 Å²	74	62.8 Å²	62.8	52%	0.517	31%	0.314	S	S	.	.	H	α-helix	trans	-63.3	-35.9	173.4	-172	0	0	0	0	112.6	Q596 R597 V598 M604	Q596-S600 VanDerWaalsContact O-CB 3.3Å; Q596-S600 WeakPolarHBondContact O-CB 3.43Å; Q596-S600 PolarHBondContact O-N 2.97Å; R597-S600 PolarHBondContact O-N 3.44Å; V598-S600 VanDerWaalsContact C-N 3.25Å; V598-S600 PolarHBondContact O-N 3.34Å; S600-M604 WeakPolarHBondContact O-CB 3.43Å; S600-M604 PolarHBondContact O-N 3.17Å; S600-M604 VanDerWaalsContact O-N 3.08Å
601	C	95.8	Very high	94.1	Very high	7 Å²	7	57.8 Å²	57.8	5%	0.047	30%	0.295	C	S	.	.	H	α-helix	trans	-67.5	-45.6	174.3	-65.5	0	0	0	0	111.2	L543 Y544 R597 V598 M599 K603 M604 W605	L543-C601 HydrophobicContact CD2-CB 4.43Å; Y544-C601 VanDerWaalsContact CE1-SG 3.52Å; R597-C601 PolarHBondContact O-N 2.65Å; V598-C601 WeakPolarHBondContact O-CB 3.45Å; V598-C601 PolarHBondContact O-N 2.94Å; V598-C601 VanDerWaalsContact O-N 3.1Å; M599-C601 VanDerWaalsContact C-N 3.32Å; M599-C601 PolarHBondContact O-N 3.15Å; C601-K603 VanDerWaalsContact C-N 3.34Å; C601-K603 PolarHBondContact O-N 2.55Å; C601-M604 WeakPolarHBondContact O-CB 3.2Å; C601-M604 PolarHBondContact O-N 2.87Å; C601-W605 HydrophobicContact CB-CZ2 4.14Å; C601-W605 VanDerWaalsContact O-CG 3.23Å; C601-W605 PolarHBondContact O-N 3.23Å
602	V	96.6	Very high	94.2	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-58.7	-47.9	178.4	177.8	0	0	0	0	110.6	F575 V598 M599 M604 W605 E606 L616 E620	F575-V602 HydrophobicContact CE1-CG2 3.83Å; F575-V602 HydrophobicContact CZ-CG2 3.8Å; V598-V602 PolarHBondContact O-N 3.21Å; M599-V602 PolarHBondContact O-N 2.85Å; V602-M604 VanDerWaalsContact C-N 3.32Å; V602-M604 PolarHBondContact O-N 2.94Å; V602-W605 PolarHBondContact O-N 3.46Å; V602-W605 VanDerWaalsContact O-N 3.13Å; V602-E606 PolarHBondContact O-N 3.39Å; V602-L616 HydrophobicContact CG1-CB 4Å; V602-L616 HydrophobicContact CG1-CD2 4.27Å; V602-E620 HydrophobicContact CG1-CG 3.92Å; V602-E620 WeakPolarHBondContact CG1-OE1 3.35Å
603	K	94.9	Very high	94	Very high	122 Å²	122	61.5 Å²	61.5	53%	0.53	32%	0.321	S	S	.	.	H	α-helix	trans	-58	-43.7	175.9	-177.2	177	172.5	-179.8	0	112	M599 C601 W605 E606 E607	M599-K603 WeakPolarHBondContact O-CB 3.43Å; M599-K603 PolarHBondContact O-N 3.24Å; C601-K603 VanDerWaalsContact C-N 3.34Å; C601-K603 PolarHBondContact O-N 2.55Å; K603-W605 VanDerWaalsContact C-N 3.32Å; K603-W605 PolarHBondContact O-N 2.92Å; K603-E606 PolarHBondContact O-N 3.42Å; K603-E607 WeakPolarHBondContact CE-OE1 3.39Å; K603-E607 HydrophobicContact CG-CG 4.48Å; K603-E607 IonicContact NZ-OE1 3.63Å; K603-E607 WeakPolarHBondContact O-CG 3.02Å; K603-E607 PolarHBondContact O-N 3.15Å
604	M	93.5	Very high	93.9	Very high	86 Å²	86	62.6 Å²	62.6	42%	0.424	33%	0.331	S	S	.	.	H	α-helix	trans	-62.2	-39	176.9	-178.3	60.9	-170.8	0	0	112.2	S600 C601 V602 S608	S600-M604 WeakPolarHBondContact O-CB 3.43Å; S600-M604 PolarHBondContact O-N 3.17Å; S600-M604 VanDerWaalsContact O-N 3.08Å; C601-M604 WeakPolarHBondContact O-CB 3.2Å; C601-M604 PolarHBondContact O-N 2.87Å; V602-M604 VanDerWaalsContact C-N 3.32Å; V602-M604 PolarHBondContact O-N 2.94Å; M604-S608 WeakPolarHBondContact CE-OG 3.5Å; M604-S608 VanDerWaalsContact O-CB 3.24Å; M604-S608 WeakPolarHBondContact O-CB 3.45Å; M604-S608 PolarHBondContact O-N 2.92Å; M604-S608 PolarHBondContact O-OG 3.4Å
605	W	95.2	Very high	93.9	Very high	4 Å²	4	64.4 Å²	64.4	2%	0.015	34%	0.339	C	S	.	.	H	α-helix	trans	-69.3	-33.1	176.9	-60.2	-19.1	0	0	0	112.6	L543 S547 L550 L571 F575 C601 V602 K603 A609 V610 L616 L619	L543-W605 HydrophobicContact CD1-CH2 3.87Å; L543-W605 HydrophobicContact CD1-CZ2 4.33Å; S547-W605 PolarHBondContact OG-NE1 3.46Å; L550-W605 HydrophobicContact CD1-CD2 4.35Å; L550-W605 HydrophobicContact CD1-CZ2 3.99Å; L571-W605 HydrophobicContact CD1-CZ3 4.09Å; L571-W605 HydrophobicContact CD2-CH2 3.62Å; L571-W605 HydrophobicContact CD2-CZ3 3.81Å; F575-W605 HydrophobicContact CE2-CH2 4.17Å; F575-W605 HydrophobicContact CE2-CZ3 4.01Å; F575-W605 HydrophobicContact CZ-CH2 4.35Å; F575-W605 AromaticContact CZ-CZ3 3.92Å; F575-W605 HydrophobicContact CZ-CZ3 3.92Å; C601-W605 HydrophobicContact CB-CZ2 4.14Å; C601-W605 VanDerWaalsContact O-CG 3.23Å; C601-W605 PolarHBondContact O-N 3.23Å; V602-W605 PolarHBondContact O-N 3.46Å; V602-W605 VanDerWaalsContact O-N 3.13Å; K603-W605 VanDerWaalsContact C-N 3.32Å; K603-W605 PolarHBondContact O-N 2.92Å; W605-A609 PolarHBondContact O-N 3.08Å; W605-A609 VanDerWaalsContact O-N 3.17Å; W605-V610 HydrophobicContact CB-CB 4.23Å; W605-V610 PolarHBondContact O-N 3.11Å; W605-L616 HydrophobicContact CB-CD1 4.4Å; W605-L616 HydrophobicContact CB-CD2 4.18Å; W605-L616 HydrophobicContact CE3-CD2 4.04Å; W605-L619 HydrophobicContact CZ3-CD1 4.48Å
606	E	94.1	Very high	93.9	Very high	90 Å²	90	61.2 Å²	61.2	42%	0.421	33%	0.325	S	S	.	.	H	α-helix	trans	-68.3	-50.2	173.3	-168.6	169.9	-143.5	0	0	111.4	V602 K603 S608 A609 S613 L616	V602-E606 PolarHBondContact O-N 3.39Å; K603-E606 PolarHBondContact O-N 3.42Å; E606-S608 VanDerWaalsContact C-N 3.25Å; E606-S608 PolarHBondContact O-N 3.07Å; E606-A609 PolarHBondContact O-N 3.34Å; E606-S613 PolarHBondContact OE1-OG 3.45Å; E606-L616 HydrophobicContact CB-CD1 3.54Å; E606-L616 HydrophobicContact CG-CD1 4.12Å
607	E	92.8	Very high	93.7	Very high	131 Å²	131	56.9 Å²	56.9	61%	0.612	31%	0.31	S	S	*	.	H	α-helix	trans	-60.5	-36.4	178.7	-72.9	177	172.6	0	0	112	K603 A609	K603-E607 WeakPolarHBondContact CE-OE1 3.39Å; K603-E607 HydrophobicContact CG-CG 4.48Å; K603-E607 IonicContact NZ-OE1 3.63Å; K603-E607 WeakPolarHBondContact O-CG 3.02Å; K603-E607 PolarHBondContact O-N 3.15Å; E607-A609 VanDerWaalsContact C-N 3.3Å
608	S	88.8	Confident	93.7	Very high	60 Å²	60	55.9 Å²	55.9	42%	0.42	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	1.4	177.1	-56.7	0	0	0	0	113.7	M604 E606 V610	M604-S608 WeakPolarHBondContact CE-OG 3.5Å; M604-S608 VanDerWaalsContact O-CB 3.24Å; M604-S608 WeakPolarHBondContact O-CB 3.45Å; M604-S608 PolarHBondContact O-N 2.92Å; M604-S608 PolarHBondContact O-OG 3.4Å; E606-S608 VanDerWaalsContact C-N 3.25Å; E606-S608 PolarHBondContact O-N 3.07Å; S608-V610 PolarHBondContact O-N 2.94Å
609	A	90.2	Very high	93.6	Very high	66 Å²	66	55.9 Å²	55.9	55%	0.545	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	37.1	-177.4	0	0	0	0	0	114.2	R564 W605 E606 E607	R564-A609 PolarHBondContact NH2-O 3.37Å; W605-A609 PolarHBondContact O-N 3.08Å; W605-A609 VanDerWaalsContact O-N 3.17Å; E606-A609 PolarHBondContact O-N 3.34Å; E607-A609 VanDerWaalsContact C-N 3.3Å
610	V	88.7	Confident	93.5	Very high	10 Å²	10	56.4 Å²	56.4	6%	0.061	31%	0.31	C	S	.	.	S	Bend	trans	-73.3	-37.7	179.3	-177.3	0	0	0	0	110.8	L550 R564 W605 S608	L550-V610 HydrophobicContact CB-CG1 4.42Å; L550-V610 HydrophobicContact CD1-CG1 4.37Å; L550-V610 HydrophobicContact CD2-CG1 4.01Å; R564-V610 HydrophobicContact CG-CG1 4.28Å; R564-V610 PolarHBondContact NE-O 2.85Å; R564-V610 VanDerWaalsContact NH2-C 3.34Å; R564-V610 PolarHBondContact NH2-O 3.07Å; W605-V610 HydrophobicContact CB-CB 4.23Å; W605-V610 PolarHBondContact O-N 3.11Å; S608-V610 PolarHBondContact O-N 2.94Å
611	Y	93.5	Very high	93.4	Very high	32 Å²	32	55.6 Å²	55.6	13%	0.125	30%	0.3	C	S	.	.	S	Bend	trans	-134.5	162.7	173.1	-59.9	-68.5	0	0	0	110.6	L550 R564 G568 L571 F615 L616	L550-Y611 HydrophobicContact CD1-CE2 3.96Å; L550-Y611 HydrophobicContact CD2-CE2 4.47Å; R564-Y611 HydrophobicContact CG-CE1 4.2Å; R564-Y611 PolarHBondContact O-OH 3.47Å; G568-Y611 WeakPolarHBondContact CA-OH 3.33Å; G568-Y611 PolarHBondContact N-OH 2.93Å; G568-Y611 VanDerWaalsContact N-OH 3.1Å; L571-Y611 HydrophobicContact CD1-CD2 4.08Å; L571-Y611 HydrophobicContact CD1-CE2 3.44Å; L571-Y611 VanDerWaalsContact CD1-CE2 3.44Å; Y611-F615 HydrophobicContact CD1-CD1 4.1Å; Y611-F615 HydrophobicContact CD1-CE1 4.08Å; Y611-F615 HydrophobicContact CD2-CD1 4.4Å; Y611-F615 HydrophobicContact CD2-CE1 4.27Å; Y611-F615 AromaticContact CG-CD1 3.81Å; Y611-F615 HydrophobicContact CG-CD1 3.81Å; Y611-F615 AromaticContact CG-CE1 3.97Å; Y611-F615 HydrophobicContact CG-CE1 3.97Å; Y611-L616 HydrophobicContact CD2-CD2 4.18Å
612	T	93.6	Very high	93.3	Very high	95 Å²	95	56 Å²	56	58%	0.583	30%	0.302	S	S	*	.			trans	-68.8	150.1	177.5	57.9	0	0	0	0	111	D614 F615 L616	T612-D614 PolarHBondContact O-N 3.33Å; T612-F615 PolarHBondContact O-N 2.88Å; T612-F615 VanDerWaalsContact O-N 3.11Å; T612-F615 WeakPolarHBondContact OG1-CB 3.43Å; T612-L616 WeakPolarHBondContact O-CG 3.44Å; T612-L616 PolarHBondContact O-N 3.15Å
613	S	91.6	Very high	93.3	Very high	58 Å²	58	56.1 Å²	56.1	41%	0.406	30%	0.302	S	S	.	.	H	α-helix	trans	-59.9	-34.1	-179.9	-167.9	0	0	0	0	112.3	E606 F615 L616 S617	E606-S613 PolarHBondContact OE1-OG 3.45Å; S613-F615 PolarHBondContact O-N 3.15Å; S613-L616 PolarHBondContact O-N 2.94Å; S613-S617 VanDerWaalsContact O-CB 3.28Å; S613-S617 WeakPolarHBondContact O-CB 3.44Å; S613-S617 PolarHBondContact O-N 3.13Å; S613-S617 PolarHBondContact O-OG 2.99Å
614	D	91.9	Very high	93.2	Very high	136 Å²	136	52 Å²	52	73%	0.727	29%	0.286	S	S	*	.	H	α-helix	trans	-63.1	-42.8	174.9	-60.9	-37.8	0	0	0	112.6	T612 S617 K618	T612-D614 PolarHBondContact O-N 3.33Å; D614-S617 PolarHBondContact O-N 2.97Å; D614-K618 PolarHBondContact O-N 3.32Å
615	F	93.2	Very high	92.9	Very high	42 Å²	42	49.7 Å²	49.7	18%	0.184	28%	0.284	C	S	.	.	H	α-helix	trans	-68.6	-42.3	178.3	179.4	-105	0	0	0	111.3	L571 E572 Y611 T612 S613 K618 L619	L571-F615 HydrophobicContact CB-CZ 4.3Å; L571-F615 HydrophobicContact CD1-CE1 3.98Å; L571-F615 HydrophobicContact CD1-CZ 4.46Å; E572-F615 HydrophobicContact CG-CE2 4.48Å; Y611-F615 HydrophobicContact CD1-CD1 4.1Å; Y611-F615 HydrophobicContact CD1-CE1 4.08Å; Y611-F615 HydrophobicContact CD2-CD1 4.4Å; Y611-F615 HydrophobicContact CD2-CE1 4.27Å; Y611-F615 AromaticContact CG-CD1 3.81Å; Y611-F615 HydrophobicContact CG-CD1 3.81Å; Y611-F615 AromaticContact CG-CE1 3.97Å; Y611-F615 HydrophobicContact CG-CE1 3.97Å; T612-F615 PolarHBondContact O-N 2.88Å; T612-F615 VanDerWaalsContact O-N 3.11Å; T612-F615 WeakPolarHBondContact OG1-CB 3.43Å; S613-F615 PolarHBondContact O-N 3.15Å; F615-K618 WeakPolarHBondContact O-CB 3.44Å; F615-K618 PolarHBondContact O-N 3.43Å; F615-L619 HydrophobicContact CD1-CD1 4.14Å; F615-L619 HydrophobicContact CD1-CG 4.5Å; F615-L619 HydrophobicContact CE1-CD1 3.68Å; F615-L619 HydrophobicContact CE1-CG 4.19Å; F615-L619 HydrophobicContact CZ-CD1 4.17Å; F615-L619 HydrophobicContact CZ-CD2 4.28Å; F615-L619 HydrophobicContact CZ-CG 4.31Å; F615-L619 WeakPolarHBondContact O-CG 3.44Å; F615-L619 PolarHBondContact O-N 3.28Å
616	L	95.8	Very high	92.5	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-63.5	-42.3	175.5	-65	178.6	0	0	0	111.3	V602 W605 E606 Y611 T612 S613 K618 L619 E620	V602-L616 HydrophobicContact CG1-CB 4Å; V602-L616 HydrophobicContact CG1-CD2 4.27Å; W605-L616 HydrophobicContact CB-CD1 4.4Å; W605-L616 HydrophobicContact CB-CD2 4.18Å; W605-L616 HydrophobicContact CE3-CD2 4.04Å; E606-L616 HydrophobicContact CB-CD1 3.54Å; E606-L616 HydrophobicContact CG-CD1 4.12Å; Y611-L616 HydrophobicContact CD2-CD2 4.18Å; T612-L616 WeakPolarHBondContact O-CG 3.44Å; T612-L616 PolarHBondContact O-N 3.15Å; S613-L616 PolarHBondContact O-N 2.94Å; L616-K618 VanDerWaalsContact C-N 3.3Å; L616-K618 PolarHBondContact O-N 2.87Å; L616-L619 HydrophobicContact CD2-CD1 4.34Å; L616-L619 WeakPolarHBondContact O-CB 3.33Å; L616-L619 PolarHBondContact O-N 3.48Å; L616-L619 VanDerWaalsContact O-N 3.09Å; L616-E620 WeakPolarHBondContact O-CG 3.3Å; L616-E620 PolarHBondContact O-N 3.37Å
617	S	92.9	Very high	91.3	Very high	48 Å²	48	58.4 Å²	58.4	34%	0.336	32%	0.316	S	S	.	.	H	α-helix	trans	-59.7	-39.4	173.1	-62.8	0	0	0	0	112	S613 D614 E620 N621	S613-S617 VanDerWaalsContact O-CB 3.28Å; S613-S617 WeakPolarHBondContact O-CB 3.44Å; S613-S617 PolarHBondContact O-N 3.13Å; S613-S617 PolarHBondContact O-OG 2.99Å; D614-S617 PolarHBondContact O-N 2.97Å; S617-E620 PolarHBondContact O-N 3.19Å; S617-N621 PolarHBondContact O-N 3.31Å; S617-N621 PolarHBondContact O-ND2 3.06Å
618	K	94	Very high	89.5	Confident	66 Å²	66	60.1 Å²	60.1	29%	0.287	32%	0.324	S	S	.	.	H	α-helix	trans	-60.3	-46.2	172.7	-174.7	-175.5	176.2	-169.3	0	111.1	E572 D614 F615 L616 N621 I622 F627	E572-K618 WeakPolarHBondContact OE1-CE 3.45Å; E572-K618 IonicContact OE1-NZ 2.93Å; E572-K618 PolarHBondContact OE1-NZ 3.45Å; E572-K618 WeakPolarHBondContact OE2-CE 3.46Å; E572-K618 IonicContact OE2-NZ 3.24Å; E572-K618 PolarHBondContact OE2-NZ 2.91Å; D614-K618 PolarHBondContact O-N 3.32Å; F615-K618 WeakPolarHBondContact O-CB 3.44Å; F615-K618 PolarHBondContact O-N 3.43Å; L616-K618 VanDerWaalsContact C-N 3.3Å; L616-K618 PolarHBondContact O-N 2.87Å; K618-N621 PolarHBondContact O-N 2.99Å; K618-I622 HydrophobicContact CG-CD1 4.15Å; K618-I622 WeakPolarHBondContact O-CG1 3.25Å; K618-I622 PolarHBondContact O-N 3.36Å; K618-F627 HydrophobicContact CG-CD2 4.46Å; K618-F627 HydrophobicContact CG-CE2 4.09Å
619	L	95.8	Very high	87.6	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61.9	-43.9	177.1	-66.6	179.9	0	0	0	112.1	L571 E572 F575 W605 F615 L616 N621 I622 F623	L571-L619 HydrophobicContact CB-CD1 3.95Å; L571-L619 HydrophobicContact CB-CD2 3.9Å; L571-L619 HydrophobicContact CD1-CD1 3.91Å; L571-L619 HydrophobicContact CG-CD1 4.4Å; E572-L619 HydrophobicContact CG-CD2 3.96Å; F575-L619 HydrophobicContact CB-CD2 4.43Å; F575-L619 HydrophobicContact CD1-CB 3.73Å; F575-L619 HydrophobicContact CD1-CD2 4.49Å; F575-L619 VanDerWaalsContact CD1-O 3.29Å; F575-L619 WeakPolarHBondContact CD1-O 3.37Å; F575-L619 HydrophobicContact CD2-CD2 4.35Å; F575-L619 HydrophobicContact CE1-CB 3.79Å; F575-L619 HydrophobicContact CE2-CD1 4.38Å; F575-L619 HydrophobicContact CG-CB 4.27Å; F575-L619 HydrophobicContact CG-CD2 4.17Å; F575-L619 HydrophobicContact CZ-CB 4.33Å; F575-L619 HydrophobicContact CZ-CD1 4.37Å; W605-L619 HydrophobicContact CZ3-CD1 4.48Å; F615-L619 HydrophobicContact CD1-CD1 4.14Å; F615-L619 HydrophobicContact CD1-CG 4.5Å; F615-L619 HydrophobicContact CE1-CD1 3.68Å; F615-L619 HydrophobicContact CE1-CG 4.19Å; F615-L619 HydrophobicContact CZ-CD1 4.17Å; F615-L619 HydrophobicContact CZ-CD2 4.28Å; F615-L619 HydrophobicContact CZ-CG 4.31Å; F615-L619 WeakPolarHBondContact O-CG 3.44Å; F615-L619 PolarHBondContact O-N 3.28Å; L616-L619 HydrophobicContact CD2-CD1 4.34Å; L616-L619 WeakPolarHBondContact O-CB 3.33Å; L616-L619 PolarHBondContact O-N 3.48Å; L616-L619 VanDerWaalsContact O-N 3.09Å; L619-N621 VanDerWaalsContact C-N 3.3Å; L619-N621 PolarHBondContact O-N 3.21Å; L619-I622 PolarHBondContact O-N 3.45Å; L619-I622 VanDerWaalsContact O-N 3.16Å; L619-F623 PolarHBondContact O-N 3.21Å
620	E	94.6	Very high	85.2	Confident	55 Å²	55	65.6 Å²	65.6	26%	0.257	34%	0.339	S	S	.	.	H	α-helix	trans	-57.2	-44.3	175	-68.8	-172.9	175.6	0	0	111.8	M599 V602 L616 S617 I622 F623 L624	M599-E620 HydrophobicContact CE-CB 4.32Å; M599-E620 HydrophobicContact CE-CG 3.65Å; M599-E620 VanDerWaalsContact CE-OE1 3.28Å; M599-E620 WeakPolarHBondContact CE-OE1 3.41Å; M599-E620 HydrophobicContact SD-CG 4.16Å; V602-E620 HydrophobicContact CG1-CG 3.92Å; V602-E620 WeakPolarHBondContact CG1-OE1 3.35Å; L616-E620 WeakPolarHBondContact O-CG 3.3Å; L616-E620 PolarHBondContact O-N 3.37Å; S617-E620 PolarHBondContact O-N 3.19Å; E620-I622 VanDerWaalsContact C-N 3.35Å; E620-I622 PolarHBondContact O-N 3.45Å; E620-F623 PolarHBondContact O-N 2.65Å; E620-L624 WeakPolarHBondContact O-CB 3.36Å; E620-L624 VanDerWaalsContact O-CG 3.3Å; E620-L624 WeakPolarHBondContact O-CG 3.38Å; E620-L624 PolarHBondContact O-N 2.96Å
621	N	93.6	Very high	82.4	Confident	57 Å²	57	67.9 Å²	67.9	31%	0.305	37%	0.365	S	S	.	.	H	α-helix	trans	-64.9	-37.6	177.6	-72.6	-39.6	0	0	0	112.4	S617 K618 L619 G625 R626 F627	S617-N621 PolarHBondContact O-N 3.31Å; S617-N621 PolarHBondContact O-ND2 3.06Å; K618-N621 PolarHBondContact O-N 2.99Å; L619-N621 VanDerWaalsContact C-N 3.3Å; L619-N621 PolarHBondContact O-N 3.21Å; N621-G625 PolarHBondContact O-N 2.94Å; N621-G625 VanDerWaalsContact O-N 3.13Å; N621-R626 HydrophobicContact CB-CB 4.33Å; N621-R626 PolarHBondContact O-N 3.33Å; N621-F627 HydrophobicContact CB-CB 4.33Å; N621-F627 HydrophobicContact CB-CD2 4.42Å; N621-F627 PolarHBondContact O-N 3.28Å; N621-F627 VanDerWaalsContact O-N 3.14Å
622	I	94.4	Very high	79.2	Confident	17 Å²	17	72.7 Å²	72.7	9%	0.087	39%	0.392	C	S	.	.	H	α-helix	trans	-64.1	-49.5	173.9	-67.5	165.8	0	0	0	110.2	E572 F575 R576 K618 L619 E620 L624 G625 F627	E572-I622 HydrophobicContact CB-CD1 4.12Å; E572-I622 HydrophobicContact CG-CD1 3.96Å; F575-I622 HydrophobicContact CB-CB 4.46Å; F575-I622 HydrophobicContact CB-CG2 3.94Å; R576-I622 HydrophobicContact CB-CG2 4.3Å; K618-I622 HydrophobicContact CG-CD1 4.15Å; K618-I622 WeakPolarHBondContact O-CG1 3.25Å; K618-I622 PolarHBondContact O-N 3.36Å; L619-I622 PolarHBondContact O-N 3.45Å; L619-I622 VanDerWaalsContact O-N 3.16Å; E620-I622 VanDerWaalsContact C-N 3.35Å; E620-I622 PolarHBondContact O-N 3.45Å; I622-L624 PolarHBondContact O-N 3.02Å; I622-G625 PolarHBondContact O-N 2.79Å; I622-G625 VanDerWaalsContact O-N 3.11Å; I622-F627 HydrophobicContact CG1-CB 3.94Å; I622-F627 HydrophobicContact CG1-CD1 4.37Å; I622-F627 HydrophobicContact CG1-CD2 4.45Å; I622-F627 HydrophobicContact CG1-CG 4Å
623	F	95.2	Very high	75.9	Confident	1 Å²	1	72.3 Å²	72.3	0%	0.004	39%	0.391	C	S	.	.	H	α-helix	trans	-65.1	-37.4	-178.8	172.3	-110.5	0	0	0	113.1	F575 L578 N579 Y582 K595 V598 M599 L619 E620 G625	F575-F623 HydrophobicContact CD1-CB 3.66Å; F575-F623 HydrophobicContact CE1-CB 4.28Å; L578-F623 HydrophobicContact CB-CD2 3.86Å; L578-F623 HydrophobicContact CB-CE2 4.03Å; N579-F623 PolarHBondContact ND2-O 2.79Å; Y582-F623 HydrophobicContact CD2-CE2 4.44Å; Y582-F623 AromaticContact CD2-CZ 3.92Å; Y582-F623 HydrophobicContact CD2-CZ 3.92Å; Y582-F623 HydrophobicContact CE2-CZ 4.44Å; Y582-F623 HydrophobicContact CG-CE2 4.14Å; Y582-F623 AromaticContact CG-CZ 3.99Å; Y582-F623 HydrophobicContact CG-CZ 3.99Å; K595-F623 HydrophobicContact CB-CE1 4.33Å; K595-F623 HydrophobicContact CG-CE1 4.2Å; V598-F623 HydrophobicContact CB-CD1 4.42Å; V598-F623 HydrophobicContact CB-CE1 3.95Å; V598-F623 HydrophobicContact CB-CE2 4.33Å; V598-F623 HydrophobicContact CB-CZ 3.91Å; V598-F623 HydrophobicContact CG1-CD1 3.94Å; V598-F623 HydrophobicContact CG1-CD2 4.13Å; V598-F623 HydrophobicContact CG1-CE1 3.98Å; V598-F623 HydrophobicContact CG1-CE2 4.18Å; V598-F623 HydrophobicContact CG1-CG 4.02Å; V598-F623 HydrophobicContact CG1-CZ 4.11Å; V598-F623 HydrophobicContact CG2-CE1 4.37Å; V598-F623 HydrophobicContact CG2-CE2 3.96Å; V598-F623 HydrophobicContact CG2-CZ 3.8Å; M599-F623 HydrophobicContact SD-CD1 4.43Å; L619-F623 PolarHBondContact O-N 3.21Å; E620-F623 PolarHBondContact O-N 2.65Å; F623-G625 PolarHBondContact O-N 3.38Å
624	L	93.1	Very high	72.7	Confident	36 Å²	36	75.4 Å²	75.4	19%	0.188	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-4.9	176.6	-63.3	176.9	0	0	0	113.1	K595 E620 I622 R626	K595-L624 HydrophobicContact CD-CD2 4.15Å; K595-L624 HydrophobicContact CG-CD2 4.47Å; E620-L624 WeakPolarHBondContact O-CB 3.36Å; E620-L624 VanDerWaalsContact O-CG 3.3Å; E620-L624 WeakPolarHBondContact O-CG 3.38Å; E620-L624 PolarHBondContact O-N 2.96Å; I622-L624 PolarHBondContact O-N 3.02Å; L624-R626 VanDerWaalsContact C-N 3.27Å; L624-R626 HydrophobicContact CB-CG 4.14Å; L624-R626 PolarHBondContact O-N 3.04Å
625	G	88.2	Confident	69.5	Low	37 Å²	37	74.4 Å²	74.4	38%	0.381	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	24.8	-177.8	0	0	0	0	0	113.7	N579 N621 I622 F623	N579-G625 PolarHBondContact ND2-N 3.07Å; N621-G625 PolarHBondContact O-N 2.94Å; N621-G625 VanDerWaalsContact O-N 3.13Å; I622-G625 PolarHBondContact O-N 2.79Å; I622-G625 VanDerWaalsContact O-N 3.11Å; F623-G625 PolarHBondContact O-N 3.38Å
626	R	86.1	Confident	66.4	Low	177 Å²	177	77.7 Å²	77.7	67%	0.668	42%	0.423	S	S	*	.			trans	-88	-12.1	174.1	-63.9	177.1	179.8	173.2	-3.5	112.5	N621 L624 Q628	N621-R626 HydrophobicContact CB-CB 4.33Å; N621-R626 PolarHBondContact O-N 3.33Å; L624-R626 VanDerWaalsContact C-N 3.27Å; L624-R626 HydrophobicContact CB-CG 4.14Å; L624-R626 PolarHBondContact O-N 3.04Å; R626-Q628 PolarHBondContact O-N 3.44Å
627	F	69.7	Low	62.9	Low	101 Å²	101	84.6 Å²	84.6	44%	0.443	46%	0.459	S	S	.	.			trans	-80.8	103	176	-158.2	-94.5	0	0	0	109.4	K618 N621 I622	K618-F627 HydrophobicContact CG-CD2 4.46Å; K618-F627 HydrophobicContact CG-CE2 4.09Å; N621-F627 HydrophobicContact CB-CB 4.33Å; N621-F627 HydrophobicContact CB-CD2 4.42Å; N621-F627 PolarHBondContact O-N 3.28Å; N621-F627 VanDerWaalsContact O-N 3.14Å; I622-F627 HydrophobicContact CG1-CB 3.94Å; I622-F627 HydrophobicContact CG1-CD1 4.37Å; I622-F627 HydrophobicContact CG1-CD2 4.45Å; I622-F627 HydrophobicContact CG1-CG 4Å
628	Q	54.9	Low	59.6	Low	167 Å²	167	86.1 Å²	86.1	78%	0.78	46%	0.457	S	S	*	.			trans	-80.2	120	165.6	-167.2	159	7.4	0	0	106.5	R626 V630	R626-Q628 PolarHBondContact O-N 3.44Å; Q628-V630 PolarHBondContact O-N 2.99Å
629	E	47.7	Very low	56.4	Low	126 Å²	126	87.6 Å²	87.6	59%	0.589	47%	0.469	S	S	*	.			trans	-59.7	99.9	164.6	-73.7	-176.8	-177.7	0	0	105.6	R576 G631	R576-E629 IonicContact CZ-OE1 2.8Å; R576-E629 IonicContact NE-OE1 2.69Å; R576-E629 IonicContact NH2-OE1 3.48Å; R576-E629 PolarHBondContact NH2-OE1 3.49Å; E629-G631 PolarHBondContact O-N 3.07Å
630	V	41.3	Very low	53.3	Low	114 Å²	114	92.6 Å²	92.6	69%	0.691	50%	0.499	S	S	*	.			trans	-60.6	94.4	147.4	-170.3	0	0	0	0	101	Q628 L632	Q628-V630 PolarHBondContact O-N 2.99Å; V630-L632 HydrophobicContact CG1-CG 4.45Å; V630-L632 PolarHBondContact O-N 3.46Å
631	G	30.4	Very low	50.3	Low	59 Å²	59	96 Å²	96	61%	0.608	51%	0.509	S	S	*	.			trans	-56.6	87.6	157.9	0	0	0	0	0	102.3	E629 P633	E629-G631 PolarHBondContact O-N 3.07Å; G631-P633 WeakPolarHBondContact O-CD 3.28Å
632	L	24.6	Very low	47.2	Very low	133 Å²	133	96 Å²	96	70%	0.696	51%	0.509	S	S	*	.			trans	-53	109.8	163.2	-87.3	132.6	0	0	0	100.1	V630 C634	V630-L632 HydrophobicContact CG1-CG 4.45Å; V630-L632 PolarHBondContact O-N 3.46Å; L632-C634 PolarHBondContact O-N 3.23Å
633	P	24.1	Very low	44	Very low	87 Å²	87	99.4 Å²	99.4	57%	0.565	53%	0.531	S	S	*	.			trans	-50.2	148.4	162.8	-10	25.5	0	0	0	103.3	G631 I635	G631-P633 WeakPolarHBondContact O-CD 3.28Å; P633-I635 HydrophobicContact CB-CG1 4.25Å; P633-I635 HydrophobicContact CG-CD1 4.37Å; P633-I635 HydrophobicContact CG-CG1 4.41Å; P633-I635 PolarHBondContact O-N 3.46Å
634	C	26	Very low	40.8	Very low	122 Å²	122	108.5 Å²	108.5	82%	0.824	57%	0.566	S	S	*	*			trans	-62.2	68	164.1	-58.8	0	0	0	0	107.5	L632 I636	L632-C634 PolarHBondContact O-N 3.23Å; C634-I636 PolarHBondContact O-N 2.94Å
635	I	24.3	Very low	38	Very low	116 Å²	116	110.9 Å²	110.9	60%	0.595	57%	0.573	S	S	*	*			trans	-64.5	89.5	150.6	-67	170	0	0	0	99.4	P633 L637	P633-I635 HydrophobicContact CB-CG1 4.25Å; P633-I635 HydrophobicContact CG-CD1 4.37Å; P633-I635 HydrophobicContact CG-CG1 4.41Å; P633-I635 PolarHBondContact O-N 3.46Å; I635-L637 HydrophobicContact CG2-CG 4.39Å; I635-L637 PolarHBondContact O-N 3.37Å
636	I	28.2	Very low	35.2	Very low	110 Å²	110	113 Å²	113	56%	0.564	58%	0.575	S	S	*	*			trans	-47.4	90.2	161.9	-63.3	162.3	0	0	0	103.4	C634 W638	C634-I636 PolarHBondContact O-N 2.94Å; I636-W638 HydrophobicContact CG2-CB 4.36Å; I636-W638 HydrophobicContact CG2-CG 4.38Å; I636-W638 PolarHBondContact O-N 2.94Å
637	L	21.9	Very low	32.6	Very low	147 Å²	147	108.3 Å²	108.3	77%	0.77	57%	0.569	S	S	*	*			trans	-71.2	59.9	166	-94.4	158.3	0	0	0	106.2	I635	I635-L637 HydrophobicContact CG2-CG 4.39Å; I635-L637 PolarHBondContact O-N 3.37Å
638	W	24.6	Very low	30.7	Very low	80 Å²	80	113.7 Å²	113.7	30%	0.303	59%	0.588	S	S	.	*	S	Bend		-82.1	104.1	126	-73.3	83.3	0	0	0	103.2	F440 I636 V640 L642	F440-W638 AromaticContact CE2-CH2 3.98Å; F440-W638 HydrophobicContact CE2-CH2 3.98Å; F440-W638 HydrophobicContact CE2-CZ2 4.26Å; F440-W638 HydrophobicContact CZ-CH2 4.43Å; I636-W638 HydrophobicContact CG2-CB 4.36Å; I636-W638 HydrophobicContact CG2-CG 4.38Å; I636-W638 PolarHBondContact O-N 2.94Å; W638-V640 PolarHBondContact O-N 2.97Å; W638-L642 HydrophobicContact CE3-CB 4.13Å; W638-L642 HydrophobicContact CE3-CD2 4.47Å; W638-L642 HydrophobicContact CZ3-CB 4.38Å; W638-L642 HydrophobicContact CZ3-CD2 3.91Å
639	D	26.6	Very low	29.4	Very low	98 Å²	98	111 Å²	111	52%	0.524	58%	0.578	S	S	.	*			trans	-43.4	120.8	159.4	-175.4	-5.1	0	0	0	106.4	R641 L642	D639-R641 PolarHBondContact O-N 3.4Å; D639-R641 PolarHBondContact OD1-N 3.39Å; D639-R641 IonicContact OD2-NE 3.14Å; D639-L642 PolarHBondContact O-N 3.1Å
640	V	29	Very low	28.5	Very low	105 Å²	105	110 Å²	110	64%	0.636	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	-3.7	-174.5	174.6	0	0	0	0	111.7	W638	W638-V640 PolarHBondContact O-N 2.97Å
641	R	31.6	Very low	27.9	Very low	125 Å²	125	112.6 Å²	112.6	47%	0.472	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.7	-20.6	168.8	-67.8	-178.7	-169.7	-158.6	6.2	115.8	F58 L62 D639	F58-R641 VanDerWaalsContact CZ-CZ 3.47Å; L62-R641 HydrophobicContact CD2-CG 4.43Å; D639-R641 PolarHBondContact O-N 3.4Å; D639-R641 PolarHBondContact OD1-N 3.39Å; D639-R641 IonicContact OD2-NE 3.14Å
642	L	28.6	Very low	27.7	Very low	58 Å²	58	118.3 Å²	118.3	30%	0.304	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.4	-23.1	178.3	-116.6	84.1	0	0	0	115.2	W638 D639 Y644 R645	W638-L642 HydrophobicContact CE3-CB 4.13Å; W638-L642 HydrophobicContact CE3-CD2 4.47Å; W638-L642 HydrophobicContact CZ3-CB 4.38Å; W638-L642 HydrophobicContact CZ3-CD2 3.91Å; D639-L642 PolarHBondContact O-N 3.1Å; L642-Y644 VanDerWaalsContact C-N 3.28Å; L642-Y644 PolarHBondContact O-N 2.9Å; L642-R645 WeakPolarHBondContact O-CB 3.44Å; L642-R645 PolarHBondContact O-N 2.84Å
643	T	27.1	Very low	27.9	Very low	88 Å²	88	119.4 Å²	119.4	54%	0.54	59%	0.589	S	S	.	*	H	α-helix	trans	-68.1	-28.4	-174	-17.6	0	0	0	0	112.7	R645	T643-R645 PolarHBondContact O-N 3.11Å
644	Y	28.2	Very low	27.9	Very low	192 Å²	192	120.6 Å²	120.6	75%	0.753	60%	0.598	S	S	*	*	H	α-helix	trans	-72.9	-10.8	170.9	-85.5	-78.5	0	0	0	114.2	L642	L642-Y644 VanDerWaalsContact C-N 3.28Å; L642-Y644 PolarHBondContact O-N 2.9Å
645	R	35	Very low	27.8	Very low	87 Å²	87	126.1 Å²	126.1	33%	0.328	60%	0.602	S	S	.	*	H	α-helix	trans	-88.4	-24.3	-179.5	-72.6	172	115	-176.5	-10.3	113.6	E69 L642 T643	E69-R645 IonicContact OE2-NH1 3.67Å; L642-R645 WeakPolarHBondContact O-CB 3.44Å; L642-R645 PolarHBondContact O-N 2.84Å; T643-R645 PolarHBondContact O-N 3.11Å
646	I	30.3	Very low	28	Very low	82 Å²	82	125.2 Å²	125.2	42%	0.421	60%	0.603	S	S	.	*	H	α-helix	trans	-86.7	-15.1	179	-61.5	176.3	0	0	0	112.4	Y648 L649 N650	I646-Y648 PolarHBondContact O-N 3.35Å; I646-L649 PolarHBondContact O-N 3.49Å; I646-N650 PolarHBondContact O-N 2.84Å; I646-N650 VanDerWaalsContact O-N 3.08Å
647	S	30.9	Very low	27.8	Very low	78 Å²	78	128.6 Å²	128.6	55%	0.545	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.1	-17.1	176.6	-164.4	0	0	0	0	113.8
648	Y	29.4	Very low	28.2	Very low	214 Å²	214	128.1 Å²	128.1	84%	0.839	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-11.4	172.5	-97.4	-84.5	0	0	0	114.4	I646	I646-Y648 PolarHBondContact O-N 3.35Å
649	L	28.7	Very low	28.5	Very low	110 Å²	110	133.1 Å²	133.1	58%	0.576	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	-28.3	177.6	-78.6	164.4	0	0	0	113.1	I646 H651 F652	I646-L649 PolarHBondContact O-N 3.49Å; L649-H651 PolarHBondContact O-N 2.95Å; L649-F652 PolarHBondContact O-N 3.42Å; L649-F652 VanDerWaalsContact O-N 3.11Å
650	N	27.6	Very low	28.4	Very low	106 Å²	106	133.5 Å²	133.5	57%	0.567	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-66.6	-18.6	176.3	-84.3	-12.1	0	0	0	113.7	I646 F652	I646-N650 PolarHBondContact O-N 2.84Å; I646-N650 VanDerWaalsContact O-N 3.08Å; N650-F652 PolarHBondContact O-N 2.73Å; N650-F652 VanDerWaalsContact O-N 3.15Å
651	H	29	Very low	28.5	Very low	168 Å²	168	136.8 Å²	136.8	78%	0.778	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-69.8	-3.1	173.1	-115.6	81.2	0	0	0	114.1	L649	L649-H651 PolarHBondContact O-N 2.95Å
652	F	27	Very low	28.2	Very low	178 Å²	178	136.2 Å²	136.2	78%	0.781	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-117.6	-8.1	178.3	-95.6	-82.4	0	0	0	116.2	L649 N650	L649-F652 PolarHBondContact O-N 3.42Å; L649-F652 VanDerWaalsContact O-N 3.11Å; N650-F652 PolarHBondContact O-N 2.73Å; N650-F652 VanDerWaalsContact O-N 3.15Å
653	F	27.8	Very low	28.2	Very low	157 Å²	157	141.8 Å²	141.8	69%	0.689	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	3.6	-166.5	-75.5	-70.6	0	0	0	118.3
654	C	23.9	Very low	28.3	Very low	112 Å²	112	144.1 Å²	144.1	76%	0.757	73%	0.725	S	S	*	*			trans	-111.2	86.6	169	-69.9	0	0	0	0	110	P656	C654-P656 WeakPolarHBondContact O-CD 3.28Å
655	R	24.1	Very low	28.1	Very low	238 Å²	238	140.1 Å²	140.1	90%	0.898	72%	0.724	S	S	*	*			trans	-75.9	122.9	157.1	-81.6	-169.1	178.8	-169.7	-0.8	108
656	P	27.4	Very low	27.9	Very low	97 Å²	97	142 Å²	142	63%	0.63	75%	0.746	S	S	*	*			trans	-60.5	138	161	-15.2	30.4	0	0	0	108.8	C654 D658	C654-P656 WeakPolarHBondContact O-CD 3.28Å; P656-D658 PolarHBondContact O-N 3.4Å
657	L	25.5	Very low	27.7	Very low	180 Å²	180	144.5 Å²	144.5	94%	0.942	77%	0.765	S	S	*	*			trans	-71.4	79.3	171.8	-75.7	155.2	0	0	0	108.3	E659	L657-E659 PolarHBondContact O-N 3.34Å
658	D	30.2	Very low	27.6	Very low	138 Å²	138	148.2 Å²	148.2	74%	0.738	78%	0.778	S	S	*	*			trans	-78.9	103.4	172.4	-69	-21	0	0	0	108.8	P656	P656-D658 PolarHBondContact O-N 3.4Å
659	E	29.8	Very low	27.4	Very low	184 Å²	184	143.6 Å²	143.6	86%	0.86	77%	0.772	S	S	*	*			trans	39.9	86	142.1	-62.5	179.7	175.7	0	0	117	L657 E661	L657-E659 PolarHBondContact O-N 3.34Å; E659-E661 PolarHBondContact O-N 2.83Å
660	A	26	Very low	27.3	Very low	107 Å²	107	146.8 Å²	146.8	88%	0.884	78%	0.784	S	S	*	*			trans	-87.2	85.7	161.6	0	0	0	0	0	109.6
661	E	29.5	Very low	27.1	Very low	174 Å²	174	146.6 Å²	146.6	81%	0.813	79%	0.791	S	S	*	*			trans	-116.4	117.4	166.8	-74.8	-163.6	163.4	0	0	112.3	E659	E659-E661 PolarHBondContact O-N 2.83Å
662	S	25.9	Very low	27.1	Very low	112 Å²	112	148.7 Å²	148.7	78%	0.783	80%	0.797	S	S	*	*			trans	51.5	96.7	154	68.2	0	0	0	0	119.1
663	I	29.2	Very low	27.2	Very low	176 Å²	176	143.7 Å²	143.7	90%	0.903	80%	0.796	S	S	*	*			trans	-118.6	121.5	147	-61.8	178.2	0	0	0	108.1
664	D	28.9	Very low	27.2	Very low	137 Å²	137	145.4 Å²	145.4	73%	0.733	81%	0.806	S	S	*	*			trans	-65	149.1	-174.5	-152.5	-14.2	0	0	0	112.3	T666	D664-T666 PolarHBondContact O-N 3.43Å
665	S	24.7	Very low	27.5	Very low	107 Å²	107	146 Å²	146	75%	0.748	81%	0.809	S	S	*	*			trans	-58.3	113.4	176.8	28.2	0	0	0	0	112.6
666	T	29.5	Very low	27.9	Very low	126 Å²	126	139.4 Å²	139.4	77%	0.773	80%	0.799	S	S	*	*			trans	-142.7	121.3	156.4	-56.3	0	0	0	0	110.3	D664 L668	D664-T666 PolarHBondContact O-N 3.43Å; T666-L668 PolarHBondContact O-N 3.47Å
667	V	27.1	Very low	28.3	Very low	135 Å²	135	143.4 Å²	143.4	82%	0.818	81%	0.814	S	S	*	*			trans	-64.4	114.9	175.1	173.9	0	0	0	0	109.3
668	L	29	Very low	28.7	Very low	157 Å²	157	142.9 Å²	142.9	82%	0.822	81%	0.807	S	S	*	*			trans	-138.6	135.8	159.9	-77.1	177	0	0	0	111.5	T666	T666-L668 PolarHBondContact O-N 3.47Å
669	T	25.4	Very low	28.9	Very low	116 Å²	116	145.8 Å²	145.8	71%	0.712	81%	0.813	S	S	*	*			trans	-66.2	147.1	-175.6	43	0	0	0	0	115
670	E	24.8	Very low	29.6	Very low	177 Å²	177	146.1 Å²	146.1	83%	0.827	81%	0.814	S	S	*	*			trans	51.4	112	141	-66.4	-176.3	164.5	0	0	121.7
671	S	23.8	Very low	30.1	Very low	102 Å²	102	149.1 Å²	149.1	71%	0.713	81%	0.81	S	S	*	*			trans	86.3	133.6	131.5	83.3	0	0	0	0	120.8
672	K	29	Very low	31.2	Very low	212 Å²	212	145 Å²	145	92%	0.922	79%	0.793	S	S	*	*			trans	92.6	114.4	158.2	-58.4	-179	-179.5	176.7	0	118.3
673	G	29.8	Very low	33.1	Very low	73 Å²	73	142.5 Å²	142.5	75%	0.753	78%	0.776	S	S	*	*			trans	126.6	95.3	152	0	0	0	0	0	114.9
674	Q	26.9	Very low	35	Very low	194 Å²	194	139.7 Å²	139.7	91%	0.907	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-61.1	128.5	164.3	-100	157.3	-48.8	0	0	109.9	S676	Q674-S676 PolarHBondContact O-N 3.22Å
675	P	31.3	Very low	37.1	Very low	125 Å²	125	140.1 Å²	140.1	81%	0.812	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-75.9	118.6	178.4	28.5	-27.9	0	0	0	109.2	L677	P675-L677 PolarHBondContact O-N 2.78Å
676	S	32.2	Very low	39.2	Very low	98 Å²	98	141.5 Å²	141.5	69%	0.685	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-64.1	128.7	171.7	37.8	0	0	0	0	110.2	Q674 Q678	Q674-S676 PolarHBondContact O-N 3.22Å; S676-Q678 PolarHBondContact O-N 3.34Å
677	L	35.1	Very low	40.8	Very low	181 Å²	181	141.2 Å²	141.2	95%	0.948	74%	0.738	S	S	*	*			trans	-55.7	100.3	174.3	-82.9	111.8	0	0	0	110.7	P675 K679	P675-L677 PolarHBondContact O-N 2.78Å; L677-K679 PolarHBondContact O-N 3.32Å
678	Q	34.9	Very low	43.1	Very low	169 Å²	169	140.5 Å²	140.5	79%	0.79	73%	0.728	S	S	*	*			trans	-79.6	117.5	166.4	-66.6	-177.3	10.6	0	0	107.9	S676 E680	S676-Q678 PolarHBondContact O-N 3.34Å; Q678-E680 PolarHBondContact O-N 3.21Å
679	K	34.8	Very low	45.5	Very low	200 Å²	200	138 Å²	138	87%	0.87	72%	0.715	S	S	*	*			trans	-60.5	104.9	164.5	-79.2	172.2	172.9	175	0	106.5	L677 E681	L677-K679 PolarHBondContact O-N 3.32Å; K679-E681 PolarHBondContact O-N 3.41Å
680	E	43.6	Very low	47.7	Very low	190 Å²	190	137.2 Å²	137.2	89%	0.888	71%	0.706	S	S	*	*			trans	-60.3	105	171.7	-82.2	-179.7	152.5	0	0	108.4	Q678 L682	Q678-E680 PolarHBondContact O-N 3.21Å; E680-L682 PolarHBondContact O-N 2.76Å
681	E	37.6	Very low	49.9	Very low	170 Å²	170	136.9 Å²	136.9	79%	0.794	70%	0.698	S	S	*	*			trans	-61.8	123.7	169.3	-71.8	-174.2	149.2	0	0	107.8	K679 S683	K679-E681 PolarHBondContact O-N 3.41Å; E681-S683 PolarHBondContact O-N 2.82Å
682	L	52.1	Low	52.7	Low	88 Å²	88	136.6 Å²	136.6	46%	0.461	69%	0.685	S	S	.	*			trans	-48.4	110.6	173.8	-121.6	123.3	0	0	0	108.9	E680 D684 K686 R687 L690	E680-L682 PolarHBondContact O-N 2.76Å; L682-D684 PolarHBondContact O-N 3.48Å; L682-K686 HydrophobicContact CD2-CB 3.8Å; L682-R687 HydrophobicContact CB-CG 4.25Å; L682-R687 HydrophobicContact CD2-CG 4.1Å; L682-R687 PolarHBondContact O-NE 3.38Å; L682-R687 VanDerWaalsContact O-NE 3.07Å; L682-L690 HydrophobicContact CD2-CD1 4.03Å
683	S	66.5	Low	55	Low	60 Å²	60	129.7 Å²	129.7	42%	0.42	66%	0.66	S	S	.	*			trans	-46.4	137.9	177.6	170.4	0	0	0	0	110.2	E681 E685 K686 R687	E681-S683 PolarHBondContact O-N 2.82Å; S683-E685 PolarHBondContact O-N 3.06Å; S683-E685 VanDerWaalsContact O-N 3.07Å; S683-E685 PolarHBondContact OG-N 2.96Å; S683-K686 PolarHBondContact O-N 3.22Å; S683-R687 PolarHBondContact O-N 3.42Å; S683-R687 VanDerWaalsContact O-N 3.15Å
684	D	68	Low	57	Low	117 Å²	117	132.3 Å²	132.3	63%	0.626	65%	0.653	S	S	*	*	H	α-helix	trans	-54.1	-29.4	179	-75.7	-31.9	0	0	0	112.1	L682 R687 L688	L682-D684 PolarHBondContact O-N 3.48Å; D684-R687 PolarHBondContact O-N 3.26Å; D684-L688 WeakPolarHBondContact O-CB 3.29Å; D684-L688 PolarHBondContact O-N 3Å
685	E	72.6	Confident	59.4	Low	145 Å²	145	126.8 Å²	126.8	68%	0.678	63%	0.632	S	S	*	*	H	α-helix	trans	-64	-45.1	173.7	-64.4	-178.6	164.8	0	0	112.7	S683 R687 L688 L689	S683-E685 PolarHBondContact O-N 3.06Å; S683-E685 VanDerWaalsContact O-N 3.07Å; S683-E685 PolarHBondContact OG-N 2.96Å; E685-R687 VanDerWaalsContact C-N 3.32Å; E685-R687 PolarHBondContact O-N 3.1Å; E685-L688 WeakPolarHBondContact O-CB 3.42Å; E685-L688 PolarHBondContact O-N 3.3Å; E685-L689 WeakPolarHBondContact O-CG 3.5Å; E685-L689 PolarHBondContact O-N 3.28Å
686	K	68.5	Low	61.7	Low	137 Å²	137	126.2 Å²	126.2	60%	0.596	62%	0.617	S	S	*	*	H	α-helix	trans	-65.6	-36.8	176.5	-78	-173.1	177.7	177.1	0	111.2	L682 S683 L688 L689 L690	L682-K686 HydrophobicContact CD2-CB 3.8Å; S683-K686 PolarHBondContact O-N 3.22Å; K686-L688 VanDerWaalsContact C-N 3.33Å; K686-L689 PolarHBondContact O-N 3.26Å; K686-L690 WeakPolarHBondContact O-CB 3.47Å; K686-L690 WeakPolarHBondContact O-CG 3.37Å; K686-L690 PolarHBondContact O-N 3.36Å
687	R	64.3	Low	63.8	Low	120 Å²	120	122 Å²	122	45%	0.453	59%	0.588	S	S	.	*	H	α-helix	trans	-64.9	-38.7	174.7	-64.2	179.2	-178.8	-161.9	-3.8	111.5	L682 S683 D684 E685 R691	L682-R687 HydrophobicContact CB-CG 4.25Å; L682-R687 HydrophobicContact CD2-CG 4.1Å; L682-R687 PolarHBondContact O-NE 3.38Å; L682-R687 VanDerWaalsContact O-NE 3.07Å; S683-R687 PolarHBondContact O-N 3.42Å; S683-R687 VanDerWaalsContact O-N 3.15Å; D684-R687 PolarHBondContact O-N 3.26Å; E685-R687 VanDerWaalsContact C-N 3.32Å; E685-R687 PolarHBondContact O-N 3.1Å; R687-R691 WeakPolarHBondContact O-CG 3.47Å; R687-R691 PolarHBondContact O-N 2.98Å
688	L	75	Confident	65.6	Low	119 Å²	119	117 Å²	117	62%	0.623	56%	0.564	S	S	*	*	H	α-helix	trans	-64.8	-46.6	174.9	-101.4	152.1	0	0	0	111.9	D684 E685 K686 R691 E692	D684-L688 WeakPolarHBondContact O-CB 3.29Å; D684-L688 PolarHBondContact O-N 3Å; E685-L688 WeakPolarHBondContact O-CB 3.42Å; E685-L688 PolarHBondContact O-N 3.3Å; K686-L688 VanDerWaalsContact C-N 3.33Å; L688-R691 WeakPolarHBondContact O-CB 3.36Å; L688-R691 PolarHBondContact O-N 3.1Å; L688-E692 PolarHBondContact O-N 2.96Å
689	L	80	Confident	67.5	Low	105 Å²	105	113.9 Å²	113.9	55%	0.55	55%	0.55	S	S	.	.	H	α-helix	trans	-61.9	-44.4	177.2	-74.2	167.2	0	0	0	112.2	E685 K686 R691 E692 V693	E685-L689 WeakPolarHBondContact O-CG 3.5Å; E685-L689 PolarHBondContact O-N 3.28Å; K686-L689 PolarHBondContact O-N 3.26Å; L689-R691 VanDerWaalsContact C-N 3.33Å; L689-R691 PolarHBondContact O-N 3.04Å; L689-E692 WeakPolarHBondContact O-CB 3.41Å; L689-E692 PolarHBondContact O-N 3.45Å; L689-E692 VanDerWaalsContact O-N 3.16Å; L689-V693 WeakPolarHBondContact O-CG2 3.49Å; L689-V693 PolarHBondContact O-N 3.4Å
690	L	70.3	Confident	69.6	Low	99 Å²	99	107.2 Å²	107.2	52%	0.518	52%	0.519	S	S	.	.	H	α-helix	trans	-60.3	-43	175.6	-78.6	164.7	0	0	0	111.6	L682 K686 E692 V693 E694	L682-L690 HydrophobicContact CD2-CD1 4.03Å; K686-L690 WeakPolarHBondContact O-CB 3.47Å; K686-L690 WeakPolarHBondContact O-CG 3.37Å; K686-L690 PolarHBondContact O-N 3.36Å; L690-E692 VanDerWaalsContact C-N 3.33Å; L690-E692 PolarHBondContact O-N 3.11Å; L690-V693 PolarHBondContact O-N 2.97Å; L690-E694 WeakPolarHBondContact O-CG 3.42Å; L690-E694 PolarHBondContact O-N 2.91Å
691	R	71.1	Confident	71.2	Confident	171 Å²	171	100.4 Å²	100.4	65%	0.645	49%	0.488	S	S	*	.	H	α-helix	trans	-61.9	-40.6	174	-76.7	177.3	-178.5	-176.7	2.5	111.9	R687 L688 L689 E694 V695	R687-R691 WeakPolarHBondContact O-CG 3.47Å; R687-R691 PolarHBondContact O-N 2.98Å; L688-R691 WeakPolarHBondContact O-CB 3.36Å; L688-R691 PolarHBondContact O-N 3.1Å; L689-R691 VanDerWaalsContact C-N 3.33Å; L689-R691 PolarHBondContact O-N 3.04Å; R691-E694 PolarHBondContact O-N 3.31Å; R691-V695 VanDerWaalsContact O-CG2 3.28Å; R691-V695 WeakPolarHBondContact O-CG2 3.28Å; R691-V695 PolarHBondContact O-N 2.94Å
692	E	82.3	Confident	72.9	Confident	96 Å²	96	96.7 Å²	96.7	45%	0.449	47%	0.473	S	S	.	.	H	α-helix	trans	-64.4	-41.1	179	-159.1	-168.5	151.8	0	0	111.8	L688 L689 L690 V695 K696	L688-E692 PolarHBondContact O-N 2.96Å; L689-E692 WeakPolarHBondContact O-CB 3.41Å; L689-E692 PolarHBondContact O-N 3.45Å; L689-E692 VanDerWaalsContact O-N 3.16Å; L690-E692 VanDerWaalsContact C-N 3.33Å; L690-E692 PolarHBondContact O-N 3.11Å; E692-V695 PolarHBondContact O-N 3.22Å; E692-K696 WeakPolarHBondContact O-CG 3.3Å; E692-K696 PolarHBondContact O-N 3.47Å; E692-K696 WeakPolarHBondContact OE1-CE 3.2Å; E692-K696 IonicContact OE1-NZ 3.59Å; E692-K696 PolarHBondContact OE1-NZ 3.26Å
693	V	77.6	Confident	74.1	Confident	67 Å²	67	96.5 Å²	96.5	41%	0.406	47%	0.47	S	S	.	.	H	α-helix	trans	-62.7	-46.9	173.1	174	0	0	0	0	110.6	L689 L690 V695 K696 V697	L689-V693 WeakPolarHBondContact O-CG2 3.49Å; L689-V693 PolarHBondContact O-N 3.4Å; L690-V693 PolarHBondContact O-N 2.97Å; V693-V695 VanDerWaalsContact C-N 3.34Å; V693-V695 PolarHBondContact O-N 3.36Å; V693-K696 PolarHBondContact O-N 3.16Å; V693-V697 HydrophobicContact CG1-CG2 4.35Å; V693-V697 VanDerWaalsContact O-CG2 3.29Å; V693-V697 WeakPolarHBondContact O-CG2 3.26Å; V693-V697 PolarHBondContact O-N 3.45Å
694	E	73.2	Confident	74.4	Confident	127 Å²	127	93.7 Å²	93.7	59%	0.593	45%	0.45	S	S	*	.	H	α-helix	trans	-57.5	-44.6	176.7	-75.5	177.6	166.9	0	0	112	L690 R691 V697 V698	L690-E694 WeakPolarHBondContact O-CG 3.42Å; L690-E694 PolarHBondContact O-N 2.91Å; R691-E694 PolarHBondContact O-N 3.31Å; E694-V697 PolarHBondContact O-N 2.89Å; E694-V698 WeakPolarHBondContact O-CG2 3.46Å; E694-V698 PolarHBondContact O-N 2.8Å
695	V	75.6	Confident	74.8	Confident	79 Å²	79	93.1 Å²	93.1	48%	0.479	44%	0.444	S	S	.	.	H	α-helix	trans	-62.4	-45.1	176.9	173.4	0	0	0	0	111.4	R691 E692 V693 V697 V698 Q699	R691-V695 VanDerWaalsContact O-CG2 3.28Å; R691-V695 WeakPolarHBondContact O-CG2 3.28Å; R691-V695 PolarHBondContact O-N 2.94Å; E692-V695 PolarHBondContact O-N 3.22Å; V693-V695 VanDerWaalsContact C-N 3.34Å; V693-V695 PolarHBondContact O-N 3.36Å; V695-V697 VanDerWaalsContact C-N 3.32Å; V695-V697 PolarHBondContact O-N 3.29Å; V695-V698 PolarHBondContact O-N 3.35Å; V695-Q699 HydrophobicContact CG1-CG 4.41Å; V695-Q699 WeakPolarHBondContact O-CG 3.21Å; V695-Q699 PolarHBondContact O-N 2.87Å
696	K	80.4	Confident	75.1	Confident	112 Å²	112	89.9 Å²	89.9	49%	0.487	44%	0.437	S	S	.	.	H	α-helix	trans	-62	-40.3	178.3	-75.6	175.1	-175.8	164.3	0	112	E692 V693 Q699 Y700	E692-K696 WeakPolarHBondContact O-CG 3.3Å; E692-K696 PolarHBondContact O-N 3.47Å; E692-K696 WeakPolarHBondContact OE1-CE 3.2Å; E692-K696 IonicContact OE1-NZ 3.59Å; E692-K696 PolarHBondContact OE1-NZ 3.26Å; V693-K696 PolarHBondContact O-N 3.16Å; K696-Q699 PolarHBondContact O-N 2.91Å; K696-Y700 WeakPolarHBondContact O-CB 3.22Å; K696-Y700 PolarHBondContact O-N 2.87Å
697	V	75.2	Confident	75.4	Confident	11 Å²	11	86 Å²	86	7%	0.067	44%	0.435	C	S	.	.	H	α-helix	trans	-65.2	-40.6	177.5	170.4	0	0	0	0	111.5	V693 E694 V695 Y700 Q701 K721 M725	V693-V697 HydrophobicContact CG1-CG2 4.35Å; V693-V697 VanDerWaalsContact O-CG2 3.29Å; V693-V697 WeakPolarHBondContact O-CG2 3.26Å; V693-V697 PolarHBondContact O-N 3.45Å; E694-V697 PolarHBondContact O-N 2.89Å; V695-V697 VanDerWaalsContact C-N 3.32Å; V695-V697 PolarHBondContact O-N 3.29Å; V697-Y700 PolarHBondContact O-N 2.81Å; V697-Q701 PolarHBondContact O-N 3.01Å; V697-K721 HydrophobicContact CG1-CD 4.22Å; V697-K721 HydrophobicContact CG1-CG 3.7Å; V697-M725 HydrophobicContact CG2-CB 4.05Å; V697-M725 HydrophobicContact CG2-CG 4.17Å
698	V	73.8	Confident	75.9	Confident	74 Å²	74	86.7 Å²	86.7	45%	0.448	45%	0.448	S	S	.	.	H	α-helix	trans	-66.8	-43.5	175.7	173.6	0	0	0	0	111.2	E694 V695 Y700 Q701 D702	E694-V698 WeakPolarHBondContact O-CG2 3.46Å; E694-V698 PolarHBondContact O-N 2.8Å; V695-V698 PolarHBondContact O-N 3.35Å; V698-Y700 VanDerWaalsContact C-N 3.32Å; V698-Y700 PolarHBondContact O-N 3.07Å; V698-Q701 WeakPolarHBondContact O-CB 3.48Å; V698-Q701 PolarHBondContact O-N 3.29Å; V698-Q701 VanDerWaalsContact O-N 3.15Å; V698-D702 PolarHBondContact O-N 3.49Å
699	Q	75.7	Confident	76	Confident	105 Å²	105	83.2 Å²	83.2	49%	0.491	43%	0.43	S	S	.	.	H	α-helix	trans	-60.6	-41.3	176	-73.7	177	-2.8	0	0	112.3	V695 K696 Q701 D702 Q703	V695-Q699 HydrophobicContact CG1-CG 4.41Å; V695-Q699 WeakPolarHBondContact O-CG 3.21Å; V695-Q699 PolarHBondContact O-N 2.87Å; K696-Q699 PolarHBondContact O-N 2.91Å; Q699-Q701 VanDerWaalsContact C-N 3.33Å; Q699-D702 PolarHBondContact O-N 3.23Å; Q699-Q703 VanDerWaalsContact O-CG 3.28Å; Q699-Q703 WeakPolarHBondContact O-CG 3.4Å; Q699-Q703 PolarHBondContact O-N 2.98Å
700	Y	79	Confident	76	Confident	59 Å²	59	87.4 Å²	87.4	23%	0.231	44%	0.444	C	S	.	.	H	α-helix	trans	-63.9	-39.6	175.5	-174.5	-99.3	0	0	0	111.8	K696 V697 V698 Q703 L704 I709 Q720 V724	K696-Y700 WeakPolarHBondContact O-CB 3.22Å; K696-Y700 PolarHBondContact O-N 2.87Å; V697-Y700 PolarHBondContact O-N 2.81Å; V698-Y700 VanDerWaalsContact C-N 3.32Å; V698-Y700 PolarHBondContact O-N 3.07Å; Y700-Q703 PolarHBondContact O-N 3.11Å; Y700-L704 HydrophobicContact CD1-CD1 3.75Å; Y700-L704 HydrophobicContact CD1-CG 4.35Å; Y700-L704 HydrophobicContact CE1-CD1 3.29Å; Y700-L704 HydrophobicContact CE1-CG 3.95Å; Y700-L704 PolarHBondContact O-N 3.23Å; Y700-I709 HydrophobicContact CD2-CD1 3.79Å; Y700-I709 HydrophobicContact CE2-CD1 3.63Å; Y700-Q720 HydrophobicContact CE1-CB 4.46Å; Y700-V724 HydrophobicContact CD1-CB 4.2Å; Y700-V724 HydrophobicContact CD1-CG1 4.25Å; Y700-V724 HydrophobicContact CD1-CG2 3.82Å; Y700-V724 HydrophobicContact CD2-CG1 4.49Å; Y700-V724 HydrophobicContact CD2-CG2 4.34Å; Y700-V724 HydrophobicContact CE1-CB 4.33Å; Y700-V724 HydrophobicContact CE1-CG2 3.51Å; Y700-V724 HydrophobicContact CE2-CG2 4.07Å; Y700-V724 HydrophobicContact CG-CG1 4.12Å; Y700-V724 HydrophobicContact CG-CG2 4.22Å
701	Q	76.3	Confident	76.3	Confident	48 Å²	48	89.5 Å²	89.5	22%	0.224	45%	0.445	C	S	.	.	H	α-helix	trans	-62.1	-47.6	174.5	-176.9	177.2	-17.3	0	0	111.7	V697 V698 Q699 Q703 L704 E705	V697-Q701 PolarHBondContact O-N 3.01Å; V698-Q701 WeakPolarHBondContact O-CB 3.48Å; V698-Q701 PolarHBondContact O-N 3.29Å; V698-Q701 VanDerWaalsContact O-N 3.15Å; Q699-Q701 VanDerWaalsContact C-N 3.33Å; Q701-Q703 VanDerWaalsContact C-N 3.26Å; Q701-Q703 PolarHBondContact O-N 2.72Å; Q701-L704 PolarHBondContact O-N 3.29Å; Q701-L704 VanDerWaalsContact O-N 3.12Å; Q701-E705 HydrophobicContact CG-CG 4.44Å; Q701-E705 WeakPolarHBondContact CG-OE1 3.46Å; Q701-E705 PolarHBondContact NE2-OE1 3.49Å; Q701-E705 WeakPolarHBondContact O-CG 3.41Å; Q701-E705 PolarHBondContact O-N 2.82Å
702	D	73.4	Confident	76.6	Confident	92 Å²	92	87.6 Å²	87.6	49%	0.492	44%	0.443	S	S	.	.	H	α-helix	trans	-60.6	-36.6	176.7	-75.3	-12.1	0	0	0	111.8	V698 Q699 E705 S706	V698-D702 PolarHBondContact O-N 3.49Å; Q699-D702 PolarHBondContact O-N 3.23Å; D702-E705 PolarHBondContact O-N 3.05Å; D702-S706 VanDerWaalsContact O-CB 3.22Å; D702-S706 WeakPolarHBondContact O-CB 3.46Å; D702-S706 PolarHBondContact O-N 3.41Å; D702-S706 PolarHBondContact O-OG 3.25Å
703	Q	77.1	Confident	76.3	Confident	83 Å²	83	93.2 Å²	93.2	39%	0.388	47%	0.466	S	S	.	.	H	α-helix	trans	-69.6	-33.5	175.8	-72	176.7	13.6	0	0	113.1	Q699 Y700 Q701 S706 G707 N708 I709	Q699-Q703 VanDerWaalsContact O-CG 3.28Å; Q699-Q703 WeakPolarHBondContact O-CG 3.4Å; Q699-Q703 PolarHBondContact O-N 2.98Å; Y700-Q703 PolarHBondContact O-N 3.11Å; Q701-Q703 VanDerWaalsContact C-N 3.26Å; Q701-Q703 PolarHBondContact O-N 2.72Å; Q703-S706 WeakPolarHBondContact CA-OG 3.39Å; Q703-S706 PolarHBondContact O-OG 2.96Å; Q703-G707 PolarHBondContact O-N 3.28Å; Q703-N708 HydrophobicContact CB-CB 4.48Å; Q703-N708 PolarHBondContact O-N 3.03Å; Q703-I709 HydrophobicContact CB-CD1 3.7Å; Q703-I709 HydrophobicContact CB-CG1 3.94Å; Q703-I709 PolarHBondContact O-N 3.43Å
704	L	73.7	Confident	76.2	Confident	2 Å²	2	94 Å²	94	1%	0.01	49%	0.488	C	S	.	.	H	α-helix	trans	-73.5	-34.2	172.7	-81.9	174.4	0	0	0	113.1	Y700 Q701 I709 R711 Q720	Y700-L704 HydrophobicContact CD1-CD1 3.75Å; Y700-L704 HydrophobicContact CD1-CG 4.35Å; Y700-L704 HydrophobicContact CE1-CD1 3.29Å; Y700-L704 HydrophobicContact CE1-CG 3.95Å; Y700-L704 PolarHBondContact O-N 3.23Å; Q701-L704 PolarHBondContact O-N 3.29Å; Q701-L704 VanDerWaalsContact O-N 3.12Å; L704-I709 HydrophobicContact CD2-CB 4.04Å; L704-I709 HydrophobicContact CD2-CG2 3.66Å; L704-I709 HydrophobicContact CG-CB 4.45Å; L704-I709 HydrophobicContact CG-CG2 4.37Å; L704-R711 HydrophobicContact CD2-CG 4.18Å; L704-Q720 HydrophobicContact CD1-CB 4.2Å
705	E	75.7	Confident	76.2	Confident	105 Å²	105	91 Å²	91	49%	0.491	48%	0.476	S	S	.	.	H	α-helix	trans	-79.4	-39.3	179.9	-72.3	-177.6	-166.3	0	0	112.2	Q701 D702 G707	Q701-E705 HydrophobicContact CG-CG 4.44Å; Q701-E705 WeakPolarHBondContact CG-OE1 3.46Å; Q701-E705 PolarHBondContact NE2-OE1 3.49Å; Q701-E705 WeakPolarHBondContact O-CG 3.41Å; Q701-E705 PolarHBondContact O-N 2.82Å; D702-E705 PolarHBondContact O-N 3.05Å; E705-G707 PolarHBondContact O-N 3.15Å
706	S	78	Confident	76.3	Confident	77 Å²	77	89.9 Å²	89.9	54%	0.538	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-14.8	172.7	57.6	0	0	0	0	113.7	D702 Q703 N708	D702-S706 VanDerWaalsContact O-CB 3.22Å; D702-S706 WeakPolarHBondContact O-CB 3.46Å; D702-S706 PolarHBondContact O-N 3.41Å; D702-S706 PolarHBondContact O-OG 3.25Å; Q703-S706 WeakPolarHBondContact CA-OG 3.39Å; Q703-S706 PolarHBondContact O-OG 2.96Å; S706-N708 VanDerWaalsContact C-N 3.33Å
707	G	75.2	Confident	75.8	Confident	54 Å²	54	87.1 Å²	87.1	56%	0.557	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	9.7	-178.2	0	0	0	0	0	114.4	Q703 E705 I709	Q703-G707 PolarHBondContact O-N 3.28Å; E705-G707 PolarHBondContact O-N 3.15Å; G707-I709 VanDerWaalsContact C-N 3.29Å
708	N	75.7	Confident	75.7	Confident	136 Å²	136	89.6 Å²	89.6	73%	0.727	48%	0.483	S	S	*	.	S	Bend	trans	-66.1	-32.6	172.8	-78.1	-21.2	0	0	0	112	Q703 S706	Q703-N708 HydrophobicContact CB-CB 4.48Å; Q703-N708 PolarHBondContact O-N 3.03Å; S706-N708 VanDerWaalsContact C-N 3.33Å
709	I	77.9	Confident	75.8	Confident	46 Å²	46	90.9 Å²	90.9	24%	0.236	48%	0.484	C	S	.	.	S	Bend	trans	-105.9	131.2	171.8	-66.6	177.4	0	0	0	109.5	Y700 Q703 L704 G707	Y700-I709 HydrophobicContact CD2-CD1 3.79Å; Y700-I709 HydrophobicContact CE2-CD1 3.63Å; Q703-I709 HydrophobicContact CB-CD1 3.7Å; Q703-I709 HydrophobicContact CB-CG1 3.94Å; Q703-I709 PolarHBondContact O-N 3.43Å; L704-I709 HydrophobicContact CD2-CB 4.04Å; L704-I709 HydrophobicContact CD2-CG2 3.66Å; L704-I709 HydrophobicContact CG-CB 4.45Å; L704-I709 HydrophobicContact CG-CG2 4.37Å; G707-I709 VanDerWaalsContact C-N 3.29Å
710	K	79.5	Confident	75.8	Confident	193 Å²	193	86.3 Å²	86.3	84%	0.839	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-72.9	131.5	173.7	-70.8	-174.4	-179.9	176.8	0	110.2	E712	K710-E712 PolarHBondContact O-N 3.37Å
711	R	76.3	Confident	75.5	Confident	142 Å²	142	86.6 Å²	86.6	54%	0.536	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-67.6	129	172.9	-60.8	178.2	-173.1	176.3	1.9	109.8	L704	L704-R711 HydrophobicContact CD2-CG 4.18Å
712	E	78	Confident	75.3	Confident	132 Å²	132	87.6 Å²	87.6	62%	0.617	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-63.6	141.6	169	-64.2	-161.8	149.4	0	0	111.5	K710 G714 L715	K710-E712 PolarHBondContact O-N 3.37Å; E712-G714 PolarHBondContact O-N 3.4Å; E712-L715 HydrophobicContact CB-CD1 4.14Å; E712-L715 WeakPolarHBondContact OE2-CD1 3.41Å
713	K	75.1	Confident	75.3	Confident	213 Å²	213	91.1 Å²	91.1	93%	0.926	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	121.7	179.8	-70.1	-177.2	178	179.6	0	109.8
714	G	76.1	Confident	75.2	Confident	84 Å²	84	90.1 Å²	90.1	87%	0.866	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.5	-6.3	172.2	0	0	0	0	0	115.5	E712	E712-G714 PolarHBondContact O-N 3.4Å
715	L	72.9	Confident	75	Confident	65 Å²	65	94.8 Å²	94.8	34%	0.34	51%	0.508	S	S	.	.			trans	-107.6	137.6	177.2	-73.9	155.8	0	0	0	111	E712 E719 Q720	E712-L715 HydrophobicContact CB-CD1 4.14Å; E712-L715 WeakPolarHBondContact OE2-CD1 3.41Å; L715-E719 HydrophobicContact CD2-CB 3.71Å; L715-Q720 HydrophobicContact CB-CG 3.95Å; L715-Q720 HydrophobicContact CD1-CG 4.22Å
716	S	77.2	Confident	74.7	Confident	54 Å²	54	100.7 Å²	100.7	38%	0.378	53%	0.532	S	S	.	.			trans	-74.3	159.9	168.5	69.2	0	0	0	0	111.4	A718 E719 Q720	S716-A718 PolarHBondContact O-N 3.43Å; S716-E719 WeakPolarHBondContact CB-OE2 3.38Å; S716-E719 PolarHBondContact N-OE2 2.87Å; S716-E719 PolarHBondContact O-N 3.03Å; S716-E719 VanDerWaalsContact O-N 3.1Å; S716-E719 VanDerWaalsContact OG-CD 3.28Å; S716-E719 VanDerWaalsContact OG-CG 3.28Å; S716-E719 WeakPolarHBondContact OG-CG 3.33Å; S716-E719 PolarHBondContact OG-N 2.73Å; S716-E719 PolarHBondContact OG-OE2 3.46Å; S716-Q720 PolarHBondContact O-N 2.89Å
717	I	69.5	Low	74.6	Confident	54 Å²	54	101.9 Å²	101.9	28%	0.277	53%	0.532	S	S	.	.	H	α-helix	trans	-57	-38	176.3	-61.4	170	0	0	0	110.7	K721	I717-K721 VanDerWaalsContact O-CB 3.28Å; I717-K721 WeakPolarHBondContact O-CB 3.42Å; I717-K721 PolarHBondContact O-N 3.12Å
718	A	73	Confident	74.5	Confident	64 Å²	64	104.4 Å²	104.4	53%	0.529	53%	0.531	S	S	.	.	H	α-helix	trans	-65	-41.7	177.9	0	0	0	0	0	111.9	S716 K721 T722	S716-A718 PolarHBondContact O-N 3.43Å; A718-K721 WeakPolarHBondContact O-CB 3.22Å; A718-K721 PolarHBondContact O-N 2.99Å; A718-T722 PolarHBondContact O-N 3.33Å; A718-T722 PolarHBondContact O-OG1 3.01Å; A718-T722 VanDerWaalsContact O-OG1 3.04Å
719	E	76	Confident	74.5	Confident	101 Å²	101	102.6 Å²	102.6	47%	0.472	52%	0.52	S	S	.	.	H	α-helix	trans	-68.8	-43.5	179.4	-71.1	161.1	147.1	0	0	112.1	L715 S716 K721 T722 F723	L715-E719 HydrophobicContact CD2-CB 3.71Å; S716-E719 WeakPolarHBondContact CB-OE2 3.38Å; S716-E719 PolarHBondContact N-OE2 2.87Å; S716-E719 PolarHBondContact O-N 3.03Å; S716-E719 VanDerWaalsContact O-N 3.1Å; S716-E719 VanDerWaalsContact OG-CD 3.28Å; S716-E719 VanDerWaalsContact OG-CG 3.28Å; S716-E719 WeakPolarHBondContact OG-CG 3.33Å; S716-E719 PolarHBondContact OG-N 2.73Å; S716-E719 PolarHBondContact OG-OE2 3.46Å; E719-K721 VanDerWaalsContact C-N 3.29Å; E719-K721 PolarHBondContact O-N 2.94Å; E719-T722 PolarHBondContact O-N 3.5Å; E719-F723 PolarHBondContact O-N 3.31Å
720	Q	76	Confident	74.3	Confident	8 Å²	8	105.9 Å²	105.9	4%	0.037	54%	0.537	C	S	.	.	H	α-helix	trans	-61.6	-39.1	173.9	-83.2	168.3	16.1	0	0	111.7	Y700 L704 L715 S716 F723 V724	Y700-Q720 HydrophobicContact CE1-CB 4.46Å; L704-Q720 HydrophobicContact CD1-CB 4.2Å; L715-Q720 HydrophobicContact CB-CG 3.95Å; L715-Q720 HydrophobicContact CD1-CG 4.22Å; S716-Q720 PolarHBondContact O-N 2.89Å; Q720-F723 PolarHBondContact O-N 2.69Å; Q720-V724 WeakPolarHBondContact O-CG2 3.44Å; Q720-V724 PolarHBondContact O-N 3.39Å; Q720-V724 VanDerWaalsContact O-N 3.11Å
721	K	72.4	Confident	74	Confident	66 Å²	66	100.5 Å²	100.5	29%	0.287	52%	0.518	S	S	.	.	H	α-helix	trans	-60.3	-45.6	174	-179.3	-179.3	179.2	161.7	0	111.8	V697 I717 A718 E719 F723 V724 M725	V697-K721 HydrophobicContact CG1-CD 4.22Å; V697-K721 HydrophobicContact CG1-CG 3.7Å; I717-K721 VanDerWaalsContact O-CB 3.28Å; I717-K721 WeakPolarHBondContact O-CB 3.42Å; I717-K721 PolarHBondContact O-N 3.12Å; A718-K721 WeakPolarHBondContact O-CB 3.22Å; A718-K721 PolarHBondContact O-N 2.99Å; E719-K721 VanDerWaalsContact C-N 3.29Å; E719-K721 PolarHBondContact O-N 2.94Å; K721-F723 VanDerWaalsContact C-N 3.3Å; K721-F723 PolarHBondContact O-N 2.93Å; K721-V724 PolarHBondContact O-N 3Å; K721-M725 HydrophobicContact CG-CE 4.45Å; K721-M725 WeakPolarHBondContact O-CB 3.28Å; K721-M725 PolarHBondContact O-N 3.04Å
722	T	72.2	Confident	73.8	Confident	69 Å²	69	97.7 Å²	97.7	42%	0.423	52%	0.516	S	S	.	.	H	α-helix	trans	-64	-37.4	177.4	-56.3	0	0	0	0	111.6	A718 E719 V724 M725 F726	A718-T722 PolarHBondContact O-N 3.33Å; A718-T722 PolarHBondContact O-OG1 3.01Å; A718-T722 VanDerWaalsContact O-OG1 3.04Å; E719-T722 PolarHBondContact O-N 3.5Å; T722-V724 VanDerWaalsContact C-N 3.32Å; T722-V724 PolarHBondContact O-N 3.42Å; T722-M725 PolarHBondContact O-N 3.29Å; T722-F726 HydrophobicContact CG2-CD2 4.4Å; T722-F726 PolarHBondContact O-N 3.33Å; T722-F726 VanDerWaalsContact O-N 3.1Å
723	F	74.7	Confident	73.5	Confident	166 Å²	166	95.3 Å²	95.3	73%	0.728	51%	0.509	S	S	*	.	H	α-helix	trans	-68.4	-28.2	179	-139.5	-82.6	0	0	0	113.6	E719 Q720 K721 F726	E719-F723 PolarHBondContact O-N 3.31Å; Q720-F723 PolarHBondContact O-N 2.69Å; K721-F723 VanDerWaalsContact C-N 3.3Å; K721-F723 PolarHBondContact O-N 2.93Å; F723-F726 VanDerWaalsContact O-OXT 3.11Å
724	V	74	Confident	73.4	Confident	61 Å²	61	86.2 Å²	86.2	37%	0.37	48%	0.477	S	S	.	.	H	α-helix	trans	-85.9	-24.4	174.9	172.7	0	0	0	0	112.4	Y700 Q720 K721 T722	Y700-V724 HydrophobicContact CD1-CB 4.2Å; Y700-V724 HydrophobicContact CD1-CG1 4.25Å; Y700-V724 HydrophobicContact CD1-CG2 3.82Å; Y700-V724 HydrophobicContact CD2-CG1 4.49Å; Y700-V724 HydrophobicContact CD2-CG2 4.34Å; Y700-V724 HydrophobicContact CE1-CB 4.33Å; Y700-V724 HydrophobicContact CE1-CG2 3.51Å; Y700-V724 HydrophobicContact CE2-CG2 4.07Å; Y700-V724 HydrophobicContact CG-CG1 4.12Å; Y700-V724 HydrophobicContact CG-CG2 4.22Å; Q720-V724 WeakPolarHBondContact O-CG2 3.44Å; Q720-V724 PolarHBondContact O-N 3.39Å; Q720-V724 VanDerWaalsContact O-N 3.11Å; K721-V724 PolarHBondContact O-N 3Å; T722-V724 VanDerWaalsContact C-N 3.32Å; T722-V724 PolarHBondContact O-N 3.42Å
725	M	69.4	Low	73.2	Confident	100 Å²	100	86.4 Å²	86.4	49%	0.493	45%	0.445	S	S	.	.	H	α-helix	trans	-74.6	-33.1	175.6	-167	-169.9	-42.9	0	0	112.1	V697 K721 T722	V697-M725 HydrophobicContact CG2-CB 4.05Å; V697-M725 HydrophobicContact CG2-CG 4.17Å; K721-M725 HydrophobicContact CG-CE 4.45Å; K721-M725 WeakPolarHBondContact O-CB 3.28Å; K721-M725 PolarHBondContact O-N 3.04Å; T722-M725 PolarHBondContact O-N 3.29Å
726	F	70.7	Confident	73.2	Confident	229 Å²	229	88.4 Å²	88.4	100%	1.004	45%	0.454	S	S	*	.			trans	-75	0	166.5	-102.8	-80	0	0	0	110.6	T722 F723	T722-F726 HydrophobicContact CG2-CD2 4.4Å; T722-F726 PolarHBondContact O-N 3.33Å; T722-F726 VanDerWaalsContact O-N 3.1Å; F723-F726 VanDerWaalsContact O-OXT 3.11Å

Retrieved 726 of 726 residues in 547.1 ms (Link to these results)

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