G4VAI1_SCHMA Loading...

Putative smad

AlphaFold DB , UniProt , Accession G4VAI1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 559 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.2	Very low	34	Very low	248 Å²	248	149.2 Å²	149.2	100%	1.222	82%	0.816	S	S	*	*				0	167.4	0	-74	89	172.6	0	0	110.1
2	K	33.8	Very low	34.1	Very low	175 Å²	175	152 Å²	152	76%	0.761	83%	0.828	S	S	*	*			trans	-149.1	150.5	-171.9	-123.3	171.6	172.2	-176.9	0	105.7
3	F	41.6	Very low	33.6	Very low	169 Å²	169	146.6 Å²	146.6	74%	0.741	83%	0.829	S	S	*	*			cis	-132.4	168	22.7	-100.2	-92.3	0	0	0	113.5
4	N	29.5	Very low	33.5	Very low	140 Å²	140	144.2 Å²	144.2	75%	0.749	83%	0.826	S	S	*	*			trans	-115.8	179.5	163	-154.4	-2.8	0	0	0	107.8
5	Q	35.8	Very low	33.2	Very low	165 Å²	165	145.9 Å²	145.9	77%	0.771	83%	0.83	S	S	*	*			trans	86.7	146	178	-57.1	177.6	-73.3	0	0	116.7
6	T	32.5	Very low	32.8	Very low	115 Å²	115	143.8 Å²	143.8	71%	0.706	83%	0.827	S	S	*	*			cis	171.3	144.1	-44	32.2	0	0	0	0	108.4
7	S	33.3	Very low	32.6	Very low	97 Å²	97	142.5 Å²	142.5	68%	0.678	82%	0.822	S	S	*	*			trans	65.3	125	155.5	-163.2	0	0	0	0	118.9
8	V	37.7	Very low	32.2	Very low	143 Å²	143	141 Å²	141	87%	0.867	82%	0.821	S	S	*	*				-160	141.2	97.7	-89.1	0	0	0	0	110.5
9	D	28.5	Very low	32	Very low	147 Å²	147	138.8 Å²	138.8	79%	0.786	82%	0.815	S	S	*	*			trans	-82.2	162.1	177	-65.3	-73.5	0	0	0	113.2
10	S	35	Very low	31.7	Very low	131 Å²	131	137.1 Å²	137.1	92%	0.916	82%	0.817	S	S	*	*			trans	-157.1	108.9	148.8	-81	0	0	0	0	110.6
11	S	29.6	Very low	31.6	Very low	111 Å²	111	135.8 Å²	135.8	78%	0.776	81%	0.81	S	S	*	*			trans	-94.1	131	-178.7	57	0	0	0	0	112.5
12	L	34.6	Very low	31.1	Very low	183 Å²	183	132.4 Å²	132.4	96%	0.958	80%	0.797	S	S	*	*			trans	-135.2	111.4	153.5	-78.1	178.8	0	0	0	108.9
13	G	27.1	Very low	30.9	Very low	82 Å²	82	132.8 Å²	132.8	85%	0.845	79%	0.793	S	S	*	*			trans	-94.7	135.2	174.6	0	0	0	0	0	111.4
14	S	33.1	Very low	30.2	Very low	113 Å²	113	130 Å²	130	79%	0.79	80%	0.795	S	S	*	*			trans	-114.3	121.6	164.6	49.3	0	0	0	0	109.1	S16	S14-S16 PolarHBondContact O-N 3.22Å
15	L	28.3	Very low	30.3	Very low	169 Å²	169	132.7 Å²	132.7	89%	0.885	80%	0.796	S	S	*	*			trans	-81.3	102.5	-176.6	-71.3	168.5	0	0	0	110.6	V17	L15-V17 PolarHBondContact O-N 3.14Å; L15-V17 VanDerWaalsContact O-N 3.09Å
16	S	27.1	Very low	29.9	Very low	112 Å²	112	132 Å²	132	78%	0.783	80%	0.798	S	S	*	*			trans	-78.1	82.8	170.4	44	0	0	0	0	111.3	S14 S18	S14-S16 PolarHBondContact O-N 3.22Å; S16-S18 PolarHBondContact O-N 3.02Å
17	V	29.8	Very low	29.6	Very low	122 Å²	122	130.1 Å²	130.1	74%	0.739	79%	0.789	S	S	*	*			trans	-76.3	89.3	173.2	-176.7	0	0	0	0	110.1	L15 S19	L15-V17 PolarHBondContact O-N 3.14Å; L15-V17 VanDerWaalsContact O-N 3.09Å; V17-S19 PolarHBondContact O-N 3.26Å; V17-S19 VanDerWaalsContact O-N 3.14Å
18	S	24.8	Very low	29.5	Very low	116 Å²	116	134.4 Å²	134.4	81%	0.811	80%	0.796	S	S	*	*			trans	-76	89.4	172.3	-64.8	0	0	0	0	111.6	S16 A20	S16-S18 PolarHBondContact O-N 3.02Å; S18-A20 PolarHBondContact O-N 3.23Å
19	S	28.3	Very low	29.2	Very low	100 Å²	100	135.9 Å²	135.9	70%	0.699	80%	0.798	S	S	*	*			trans	-95.3	77.8	171.1	48.4	0	0	0	0	111.8	V17 V21	V17-S19 PolarHBondContact O-N 3.26Å; V17-S19 VanDerWaalsContact O-N 3.14Å; S19-V21 PolarHBondContact O-N 2.87Å; S19-V21 VanDerWaalsContact O-N 3.11Å
20	A	26.3	Very low	29.1	Very low	104 Å²	104	136.2 Å²	136.2	86%	0.86	80%	0.799	S	S	*	*			trans	-70.5	103.8	173.8	0	0	0	0	0	111.2	S18	S18-A20 PolarHBondContact O-N 3.23Å
21	V	29.6	Very low	28.8	Very low	109 Å²	109	137.4 Å²	137.4	66%	0.661	80%	0.796	S	S	*	*			trans	-125.1	89.7	170.1	-176.1	0	0	0	0	109.7	S19 R23	S19-V21 PolarHBondContact O-N 2.87Å; S19-V21 VanDerWaalsContact O-N 3.11Å; V21-R23 HydrophobicContact CG1-CB 4.28Å; V21-R23 HydrophobicContact CG1-CG 3.86Å; V21-R23 PolarHBondContact O-N 3.49Å; V21-R23 VanDerWaalsContact O-N 3.11Å
22	N	26.8	Very low	28.8	Very low	178 Å²	178	137.9 Å²	137.9	95%	0.952	79%	0.793	S	S	*	*			trans	-67.8	101.2	157.6	-95.5	-17.4	0	0	0	108.1
23	R	29.2	Very low	28.6	Very low	182 Å²	182	136.7 Å²	136.7	69%	0.687	79%	0.788	S	S	*	*			trans	-122.7	126	159.9	-85.1	-172	175.3	-156.7	-1.2	108.7	V21 Y25	V21-R23 HydrophobicContact CG1-CB 4.28Å; V21-R23 HydrophobicContact CG1-CG 3.86Å; V21-R23 PolarHBondContact O-N 3.49Å; V21-R23 VanDerWaalsContact O-N 3.11Å; R23-Y25 VanDerWaalsContact O-CD2 3.32Å; R23-Y25 WeakPolarHBondContact O-CD2 3.38Å; R23-Y25 PolarHBondContact O-N 3.36Å
24	S	26.4	Very low	28.6	Very low	110 Å²	110	138.8 Å²	138.8	77%	0.769	79%	0.785	S	S	*	*			trans	-70.3	117.2	176.9	-49.8	0	0	0	0	109.8	D26	S24-D26 VanDerWaalsContact C-N 3.25Å; S24-D26 PolarHBondContact O-N 3.39Å
25	Y	31.5	Very low	28.5	Very low	198 Å²	198	142.1 Å²	142.1	78%	0.776	79%	0.788	S	S	*	*			trans	-89.3	49.9	178	-76.6	-79.9	0	0	0	112.7	R23	R23-Y25 VanDerWaalsContact O-CD2 3.32Å; R23-Y25 WeakPolarHBondContact O-CD2 3.38Å; R23-Y25 PolarHBondContact O-N 3.36Å
26	D	28.2	Very low	28.5	Very low	151 Å²	151	139.7 Å²	139.7	81%	0.807	78%	0.782	S	S	*	*			trans	-99.1	58	169	-82.1	-48.5	0	0	0	110	S24	S24-D26 VanDerWaalsContact C-N 3.25Å; S24-D26 PolarHBondContact O-N 3.39Å
27	S	27.4	Very low	28.7	Very low	74 Å²	74	138 Å²	138	52%	0.517	78%	0.783	S	S	.	*	S	Bend	trans	-150.9	18.6	-174.8	70.4	0	0	0	0	116.5
28	F	30.1	Very low	28.8	Very low	187 Å²	187	137.3 Å²	137.3	82%	0.82	79%	0.79	S	S	*	*	S	Bend	trans	-130.7	2.5	173.3	-86.5	-75.8	0	0	0	115.7
29	L	32.2	Very low	29	Very low	175 Å²	175	139.6 Å²	139.6	92%	0.916	79%	0.792	S	S	*	*	S	Bend	trans	-99.8	66.5	164.4	-77.5	170.5	0	0	0	109.9
30	N	26.8	Very low	29	Very low	153 Å²	153	142.6 Å²	142.6	82%	0.818	80%	0.799	S	S	*	*			trans	-153.5	64.1	176.1	-101.4	-34.1	0	0	0	111.6
31	N	27.9	Very low	29.2	Very low	157 Å²	157	143 Å²	143	84%	0.84	80%	0.796	S	S	*	*	S	Bend	trans	-156.6	137.6	151.6	-135.4	-15.6	0	0	0	111.4
32	V	29.1	Very low	29.3	Very low	120 Å²	120	146 Å²	146	73%	0.727	80%	0.803	S	S	*	*	S	Bend	trans	49.3	87	169.9	-164	0	0	0	0	116.3
33	D	29.9	Very low	29.4	Very low	158 Å²	158	144.9 Å²	144.9	85%	0.845	80%	0.796	S	S	*	*				-161.2	136.8	104	-116.1	-26.2	0	0	0	112.2
34	T	28.3	Very low	29.4	Very low	126 Å²	126	144.3 Å²	144.3	77%	0.773	81%	0.806	S	S	*	*			trans	-101.7	121.5	-178.2	47.6	0	0	0	0	111.9
35	Q	31.5	Very low	29.6	Very low	183 Å²	183	144.6 Å²	144.6	86%	0.855	81%	0.807	S	S	*	*			trans	-128.2	128.3	162.1	-83.1	-63.1	-52.7	0	0	110.4
36	P	27	Very low	29.4	Very low	118 Å²	118	142.2 Å²	142.2	77%	0.766	81%	0.808	S	S	*	*			trans	-95.8	153.6	-173.9	36.6	-34.6	0	0	0	113.6
37	G	31.4	Very low	29.7	Very low	78 Å²	78	141.3 Å²	141.3	80%	0.804	81%	0.812	S	S	*	*			trans	111.8	89.4	149.2	0	0	0	0	0	117.7
38	A	32.2	Very low	30.1	Very low	106 Å²	106	143.8 Å²	143.8	88%	0.876	83%	0.825	S	S	*	*			trans	-171.8	109.7	135.3	0	0	0	0	0	109.4
39	L	30.1	Very low	30.2	Very low	164 Å²	164	140.9 Å²	140.9	86%	0.859	82%	0.824	S	S	*	*			trans	-108.3	147.1	170.8	-83.9	173.6	0	0	0	110.4
40	L	26.4	Very low	30.3	Very low	163 Å²	163	140.4 Å²	140.4	85%	0.853	82%	0.822	S	S	*	*			trans	54.8	101	154.6	-69.6	163	0	0	0	118.5
41	S	32	Very low	30.3	Very low	114 Å²	114	140.5 Å²	140.5	80%	0.797	82%	0.822	S	S	*	*				-151.7	127.6	118.3	51.6	0	0	0	0	113
42	E	32.2	Very low	30.4	Very low	172 Å²	172	138.7 Å²	138.7	80%	0.804	82%	0.82	S	S	*	*			trans	13.4	122.8	139.7	-65.5	177.6	127.4	0	0	118.7
43	L	28.1	Very low	30.2	Very low	153 Å²	153	140.8 Å²	140.8	80%	0.801	83%	0.827	S	S	*	*				79	132.3	73.2	-89.6	171	0	0	0	114.9
44	L	29	Very low	30.3	Very low	171 Å²	171	139 Å²	139	90%	0.895	82%	0.822	S	S	*	*			trans	82.2	157.2	164.6	-60.8	176	0	0	0	120.8
45	S	30.4	Very low	30.1	Very low	115 Å²	115	138 Å²	138	80%	0.804	82%	0.82	S	S	*	*			trans	69.3	108	174.2	-144.7	0	0	0	0	119.6
46	D	27.5	Very low	29.9	Very low	149 Å²	149	134.8 Å²	134.8	80%	0.797	82%	0.817	S	S	*	*			trans	-55.5	155.2	146.1	-51.3	-90.3	0	0	0	112.1
47	C	34.3	Very low	29.8	Very low	132 Å²	132	134.9 Å²	134.9	89%	0.892	82%	0.816	S	S	*	*			trans	-169.3	153	130.5	-113.8	0	0	0	0	111.4
48	T	35.8	Very low	29.6	Very low	126 Å²	126	138.4 Å²	138.4	77%	0.773	82%	0.815	S	S	*	*			trans	-84.1	156.8	176.7	42.6	0	0	0	0	112.4
49	P	32.9	Very low	29.4	Very low	125 Å²	125	141.9 Å²	141.9	81%	0.812	81%	0.814	S	S	*	*			trans	-74.2	156	-174.3	31.6	-37	0	0	0	113.3
50	L	33.4	Very low	29.1	Very low	166 Å²	166	139.2 Å²	139.2	87%	0.869	81%	0.809	S	S	*	*			trans	-121.4	154.4	164.3	-118.2	81.1	0	0	0	110.2
51	D	27.5	Very low	29.4	Very low	155 Å²	155	137 Å²	137	83%	0.829	81%	0.807	S	S	*	*			trans	-67.2	154.3	179	-56.4	-86.6	0	0	0	113.4
52	C	29.1	Very low	29.1	Very low	118 Å²	118	139.6 Å²	139.6	80%	0.797	81%	0.812	S	S	*	*			trans	-132.8	84.4	166.2	-157.9	0	0	0	0	110.2
53	L	25.7	Very low	29	Very low	164 Å²	164	137 Å²	137	86%	0.859	81%	0.812	S	S	*	*			trans	-70.9	121.1	163.9	-83.5	165.4	0	0	0	108.9
54	V	31.1	Very low	29	Very low	122 Å²	122	138.6 Å²	138.6	74%	0.739	82%	0.816	S	S	*	*			trans	-121.7	105.4	163.3	-179.5	0	0	0	0	108.2
55	S	24	Very low	29.2	Very low	105 Å²	105	137.8 Å²	137.8	73%	0.734	81%	0.812	S	S	*	*			trans	-87.1	133.5	171.6	-55.4	0	0	0	0	110.2
56	S	29.1	Very low	29	Very low	115 Å²	115	139.7 Å²	139.7	80%	0.804	81%	0.813	S	S	*	*			trans	-141.7	111.2	163.6	59.5	0	0	0	0	108.8
57	T	23.9	Very low	29.3	Very low	120 Å²	120	140.2 Å²	140.2	74%	0.736	82%	0.815	S	S	*	*			trans	-122.7	150.9	-173.5	-37.2	0	0	0	0	109.5
58	L	26.4	Very low	28.9	Very low	151 Å²	151	139.1 Å²	139.1	79%	0.791	81%	0.808	S	S	*	*			trans	73.1	154.6	179.5	-47.6	173.2	0	0	0	112.8
59	Q	28.1	Very low	28.7	Very low	180 Å²	180	141.1 Å²	141.1	84%	0.841	81%	0.814	S	S	*	*			cis	-144.9	169.4	14.9	-148	153.7	14.9	0	0	112.2
60	S	24.9	Very low	28.5	Very low	108 Å²	108	139.6 Å²	139.6	76%	0.755	81%	0.806	S	S	*	*			trans	-102.7	144.5	-166.9	55.9	0	0	0	0	115.2
61	S	31.6	Very low	28.2	Very low	117 Å²	117	139.7 Å²	139.7	82%	0.818	81%	0.806	S	S	*	*			trans	-158.6	144.4	149.8	56.3	0	0	0	0	112.4
62	N	26.3	Very low	28.3	Very low	168 Å²	168	142.2 Å²	142.2	90%	0.898	81%	0.806	S	S	*	*			trans	-77	143.5	-176.6	-49.7	-44.3	0	0	0	113.1
63	S	30.5	Very low	28.2	Very low	116 Å²	116	139.7 Å²	139.7	81%	0.811	80%	0.8	S	S	*	*				-160.7	144.3	124	55.9	0	0	0	0	110.5
64	Q	28	Very low	28.4	Very low	187 Å²	187	138.5 Å²	138.5	87%	0.874	80%	0.799	S	S	*	*			trans	-78.1	137.9	163.6	-63.9	159.7	-94.5	0	0	107.8
65	D	33.2	Very low	28.3	Very low	154 Å²	154	138.5 Å²	138.5	82%	0.824	80%	0.799	S	S	*	*			trans	-157.5	155.3	141.8	-119	-36.1	0	0	0	112.4
66	N	26.9	Very low	28.5	Very low	155 Å²	155	139.5 Å²	139.5	83%	0.829	81%	0.806	S	S	*	*			trans	-95.4	120.2	-170.8	-57.8	-88.1	0	0	0	110.9
67	I	33.6	Very low	28.7	Very low	160 Å²	160	139.2 Å²	139.2	82%	0.821	80%	0.804	S	S	*	*			trans	-126.1	121.7	164.6	-59.9	-177	0	0	0	109.3
68	S	25.6	Very low	29.1	Very low	109 Å²	109	138.6 Å²	138.6	76%	0.762	81%	0.805	S	S	*	*			trans	-75.6	143.8	175.2	44.8	0	0	0	0	111.6
69	L	30.5	Very low	29.5	Very low	169 Å²	169	138.5 Å²	138.5	89%	0.885	81%	0.805	S	S	*	*			trans	-115.8	127	157.4	-75.5	172.3	0	0	0	108
70	S	30.3	Very low	29.9	Very low	92 Å²	92	134.3 Å²	134.3	64%	0.643	80%	0.796	S	S	*	*			trans	-82.9	137.2	-163.5	39.8	0	0	0	0	113.3	Y72	S70-Y72 PolarHBondContact O-N 3.33Å
71	L	25.7	Very low	30.3	Very low	169 Å²	169	135.8 Å²	135.8	89%	0.885	80%	0.795	S	S	*	*			trans	-67.5	117.6	155.1	-84.6	69.3	0	0	0	108.1
72	Y	29.6	Very low	30.7	Very low	208 Å²	208	136.1 Å²	136.1	82%	0.816	79%	0.788	S	S	*	*			trans	-94.9	81.5	156.4	-90.7	-76.6	0	0	0	109.4	S70	S70-Y72 PolarHBondContact O-N 3.33Å
73	G	27.1	Very low	31.2	Very low	65 Å²	65	134.3 Å²	134.3	67%	0.67	78%	0.778	S	S	*	*			trans	-78	128.2	159.8	0	0	0	0	0	109.2
74	V	29.6	Very low	31.5	Very low	138 Å²	138	134.8 Å²	134.8	84%	0.836	77%	0.772	S	S	*	*			trans	-103	91.8	173.6	-177.6	0	0	0	0	108.6
75	T	30.3	Very low	31.9	Very low	122 Å²	122	131.8 Å²	131.8	75%	0.748	76%	0.762	S	S	*	*			trans	-74	124.8	169.1	49	0	0	0	0	109.7	S77	T75-S77 PolarHBondContact O-N 3.03Å
76	S	28.3	Very low	32	Very low	127 Å²	127	131.2 Å²	131.2	89%	0.888	76%	0.758	S	S	*	*			trans	-69.5	107.4	173	54	0	0	0	0	111.1
77	S	33.4	Very low	32.5	Very low	109 Å²	109	128.7 Å²	128.7	76%	0.762	75%	0.753	S	S	*	*			trans	-124.6	125.4	168.2	49.9	0	0	0	0	110.3	T75	T75-S77 PolarHBondContact O-N 3.03Å
78	S	32.4	Very low	32.5	Very low	107 Å²	107	126.4 Å²	126.4	75%	0.748	75%	0.751	S	S	*	*			trans	-90.1	133.7	-177.4	53.1	0	0	0	0	111.8
79	N	34.1	Very low	33	Very low	148 Å²	148	127 Å²	127	79%	0.791	76%	0.755	S	S	*	*				-169.1	136	129.6	-99.3	-16.1	0	0	0	113.9
80	S	35.5	Very low	33.1	Very low	93 Å²	93	126.7 Å²	126.7	65%	0.65	76%	0.755	S	S	*	*			trans	46.5	120.2	143.5	-50.9	0	0	0	0	121.9
81	N	35	Very low	33.3	Very low	139 Å²	139	125.8 Å²	125.8	74%	0.743	76%	0.76	S	S	*	*			trans	73.1	146.7	140.5	-62.6	25.6	0	0	0	117.7
82	D	39.7	Very low	33.6	Very low	124 Å²	124	125.3 Å²	125.3	66%	0.663	76%	0.758	S	S	*	*			cis	-139.5	151.3	10.2	-117.6	-50.2	0	0	0	114.1
83	N	36.5	Very low	33.9	Very low	130 Å²	130	122.8 Å²	122.8	70%	0.695	76%	0.759	S	S	*	*			trans	0.6	151.2	160	-74	-72.2	0	0	0	124.8
84	N	36.9	Very low	34	Very low	126 Å²	126	127.5 Å²	127.5	67%	0.674	77%	0.769	S	S	*	*			trans	92.4	100.4	143.7	-68.7	-29	0	0	0	123.1
85	N	36.4	Very low	34.1	Very low	123 Å²	123	128.1 Å²	128.1	66%	0.658	77%	0.766	S	S	*	*				78.5	111.3	115.4	-60.1	-16.7	0	0	0	123.2
86	N	35.2	Very low	33.9	Very low	142 Å²	142	128.6 Å²	128.6	76%	0.759	77%	0.769	S	S	*	*				92	144	121.3	-70.5	-11.9	0	0	0	123.3
87	S	36.8	Very low	34	Very low	102 Å²	102	129.3 Å²	129.3	71%	0.713	76%	0.763	S	S	*	*			trans	68.2	93.1	148.8	44.4	0	0	0	0	120.6
88	S	33.5	Very low	33.7	Very low	112 Å²	112	131.1 Å²	131.1	78%	0.783	77%	0.769	S	S	*	*				39.3	130.3	116.4	64.3	0	0	0	0	121.4
89	S	36.6	Very low	33.7	Very low	121 Å²	121	133.7 Å²	133.7	85%	0.846	77%	0.773	S	S	*	*				-165.7	167.6	111.9	56.1	0	0	0	0	112.6
90	N	32.1	Very low	33.4	Very low	164 Å²	164	129.6 Å²	129.6	88%	0.877	77%	0.766	S	S	*	*			trans	-71.2	154.6	179	-69.6	-26.8	0	0	0	112.9
91	G	35.2	Very low	32.9	Very low	73 Å²	73	132.8 Å²	132.8	75%	0.753	78%	0.776	S	S	*	*			trans	-159.1	73.7	172.7	0	0	0	0	0	113.6
92	N	31.3	Very low	32.6	Very low	158 Å²	158	135.1 Å²	135.1	85%	0.845	78%	0.784	S	S	*	*			trans	-65.7	132.7	172.3	-71.6	-12.3	0	0	0	110.7
93	N	36.1	Very low	32	Very low	155 Å²	155	137.6 Å²	137.6	83%	0.829	80%	0.797	S	S	*	*			trans	-149.2	114.1	160.2	-91.6	-49	0	0	0	110.4
94	N	28.5	Very low	31.7	Very low	165 Å²	165	133.8 Å²	133.8	88%	0.882	79%	0.789	S	S	*	*			trans	-80.7	125.2	171.2	-75.2	-21.1	0	0	0	109.5
95	I	32.7	Very low	31.6	Very low	151 Å²	151	134.6 Å²	134.6	77%	0.774	79%	0.792	S	S	*	*			trans	-126.2	109.2	161.2	-61.4	-178.1	0	0	0	107.9
96	T	25.8	Very low	31.3	Very low	131 Å²	131	138.7 Å²	138.7	80%	0.804	80%	0.8	S	S	*	*			trans	-72	130.1	170.7	47.8	0	0	0	0	110
97	N	29.8	Very low	31.3	Very low	143 Å²	143	135.6 Å²	135.6	77%	0.765	79%	0.786	S	S	*	*			trans	-135	107.5	165.7	-110.8	-19.7	0	0	0	110.2	I99	N97-I99 PolarHBondContact O-N 3.03Å
98	T	26.6	Very low	31	Very low	147 Å²	147	136 Å²	136	90%	0.902	79%	0.786	S	S	*	*			trans	-74.5	112.6	172.2	17.7	0	0	0	0	110.5
99	I	32.5	Very low	31	Very low	161 Å²	161	135.1 Å²	135.1	83%	0.826	77%	0.771	S	S	*	*			trans	-128.2	123.5	163.2	-60.5	-179.1	0	0	0	107	N97	N97-I99 PolarHBondContact O-N 3.03Å
100	G	28.2	Very low	30.7	Very low	62 Å²	62	133.8 Å²	133.8	64%	0.639	76%	0.755	S	S	*	*			trans	-99.8	171.1	-177.2	0	0	0	0	0	113.8
101	N	26.4	Very low	30.7	Very low	160 Å²	160	131.3 Å²	131.3	86%	0.856	75%	0.747	S	S	*	*			trans	54.2	90	157.9	-60.2	4.5	0	0	0	117.9
102	M	27.3	Very low	30.3	Very low	188 Å²	188	134.6 Å²	134.6	93%	0.926	75%	0.748	S	S	*	*				-173.1	55.5	128.3	-86.4	-113.5	-169.3	0	0	111.4	G104	M102-G104 PolarHBondContact O-N 3.42Å
103	N	28	Very low	30.4	Very low	175 Å²	175	129 Å²	129	94%	0.936	72%	0.721	S	S	*	*			trans	-96.9	94.1	-179.2	-72.7	11	0	0	0	112.5
104	G	30.1	Very low	30.5	Very low	51 Å²	51	128.9 Å²	128.9	53%	0.526	72%	0.715	S	S	.	*	S	Bend	trans	-120.2	149.6	143.9	0	0	0	0	0	107.6	M102 Y106	M102-G104 PolarHBondContact O-N 3.42Å; G104-Y106 VanDerWaalsContact C-N 3.28Å; G104-Y106 PolarHBondContact O-N 3.16Å
105	I	33.6	Very low	30.9	Very low	142 Å²	142	123.1 Å²	123.1	73%	0.728	69%	0.685	S	S	*	*			trans	-74.1	83.4	-173.6	-58.5	175.4	0	0	0	110.5	V107 E517	I105-V107 HydrophobicContact CG2-CG2 3.95Å; I105-V107 PolarHBondContact O-N 3.32Å; I105-E517 WeakPolarHBondContact CG1-OE1 3.49Å; I105-E517 PolarHBondContact N-OE1 3.38Å
106	Y	30.4	Very low	30.7	Very low	210 Å²	210	117.8 Å²	117.8	82%	0.824	66%	0.66	S	S	*	*			trans	-81.9	91.8	168.9	-166.4	-84.8	0	0	0	108.7	G104 P108	G104-Y106 VanDerWaalsContact C-N 3.28Å; G104-Y106 PolarHBondContact O-N 3.16Å; Y106-P108 VanDerWaalsContact O-CD 3.24Å; Y106-P108 WeakPolarHBondContact O-CD 3.24Å
107	V	35.7	Very low	31.1	Very low	77 Å²	77	119.2 Å²	119.2	47%	0.467	65%	0.652	S	S	.	*			trans	-69.2	118.8	170.2	-175.1	0	0	0	0	108.2	I105 I109	I105-V107 HydrophobicContact CG2-CG2 3.95Å; I105-V107 PolarHBondContact O-N 3.32Å; V107-I109 HydrophobicContact CB-CG1 4.15Å; V107-I109 HydrophobicContact CG1-CG1 3.86Å; V107-I109 PolarHBondContact O-N 3.34Å
108	P	29.7	Very low	31.3	Very low	111 Å²	111	121.6 Å²	121.6	72%	0.721	65%	0.65	S	S	*	*			trans	-74.4	80.8	168.6	32.2	-33	0	0	0	108.3	Y106 N110	Y106-P108 VanDerWaalsContact O-CD 3.24Å; Y106-P108 WeakPolarHBondContact O-CD 3.24Å; P108-N110 PolarHBondContact O-N 3.43Å
109	I	34.9	Very low	31.6	Very low	92 Å²	92	120.1 Å²	120.1	47%	0.472	63%	0.631	S	S	.	*			trans	-61.9	123	178.7	-55.8	176.1	0	0	0	108.1	V107 P111 C116	V107-I109 HydrophobicContact CB-CG1 4.15Å; V107-I109 HydrophobicContact CG1-CG1 3.86Å; V107-I109 PolarHBondContact O-N 3.34Å; I109-P111 WeakPolarHBondContact O-CD 3.23Å; I109-C116 HydrophobicContact CG2-CB 3.73Å
110	N	30.2	Very low	31.4	Very low	93 Å²	93	119 Å²	119	50%	0.497	63%	0.627	S	S	.	*			trans	-55.3	119.8	179.5	177.5	1.9	0	0	0	109.6	P108 N112 S113	P108-N110 PolarHBondContact O-N 3.43Å; N110-N112 PolarHBondContact O-N 3.3Å; N110-N112 WeakPolarHBondContact OD1-CB 3.37Å; N110-N112 PolarHBondContact OD1-N 3.02Å; N110-S113 PolarHBondContact O-N 3.16Å
111	P	32	Very low	31.5	Very low	112 Å²	112	121.2 Å²	121.2	73%	0.727	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-9.2	-179	28.1	-36	0	0	0	113.5	I109	I109-P111 WeakPolarHBondContact O-CD 3.23Å
112	N	27.3	Very low	31.4	Very low	142 Å²	142	119.6 Å²	119.6	76%	0.759	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	6.5	173.3	-57	-31.5	0	0	0	113.3	N110	N110-N112 PolarHBondContact O-N 3.3Å; N110-N112 WeakPolarHBondContact OD1-CB 3.37Å; N110-N112 PolarHBondContact OD1-N 3.02Å
113	S	32.4	Very low	31.5	Very low	40 Å²	40	117.3 Å²	117.3	28%	0.28	62%	0.619	S	S	.	*	S	Bend	trans	-80.3	139.1	162.8	-169.5	0	0	0	0	110	N110 D115	N110-S113 PolarHBondContact O-N 3.16Å; S113-D115 PolarHBondContact O-N 2.97Å; S113-D115 VanDerWaalsContact O-N 3.15Å; S113-D115 PolarHBondContact OG-OD2 3.3Å
114	H	37.8	Very low	31.3	Very low	153 Å²	153	117.2 Å²	117.2	71%	0.708	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-61.5	-20.5	175.9	-86.4	-97	0	0	0	113.3	C116	H114-C116 VanDerWaalsContact C-N 3.28Å; H114-C116 PolarHBondContact O-N 2.8Å
115	D	36.6	Very low	31.1	Very low	45 Å²	45	122 Å²	122	24%	0.241	63%	0.626	C	S	.	*	G	3₁₀ helix	trans	-72.4	-7.5	-174.3	-54.1	-50.1	0	0	0	115.5	S113	S113-D115 PolarHBondContact O-N 2.97Å; S113-D115 VanDerWaalsContact O-N 3.15Å; S113-D115 PolarHBondContact OG-OD2 3.3Å
116	C	30.3	Very low	30.9	Very low	39 Å²	39	124 Å²	124	26%	0.264	63%	0.629	S	S	.	*	G	3₁₀ helix	trans	-143.7	53.9	-169.1	-98.8	0	0	0	0	116.1	I109 H114 R118	I109-C116 HydrophobicContact CG2-CB 3.73Å; H114-C116 VanDerWaalsContact C-N 3.28Å; H114-C116 PolarHBondContact O-N 2.8Å; C116-R118 PolarHBondContact O-N 3.16Å; C116-R118 VanDerWaalsContact O-N 3.15Å
117	Y	33.7	Very low	30.7	Very low	160 Å²	160	119.3 Å²	119.3	63%	0.627	63%	0.627	S	S	*	*			trans	-65.9	110.6	166.9	-82.6	-81.3	0	0	0	113.3	N473	Y117-N473 PolarHBondContact O-ND2 2.92Å
118	R	33.8	Very low	30.5	Very low	193 Å²	193	122.8 Å²	122.8	73%	0.728	64%	0.643	S	S	*	*			trans	-82.4	109.9	159.3	-175.2	-177.8	-170.8	175.4	2.6	108.5	C116 N120	C116-R118 PolarHBondContact O-N 3.16Å; C116-R118 VanDerWaalsContact O-N 3.15Å; R118-N120 PolarHBondContact O-N 3.09Å; R118-N120 VanDerWaalsContact O-N 3.07Å
119	K	32.3	Very low	30.7	Very low	116 Å²	116	122.6 Å²	122.6	50%	0.504	64%	0.641	S	S	.	*			trans	-65.4	108.6	171.3	-87.4	-169.6	170.8	-170	0	109.8	S121	K119-S121 PolarHBondContact O-N 3.22Å
120	N	29.7	Very low	30.5	Very low	138 Å²	138	125.3 Å²	125.3	74%	0.738	66%	0.657	S	S	*	*			trans	-69.9	112.5	164.9	-78.2	-10.9	0	0	0	108.8	R118 T122	R118-N120 PolarHBondContact O-N 3.09Å; R118-N120 VanDerWaalsContact O-N 3.07Å; N120-T122 PolarHBondContact O-N 3.42Å
121	S	29.1	Very low	30.7	Very low	109 Å²	109	129.3 Å²	129.3	76%	0.762	68%	0.677	S	S	*	*			trans	-79	100.2	168.5	51.8	0	0	0	0	109.3	K119 I123	K119-S121 PolarHBondContact O-N 3.22Å; S121-I123 PolarHBondContact O-N 3.07Å
122	T	25.6	Very low	30.5	Very low	125 Å²	125	129 Å²	129	77%	0.767	68%	0.677	S	S	*	*			trans	-60.2	117.8	169.8	-57.5	0	0	0	0	109.2	N120 E124	N120-T122 PolarHBondContact O-N 3.42Å; T122-E124 PolarHBondContact O-N 2.8Å
123	I	28.3	Very low	30.7	Very low	141 Å²	141	126.7 Å²	126.7	72%	0.723	67%	0.672	S	S	*	*			trans	-78.5	111	167	-61.7	175.1	0	0	0	106.4	S121 L125	S121-I123 PolarHBondContact O-N 3.07Å; I123-L125 VanDerWaalsContact C-N 3.29Å; I123-L125 HydrophobicContact CG2-CD2 4.3Å; I123-L125 HydrophobicContact CG2-CG 4.35Å; I123-L125 PolarHBondContact O-N 3.35Å
124	E	24.7	Very low	30.8	Very low	172 Å²	172	133.8 Å²	133.8	80%	0.804	70%	0.698	S	S	*	*			trans	-67.9	89.5	168.8	-74.1	-163.3	149.4	0	0	109.8	T122 K126	T122-E124 PolarHBondContact O-N 2.8Å; E124-K126 PolarHBondContact O-N 3.3Å; E124-K126 VanDerWaalsContact O-N 3.12Å
125	L	25.4	Very low	30.5	Very low	152 Å²	152	133.3 Å²	133.3	80%	0.796	70%	0.7	S	S	*	*			trans	-70.2	100.1	160.5	-68.8	176.7	0	0	0	107.9	I123 S127	I123-L125 VanDerWaalsContact C-N 3.29Å; I123-L125 HydrophobicContact CG2-CD2 4.3Å; I123-L125 HydrophobicContact CG2-CG 4.35Å; I123-L125 PolarHBondContact O-N 3.35Å; L125-S127 PolarHBondContact O-N 3.42Å
126	K	28.2	Very low	30.1	Very low	185 Å²	185	137.5 Å²	137.5	80%	0.804	72%	0.721	S	S	*	*			trans	-63.2	102.7	167	-90.7	-172.6	170.9	-175.8	0	109.8	E124	E124-K126 PolarHBondContact O-N 3.3Å; E124-K126 VanDerWaalsContact O-N 3.12Å
127	S	28.1	Very low	30.3	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	75%	0.745	S	S	*	*			trans	-87.9	98.8	165.3	56.3	0	0	0	0	109.3	L125	L125-S127 PolarHBondContact O-N 3.42Å
128	D	31.5	Very low	30.2	Very low	150 Å²	150	143.1 Å²	143.1	80%	0.802	75%	0.749	S	S	*	*			trans	-72.2	132.2	166.5	-68.2	-44	0	0	0	109.2
129	P	32.1	Very low	30	Very low	107 Å²	107	140.3 Å²	140.3	70%	0.695	74%	0.744	S	S	*	*			trans	-87.6	157.7	-178.1	34.7	-35.3	0	0	0	113.3
130	D	30.8	Very low	30	Very low	149 Å²	149	139.2 Å²	139.2	80%	0.797	75%	0.751	S	S	*	*			trans	52.4	114.1	160.6	-62.8	-36.5	0	0	0	119.9
131	I	35.6	Very low	30.2	Very low	178 Å²	178	141.5 Å²	141.5	91%	0.913	75%	0.754	S	S	*	*				-157.8	143	107.2	-97.6	152.3	0	0	0	109.1
132	S	28.2	Very low	30.5	Very low	105 Å²	105	142.7 Å²	142.7	73%	0.734	75%	0.752	S	S	*	*			trans	-109	153.5	-166.9	-171.5	0	0	0	0	114.5
133	S	29.9	Very low	30.9	Very low	94 Å²	94	141.9 Å²	141.9	66%	0.657	75%	0.752	S	S	*	*			trans	72.1	109.3	156.5	73	0	0	0	0	120.3
134	K	36.1	Very low	31.2	Very low	188 Å²	188	138.4 Å²	138.4	82%	0.817	75%	0.75	S	S	*	*				156.3	107.6	123.5	-83.7	170.8	-176.8	-175.1	0	109.2
135	L	30.1	Very low	31.4	Very low	143 Å²	143	136.7 Å²	136.7	75%	0.749	75%	0.751	S	S	*	*				71.1	112.3	71.3	-78.4	151.9	0	0	0	114.4
136	I	29.6	Very low	31.7	Very low	133 Å²	133	137.1 Å²	137.1	68%	0.682	75%	0.753	S	S	*	*			trans	73.5	144.6	148.7	-61	168	0	0	0	114.3
137	E	32.6	Very low	31.8	Very low	164 Å²	164	133.5 Å²	133.5	77%	0.766	75%	0.751	S	S	*	*			cis	-146.1	138.8	9.9	-134.5	129.1	-142.9	0	0	106.9
138	E	31.9	Very low	31.6	Very low	153 Å²	153	134.5 Å²	134.5	72%	0.715	75%	0.753	S	S	*	*				113.4	147.9	83.5	-111.2	-152	138.7	0	0	116.2
139	Q	30.6	Very low	31.6	Very low	135 Å²	135	134.3 Å²	134.3	63%	0.631	76%	0.757	S	S	*	*			trans	62.1	102.2	146.1	-58.2	-74.3	-7.2	0	0	124.6
140	S	32.3	Very low	31.3	Very low	92 Å²	92	134.6 Å²	134.6	64%	0.643	76%	0.761	S	S	*	*				62.7	148.2	106.6	-53.9	0	0	0	0	124.6
141	K	34.3	Very low	31.4	Very low	187 Å²	187	137.7 Å²	137.7	81%	0.813	77%	0.768	S	S	*	*			trans	81.5	148.9	168.3	-62.4	176.6	-174.3	174.3	0	116
142	D	35.5	Very low	31.1	Very low	134 Å²	134	136.5 Å²	136.5	72%	0.717	76%	0.763	S	S	*	*			cis	-161.5	-168.4	-3.8	-115.1	-41.9	0	0	0	108.2
143	S	33.3	Very low	31.3	Very low	108 Å²	108	138.3 Å²	138.3	76%	0.755	76%	0.764	S	S	*	*				-154.3	-176.3	-86.4	54.7	0	0	0	0	111.6
144	G	34.4	Very low	31.6	Very low	67 Å²	67	140.6 Å²	140.6	69%	0.691	77%	0.769	S	S	*	*			trans	100	123	-175.5	0	0	0	0	0	113.4
145	V	29.7	Very low	31.3	Very low	137 Å²	137	136.3 Å²	136.3	83%	0.83	76%	0.762	S	S	*	*			cis	94.7	136.4	15.4	-164.8	0	0	0	0	115.2
146	L	30.4	Very low	31.5	Very low	160 Å²	160	136.4 Å²	136.4	84%	0.838	76%	0.762	S	S	*	*			trans	81.2	146.8	178	-54.6	-173.7	0	0	0	117.4
147	S	30	Very low	31.6	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	77%	0.772	S	S	*	*			cis	-164.1	163	-14.9	48.1	0	0	0	0	113.9
148	V	25.4	Very low	31.5	Very low	132 Å²	132	135.7 Å²	135.7	80%	0.8	77%	0.774	S	S	*	*			trans	-63.2	146.8	177.7	172.2	0	0	0	0	115.1
149	T	31.1	Very low	31.6	Very low	146 Å²	146	133.8 Å²	133.8	90%	0.896	78%	0.777	S	S	*	*			trans	-172.5	159.6	133.1	15.2	0	0	0	0	113.6
150	S	26.2	Very low	31.4	Very low	112 Å²	112	134.5 Å²	134.5	78%	0.783	78%	0.784	S	S	*	*			trans	-112.6	162.5	-178.9	51.9	0	0	0	0	112.6
151	K	33.1	Very low	31.3	Very low	214 Å²	214	138.7 Å²	138.7	93%	0.93	79%	0.791	S	S	*	*			trans	-143.5	162.7	166	-88.7	-164	172.6	-174.3	0	112.3
152	L	28.2	Very low	31	Very low	154 Å²	154	135.8 Å²	135.8	81%	0.806	79%	0.789	S	S	*	*			trans	-116.6	-170.4	-170.7	-92.1	145.2	0	0	0	111.2
153	D	33.6	Very low	30.8	Very low	142 Å²	142	136 Å²	136	76%	0.759	79%	0.79	S	S	*	*			trans	75.3	144.7	166.4	-40.8	-44	0	0	0	114.8
154	D	34.2	Very low	30.4	Very low	143 Å²	143	142 Å²	142	77%	0.765	80%	0.796	S	S	*	*			cis	-139.8	142.8	4.5	-105.7	-50.3	0	0	0	108.2
155	S	30.8	Very low	30.4	Very low	97 Å²	97	148.8 Å²	148.8	68%	0.678	80%	0.802	S	S	*	*				75.7	127.7	71.4	-162.1	0	0	0	0	116.2
156	I	34	Very low	30.6	Very low	146 Å²	146	148.7 Å²	148.7	75%	0.749	80%	0.797	S	S	*	*			trans	154.8	110.4	144	-79	158.7	0	0	0	114.6
157	K	31.2	Very low	30.6	Very low	205 Å²	205	145.6 Å²	145.6	89%	0.891	80%	0.795	S	S	*	*			trans	34.9	133.8	139.9	-51.8	175.2	-177.2	174.7	0	123.2
158	G	31.6	Very low	30.8	Very low	77 Å²	77	148.2 Å²	148.2	79%	0.794	80%	0.8	S	S	*	*			trans	-165.7	133.1	155.3	0	0	0	0	0	113
159	S	32.9	Very low	31.1	Very low	112 Å²	112	150.5 Å²	150.5	78%	0.783	80%	0.799	S	S	*	*			trans	-62.6	137.8	-177.8	46.8	0	0	0	0	113.4
160	I	27.5	Very low	31.2	Very low	151 Å²	151	150.6 Å²	150.6	77%	0.774	79%	0.794	S	S	*	*				53.3	108	74.4	-57.1	172.6	0	0	0	113.1
161	F	30.1	Very low	31.3	Very low	180 Å²	180	150.3 Å²	150.3	79%	0.789	79%	0.792	S	S	*	*				-154.7	148.9	129.1	-129.5	-88.6	0	0	0	110.2	D163	F161-D163 WeakPolarHBondContact CD1-OD2 3.19Å; F161-D163 VanDerWaalsContact CE1-OD2 3.29Å; F161-D163 WeakPolarHBondContact CE1-OD2 3.34Å
162	T	27.3	Very low	31.2	Very low	126 Å²	126	145.2 Å²	145.2	77%	0.773	78%	0.783	S	S	*	*			trans	-147	122.8	177.3	48.2	0	0	0	0	108.6
163	D	32.8	Very low	31.2	Very low	139 Å²	139	144.6 Å²	144.6	74%	0.743	79%	0.786	S	S	*	*			trans	-134.8	144.5	170.4	-86.9	-55	0	0	0	111.5	F161	F161-D163 WeakPolarHBondContact CD1-OD2 3.19Å; F161-D163 VanDerWaalsContact CE1-OD2 3.29Å; F161-D163 WeakPolarHBondContact CE1-OD2 3.34Å
164	R	24.6	Very low	31.1	Very low	232 Å²	232	143 Å²	143	88%	0.875	79%	0.786	S	S	*	*			trans	-117.3	142	165.2	-59.5	168.7	174.1	163.1	-4.7	106.6
165	Y	34	Very low	30.7	Very low	211 Å²	211	143.5 Å²	143.5	83%	0.827	79%	0.789	S	S	*	*			trans	-162.3	118.3	140.9	-93.5	-70.3	0	0	0	104.9
166	D	33	Very low	30.7	Very low	135 Å²	135	145.4 Å²	145.4	72%	0.722	80%	0.796	S	S	*	*				51.9	109.2	102.2	-65.4	-33.1	0	0	0	112.8
167	A	30.8	Very low	30.4	Very low	95 Å²	95	144 Å²	144	79%	0.785	80%	0.795	S	S	*	*				83.2	119.5	61.5	0	0	0	0	0	112.7
168	D	33.8	Very low	30.3	Very low	164 Å²	164	139.5 Å²	139.5	88%	0.877	79%	0.789	S	S	*	*			trans	-148.1	163.8	160.8	-143.7	-22.3	0	0	0	111.3
169	K	32.6	Very low	30.1	Very low	179 Å²	179	141.4 Å²	141.4	78%	0.778	79%	0.785	S	S	*	*			trans	-113.8	161.5	-173.5	-68.6	173.1	179.3	169.9	0	112
170	N	33.5	Very low	30	Very low	148 Å²	148	142 Å²	142	79%	0.791	78%	0.784	S	S	*	*			trans	151.2	131	141.8	-73.2	-28.8	0	0	0	108.3
171	S	27.2	Very low	30	Very low	106 Å²	106	141.6 Å²	141.6	74%	0.741	78%	0.784	S	S	*	*			cis	90.1	65.5	18.7	90.9	0	0	0	0	117.7
172	S	32	Very low	29.9	Very low	107 Å²	107	139.1 Å²	139.1	75%	0.748	78%	0.784	S	S	*	*			trans	-166.2	133	152.6	49.6	0	0	0	0	108.5
173	T	27.2	Very low	29.9	Very low	141 Å²	141	139 Å²	139	87%	0.865	78%	0.783	S	S	*	*			cis	83.5	67.7	37.2	71.7	0	0	0	0	116.9
174	S	32	Very low	29.5	Very low	108 Å²	108	136.8 Å²	136.8	76%	0.755	78%	0.784	S	S	*	*			trans	-162	131.2	149.9	47.9	0	0	0	0	108
175	N	26	Very low	29.5	Very low	155 Å²	155	131.4 Å²	131.4	83%	0.829	78%	0.777	S	S	*	*				70.7	149.8	53.7	-73.9	-6.7	0	0	0	114.6
176	V	30.5	Very low	29.1	Very low	137 Å²	137	127.6 Å²	127.6	83%	0.83	78%	0.775	S	S	*	*			trans	81.5	141.6	179.5	-169.1	0	0	0	0	114.7
177	T	26.9	Very low	28.8	Very low	117 Å²	117	127 Å²	127	72%	0.718	78%	0.777	S	S	*	*			cis	175.2	121.9	-49.1	-85.5	0	0	0	0	108.5
178	S	30.2	Very low	28.5	Very low	109 Å²	109	128.9 Å²	128.9	76%	0.762	78%	0.778	S	S	*	*			trans	-175.1	129.5	156.1	44.2	0	0	0	0	108.1
179	T	27.7	Very low	28.2	Very low	118 Å²	118	126.3 Å²	126.3	72%	0.724	77%	0.773	S	S	*	*			cis	59	122	32.6	74.6	0	0	0	0	113.2
180	T	31.2	Very low	27.8	Very low	123 Å²	123	124.2 Å²	124.2	76%	0.755	78%	0.776	S	S	*	*			cis	-134.5	155.9	33.2	49.3	0	0	0	0	112.4
181	N	26	Very low	27.6	Very low	144 Å²	144	123.9 Å²	123.9	77%	0.77	78%	0.78	S	S	*	*				66.2	146.2	53.8	-85.7	3.7	0	0	0	116.1
182	T	28.7	Very low	27.5	Very low	128 Å²	128	125.2 Å²	125.2	79%	0.785	78%	0.783	S	S	*	*			trans	94.7	106.6	-174.5	-41.3	0	0	0	0	112.8
183	T	26.2	Very low	27.3	Very low	123 Å²	123	126.5 Å²	126.5	76%	0.755	79%	0.787	S	S	*	*			cis	88.3	121.3	17.4	-40.5	0	0	0	0	115.4
184	A	24.6	Very low	27.2	Very low	93 Å²	93	125.9 Å²	125.9	77%	0.769	78%	0.783	S	S	*	*			trans	67.3	162.9	177.4	0	0	0	0	0	114.1
185	V	26.5	Very low	26.8	Very low	119 Å²	119	126.7 Å²	126.7	72%	0.721	78%	0.784	S	S	*	*			cis	-133	142.4	18.6	171.5	0	0	0	0	112.2	T187	V185-T187 HydrophobicContact CG1-CG2 4.01Å
186	T	23.6	Very low	26.8	Very low	130 Å²	130	125.5 Å²	125.5	80%	0.798	78%	0.782	S	S	*	*			trans	-85.7	119	162.8	-56.3	0	0	0	0	110
187	T	27.9	Very low	26.5	Very low	124 Å²	124	123.2 Å²	123.2	76%	0.761	78%	0.777	S	S	*	*			trans	-130	103.3	165.8	34.9	0	0	0	0	110.5	V185	V185-T187 HydrophobicContact CG1-CG2 4.01Å
188	T	23.8	Very low	26.4	Very low	133 Å²	133	124 Å²	124	82%	0.816	78%	0.776	S	S	*	*			trans	-75.8	123.1	165.2	46.7	0	0	0	0	110
189	S	28.6	Very low	26.1	Very low	110 Å²	110	124.5 Å²	124.5	77%	0.769	77%	0.774	S	S	*	*			trans	-133.8	98.7	167.9	58.6	0	0	0	0	110.2
190	T	24.6	Very low	26.1	Very low	135 Å²	135	125 Å²	125	83%	0.828	77%	0.771	S	S	*	*			trans	-81.1	117.4	176.6	47.7	0	0	0	0	111.3
191	T	28.8	Very low	25.8	Very low	142 Å²	142	124.9 Å²	124.9	87%	0.871	77%	0.766	S	S	*	*			trans	-140	128.1	157	38.5	0	0	0	0	110.1
192	T	24.5	Very low	26	Very low	133 Å²	133	124.7 Å²	124.7	82%	0.816	77%	0.765	S	S	*	*			trans	-83.1	142.9	-178.7	48.8	0	0	0	0	112.6
193	T	27.1	Very low	26	Very low	134 Å²	134	124.3 Å²	124.3	82%	0.822	76%	0.758	S	S	*	*			trans	-159.6	124.2	135.7	17.7	0	0	0	0	113.3
194	T	26.1	Very low	26.1	Very low	128 Å²	128	129.7 Å²	129.7	79%	0.785	77%	0.766	S	S	*	*			trans	53.9	105.3	139.9	-33.3	0	0	0	0	121.4
195	T	24.2	Very low	26.3	Very low	126 Å²	126	135.4 Å²	135.4	77%	0.773	77%	0.769	S	S	*	*			trans	-45.2	134.3	156.2	-50.4	0	0	0	0	115.7
196	T	25.1	Very low	26.2	Very low	130 Å²	130	138.2 Å²	138.2	80%	0.798	77%	0.774	S	S	*	*			trans	-144.2	107.1	139.2	25.7	0	0	0	0	110.1
197	A	23.4	Very low	26.6	Very low	88 Å²	88	137.2 Å²	137.2	73%	0.727	77%	0.773	S	S	*	*			trans	-89.1	121.9	167	0	0	0	0	0	108.8
198	I	25.1	Very low	26.7	Very low	135 Å²	135	137.8 Å²	137.8	69%	0.692	77%	0.771	S	S	*	*			trans	-108.5	94.4	175.4	-53.5	-177.4	0	0	0	108.6	I200	I198-I200 HydrophobicContact CG2-CD1 4.24Å; I198-I200 HydrophobicContact CG2-CG1 3.72Å
199	V	24.6	Very low	27.2	Very low	119 Å²	119	139.5 Å²	139.5	72%	0.721	77%	0.773	S	S	*	*			trans	-85.1	106.4	168.1	177.7	0	0	0	0	107.9	N201	V199-N201 PolarHBondContact O-N 3.14Å
200	I	28.6	Very low	27.4	Very low	127 Å²	127	141.5 Å²	141.5	65%	0.651	77%	0.768	S	S	*	*			trans	-88.3	82.8	175.3	-52.7	-174.9	0	0	0	109.3	I198 N202	I198-I200 HydrophobicContact CG2-CD1 4.24Å; I198-I200 HydrophobicContact CG2-CG1 3.72Å; I200-N202 WeakPolarHBondContact CG2-OD1 3.4Å; I200-N202 PolarHBondContact O-N 3.37Å; I200-N202 VanDerWaalsContact O-N 3.14Å
201	N	24.7	Very low	27.6	Very low	122 Å²	122	142.6 Å²	142.6	65%	0.652	76%	0.764	S	S	*	*			trans	-75.6	90.6	164.8	-94.9	17.7	0	0	0	109.6	V199 N203	V199-N201 PolarHBondContact O-N 3.14Å; N201-N203 PolarHBondContact O-N 3.03Å
202	N	29.9	Very low	27.8	Very low	140 Å²	140	146.6 Å²	146.6	75%	0.749	76%	0.764	S	S	*	*			trans	-79.5	76.6	165.1	-80.1	0.2	0	0	0	109.8	I200 Y204	I200-N202 WeakPolarHBondContact CG2-OD1 3.4Å; I200-N202 PolarHBondContact O-N 3.37Å; I200-N202 VanDerWaalsContact O-N 3.14Å; N202-Y204 PolarHBondContact O-N 3.31Å
203	N	28.3	Very low	28.1	Very low	119 Å²	119	146 Å²	146	64%	0.636	76%	0.761	S	S	*	*			trans	-61.1	123.7	166	-74.8	-9.2	0	0	0	109	N201 Y205	N201-N203 PolarHBondContact O-N 3.03Å; N203-Y205 PolarHBondContact O-N 3.42Å
204	Y	27.6	Very low	28.2	Very low	237 Å²	237	146.3 Å²	146.3	93%	0.929	76%	0.757	S	S	*	*			trans	-63.7	119.5	163.2	-89.1	-105.1	0	0	0	108.5	N202	N202-Y204 PolarHBondContact O-N 3.31Å
205	Y	29.6	Very low	28.6	Very low	213 Å²	213	145.4 Å²	145.4	84%	0.835	75%	0.752	S	S	*	*			trans	-96.7	111	166.6	-113.2	-76.7	0	0	0	109.2	N203	N203-Y205 PolarHBondContact O-N 3.42Å
206	E	24.6	Very low	29	Very low	178 Å²	178	145.1 Å²	145.1	83%	0.832	76%	0.755	S	S	*	*			trans	-82.6	137.8	169.1	-175.2	169.3	-133.8	0	0	109
207	S	31.8	Very low	29.5	Very low	109 Å²	109	144.7 Å²	144.7	76%	0.762	75%	0.754	S	S	*	*			trans	-148.8	88.9	178.4	66.8	0	0	0	0	112.2
208	D	29.2	Very low	29.9	Very low	135 Å²	135	147.4 Å²	147.4	72%	0.722	76%	0.762	S	S	*	*			trans	-59	131.5	167.4	-94.9	-32.7	0	0	0	112.1
209	I	34.8	Very low	30.1	Very low	169 Å²	169	148.6 Å²	148.6	87%	0.867	77%	0.769	S	S	*	*			trans	-132.2	134.2	152.6	-62.5	-174.7	0	0	0	108.2
210	K	32.4	Very low	30.4	Very low	152 Å²	152	150.1 Å²	150.1	66%	0.661	77%	0.773	S	S	*	*			trans	-105.6	146.8	-160.7	-63.2	177.6	177.2	176.6	0	113.9
211	H	30.1	Very low	30.5	Very low	159 Å²	159	152 Å²	152	74%	0.736	78%	0.779	S	S	*	*			trans	58.2	138.2	156.2	-55.5	-46.9	0	0	0	117.1
212	Y	31.8	Very low	30.8	Very low	226 Å²	226	152.1 Å²	152.1	89%	0.886	79%	0.787	S	S	*	*				-145.2	165.4	53.8	-104.3	-95.4	0	0	0	114.6
213	T	30.6	Very low	30.8	Very low	120 Å²	120	151 Å²	151	74%	0.736	79%	0.785	S	S	*	*			trans	-84.1	155.8	176.5	49.8	0	0	0	0	111.2
214	N	30	Very low	30.8	Very low	141 Å²	141	153.1 Å²	153.1	75%	0.754	80%	0.795	S	S	*	*				-173.7	171.9	76.5	-147	-10.7	0	0	0	114.9
215	T	34.2	Very low	30.8	Very low	108 Å²	108	147.3 Å²	147.3	66%	0.663	78%	0.783	S	S	*	*			trans	57.5	90.9	157	48.6	0	0	0	0	120.7
216	S	33.3	Very low	30.5	Very low	120 Å²	120	142.3 Å²	142.3	84%	0.839	78%	0.78	S	S	*	*				50.4	150.8	113.5	-54.6	0	0	0	0	123.3
217	P	34.5	Very low	30.6	Very low	121 Å²	121	141.1 Å²	141.1	79%	0.786	78%	0.778	S	S	*	*			trans	-117.6	163.1	-151.3	41.3	-30.1	0	0	0	116.4
218	T	33.2	Very low	30.2	Very low	145 Å²	145	141 Å²	141	89%	0.89	78%	0.777	S	S	*	*			trans	-131.2	136.4	157.5	46.1	0	0	0	0	112.5
219	L	28.3	Very low	30.1	Very low	161 Å²	161	141.7 Å²	141.7	84%	0.843	78%	0.78	S	S	*	*			trans	-55.4	130.2	178.1	-179.9	76.3	0	0	0	113.5
220	N	31.6	Very low	29.7	Very low	151 Å²	151	140.3 Å²	140.3	81%	0.807	78%	0.78	S	S	*	*			trans	-169.8	132.6	139.8	-100	-28.6	0	0	0	114.9
221	Q	29.4	Very low	29.5	Very low	166 Å²	166	138.4 Å²	138.4	78%	0.776	78%	0.781	S	S	*	*			trans	37	118.4	148	-150.3	168.7	26.9	0	0	121	T223	Q221-T223 PolarHBondContact O-N 3.48Å
222	P	31.7	Very low	29.5	Very low	125 Å²	125	137 Å²	137	81%	0.812	78%	0.784	S	S	*	*			trans	-78.6	109.3	169.1	31.7	-32	0	0	0	111.6
223	T	30.6	Very low	29.5	Very low	116 Å²	116	132.2 Å²	132.2	71%	0.712	78%	0.778	S	S	*	*			trans	-67.7	136	166.9	-56.5	0	0	0	0	110.2	Q221 V225	Q221-T223 PolarHBondContact O-N 3.48Å; T223-V225 PolarHBondContact O-N 3.2Å; T223-V225 VanDerWaalsContact O-N 3.1Å
224	I	27	Very low	29.5	Very low	164 Å²	164	132.5 Å²	132.5	84%	0.841	78%	0.78	S	S	*	*			trans	-70.5	106.5	173.9	-61.1	170.7	0	0	0	108.6
225	V	27.3	Very low	29.3	Very low	114 Å²	114	132 Å²	132	69%	0.691	78%	0.782	S	S	*	*			trans	-96.8	109.4	172.9	-180	0	0	0	0	108.9	T223 L227	T223-V225 PolarHBondContact O-N 3.2Å; T223-V225 VanDerWaalsContact O-N 3.1Å; V225-L227 PolarHBondContact O-N 3.04Å; V225-L227 VanDerWaalsContact O-N 3.15Å
226	S	24.8	Very low	29.1	Very low	109 Å²	109	132.2 Å²	132.2	76%	0.762	78%	0.783	S	S	*	*			trans	-72.5	101.5	173.8	41.2	0	0	0	0	110.9	S228	S226-S228 PolarHBondContact O-N 2.97Å; S226-S228 VanDerWaalsContact O-N 3.15Å
227	L	25.9	Very low	29	Very low	152 Å²	152	131 Å²	131	80%	0.796	77%	0.771	S	S	*	*			trans	-74.6	94.6	174.5	-77.4	165.1	0	0	0	111.3	V225 L229	V225-L227 PolarHBondContact O-N 3.04Å; V225-L227 VanDerWaalsContact O-N 3.15Å; L227-L229 PolarHBondContact O-N 3.21Å
228	S	24.4	Very low	29.2	Very low	106 Å²	106	130.9 Å²	130.9	74%	0.741	77%	0.77	S	S	*	*			trans	-78.9	108.5	165.2	57.9	0	0	0	0	110.4	S226 T230	S226-S228 PolarHBondContact O-N 2.97Å; S226-S228 VanDerWaalsContact O-N 3.15Å; S228-T230 PolarHBondContact O-N 3.32Å
229	L	26.8	Very low	29.6	Very low	151 Å²	151	128.5 Å²	128.5	79%	0.791	76%	0.756	S	S	*	*			trans	-82	101.5	170.3	-75.8	89	0	0	0	110.5	L227 T231	L227-L229 PolarHBondContact O-N 3.21Å; L229-T231 PolarHBondContact O-N 3.13Å
230	T	24.8	Very low	30.5	Very low	139 Å²	139	123.3 Å²	123.3	85%	0.853	73%	0.733	S	S	*	*			trans	-80.6	96.4	164.6	25.1	0	0	0	0	110.3	S228	S228-T230 PolarHBondContact O-N 3.32Å
231	T	30.1	Very low	31	Very low	113 Å²	113	118.5 Å²	118.5	69%	0.693	71%	0.709	S	S	*	*			trans	-89.3	119.3	172.9	-51.6	0	0	0	0	110.1	L229 V233	L229-T231 PolarHBondContact O-N 3.13Å; T231-V233 PolarHBondContact O-N 3.41Å
232	T	28.2	Very low	31.9	Very low	129 Å²	129	114.8 Å²	114.8	79%	0.791	69%	0.693	S	S	*	*			trans	-73.1	119.7	175.8	31.5	0	0	0	0	111.4	T234	T232-T234 PolarHBondContact O-N 3.37Å
233	V	32.1	Very low	33	Very low	126 Å²	126	112 Å²	112	76%	0.764	67%	0.671	S	S	*	*			trans	-77.9	114.1	176.6	179.9	0	0	0	0	110.1	T231	T231-V233 PolarHBondContact O-N 3.41Å
234	T	30.2	Very low	33.9	Very low	125 Å²	125	111.8 Å²	111.8	77%	0.767	66%	0.662	S	S	*	*			trans	-102.4	131.2	163.7	43.6	0	0	0	0	110	T232 T236	T232-T234 PolarHBondContact O-N 3.37Å; T234-T236 PolarHBondContact O-N 3.1Å
235	T	27.6	Very low	35	Very low	132 Å²	132	105.8 Å²	105.8	81%	0.81	64%	0.637	S	S	*	*			trans	-86.2	101.6	-166.2	42.9	0	0	0	0	113.2
236	T	29.5	Very low	36.2	Very low	111 Å²	111	100.6 Å²	100.6	68%	0.681	61%	0.606	S	S	*	*			trans	-154.3	134	163.9	23	0	0	0	0	113.4	T234	T234-T236 PolarHBondContact O-N 3.1Å
237	T	30.4	Very low	37.7	Very low	96 Å²	96	100.6 Å²	100.6	59%	0.589	60%	0.597	S	S	*	*			trans	64.5	134.7	168.3	66.9	0	0	0	0	118.2	T239 S240	T237-T239 PolarHBondContact O-N 3.33Å; T237-S240 PolarHBondContact O-N 3.11Å; T237-S240 PolarHBondContact O-OG 2.84Å
238	P	39.2	Very low	39.2	Very low	117 Å²	117	98.2 Å²	98.2	76%	0.76	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-6.1	-175.4	31.4	-36.8	0	0	0	114.6	S240	P238-S240 PolarHBondContact O-N 3.33Å
239	T	42.2	Very low	40.6	Very low	96 Å²	96	94 Å²	94	59%	0.589	56%	0.556	S	S	*	*	H	α-helix	trans	-76.4	-7.8	176.4	41.6	0	0	0	0	113.8	T237 N243	T237-T239 PolarHBondContact O-N 3.33Å; T239-N243 PolarHBondContact O-ND2 3.3Å; T239-N243 VanDerWaalsContact O-ND2 3.16Å
240	S	46.3	Very low	41.9	Very low	52 Å²	52	87 Å²	87	36%	0.364	52%	0.52	S	S	.	.	H	α-helix	trans	-76.9	-38.2	-177.5	53.2	0	0	0	0	113.8	T237 P238 N243 Q244	T237-S240 PolarHBondContact O-N 3.11Å; T237-S240 PolarHBondContact O-OG 2.84Å; P238-S240 PolarHBondContact O-N 3.33Å; S240-N243 PolarHBondContact O-N 3.46Å; S240-Q244 PolarHBondContact O-N 3.24Å
241	V	43.6	Very low	43.5	Very low	50 Å²	50	83.2 Å²	83.2	30%	0.303	50%	0.503	S	S	.	.	H	α-helix	trans	-74.7	-38.2	-168.3	-161.6	0	0	0	0	112.7	N243 Q244 A245 F344 L348	V241-N243 PolarHBondContact O-N 3.45Å; V241-Q244 PolarHBondContact O-N 2.94Å; V241-A245 PolarHBondContact O-N 2.88Å; V241-F344 HydrophobicContact CB-CE1 4.2Å; V241-F344 HydrophobicContact CG1-CE1 3.77Å; V241-F344 HydrophobicContact CG1-CZ 4.45Å; V241-L348 HydrophobicContact CG1-CD1 4.46Å
242	I	48.2	Very low	44.9	Very low	88 Å²	88	80 Å²	80	45%	0.451	48%	0.481	S	S	.	.	H	α-helix	trans	-57.8	-40.4	174.4	-59.3	174.9	0	0	0	110.3	Q244 A245 A246	I242-Q244 VanDerWaalsContact C-N 3.32Å; I242-Q244 PolarHBondContact O-N 3.25Å; I242-A245 PolarHBondContact O-N 3.03Å; I242-A246 WeakPolarHBondContact O-CB 3.25Å; I242-A246 PolarHBondContact O-N 3.21Å
243	N	53.2	Low	46.2	Very low	66 Å²	66	74 Å²	74	35%	0.353	45%	0.445	S	S	.	.	H	α-helix	trans	-69.5	-24.2	177.7	-72.1	-31.7	0	0	0	113.6	T239 S240 V241 L247	T239-N243 PolarHBondContact O-ND2 3.3Å; T239-N243 VanDerWaalsContact O-ND2 3.16Å; S240-N243 PolarHBondContact O-N 3.46Å; V241-N243 PolarHBondContact O-N 3.45Å; N243-L247 WeakPolarHBondContact O-CB 3.26Å; N243-L247 WeakPolarHBondContact O-CD1 3.46Å; N243-L247 VanDerWaalsContact O-CG 3.25Å; N243-L247 WeakPolarHBondContact O-CG 3.48Å; N243-L247 PolarHBondContact O-N 2.85Å; N243-L247 VanDerWaalsContact O-N 3.11Å
244	Q	50.9	Low	47.3	Very low	112 Å²	112	72.9 Å²	72.9	52%	0.523	43%	0.429	S	S	.	.	H	α-helix	trans	-75.6	-47.3	174	-70.8	-173.5	-8.7	0	0	111.5	S240 V241 I242 A246 L247 I248	S240-Q244 PolarHBondContact O-N 3.24Å; V241-Q244 PolarHBondContact O-N 2.94Å; I242-Q244 VanDerWaalsContact C-N 3.32Å; I242-Q244 PolarHBondContact O-N 3.25Å; Q244-A246 PolarHBondContact O-N 3.33Å; Q244-L247 PolarHBondContact O-N 3Å; Q244-I248 WeakPolarHBondContact O-CB 3.35Å; Q244-I248 WeakPolarHBondContact O-CD1 3.17Å; Q244-I248 VanDerWaalsContact O-CG1 3.27Å; Q244-I248 WeakPolarHBondContact O-CG1 3.49Å; Q244-I248 PolarHBondContact O-N 3.4Å
245	A	49.2	Very low	48.5	Very low	38 Å²	38	69.5 Å²	69.5	31%	0.314	42%	0.415	S	S	.	.	H	α-helix	trans	-57.7	-39.7	173.7	0	0	0	0	0	111.6	V241 I242 A249	V241-A245 PolarHBondContact O-N 2.88Å; I242-A245 PolarHBondContact O-N 3.03Å; A245-A249 WeakPolarHBondContact O-CB 3.42Å; A245-A249 PolarHBondContact O-N 3.28Å
246	A	52.5	Low	49.7	Very low	5 Å²	5	63.7 Å²	63.7	4%	0.041	38%	0.379	C	S	.	.	H	α-helix	trans	-56.5	-57.3	172.9	0	0	0	0	0	113.5	I242 Q244 I248 A249 A250 M490	I242-A246 WeakPolarHBondContact O-CB 3.25Å; I242-A246 PolarHBondContact O-N 3.21Å; Q244-A246 PolarHBondContact O-N 3.33Å; A246-I248 VanDerWaalsContact C-N 3.31Å; A246-I248 PolarHBondContact O-N 2.94Å; A246-A249 PolarHBondContact O-N 2.69Å; A246-A250 PolarHBondContact O-N 3.28Å; A246-M490 WeakPolarHBondContact CA-SD 3.4Å; A246-M490 HydrophobicContact CB-CB 4.29Å; A246-M490 HydrophobicContact CB-CE 3.53Å; A246-M490 HydrophobicContact CB-CG 3.6Å; A246-M490 HydrophobicContact CB-SD 3.34Å; A246-M490 WeakPolarHBondContact CB-SD 3.36Å
247	L	55.8	Low	50.8	Low	108 Å²	108	58.5 Å²	58.5	57%	0.565	35%	0.348	S	S	*	.	H	α-helix	trans	-63.2	-37.8	-177.8	-74.3	167.1	0	0	0	111.9	N243 Q244 A251	N243-L247 WeakPolarHBondContact O-CB 3.26Å; N243-L247 WeakPolarHBondContact O-CD1 3.46Å; N243-L247 VanDerWaalsContact O-CG 3.25Å; N243-L247 WeakPolarHBondContact O-CG 3.48Å; N243-L247 PolarHBondContact O-N 2.85Å; N243-L247 VanDerWaalsContact O-N 3.11Å; Q244-L247 PolarHBondContact O-N 3Å; L247-A251 VanDerWaalsContact O-CB 3.29Å; L247-A251 WeakPolarHBondContact O-CB 3.47Å; L247-A251 PolarHBondContact O-N 3.27Å
248	I	58.7	Low	51.7	Low	102 Å²	102	58 Å²	58	52%	0.523	34%	0.342	S	S	.	.	H	α-helix	trans	-63.9	-51.2	174.7	-68.7	165.7	0	0	0	110.1	Q244 A246 A250 A251 L252	Q244-I248 WeakPolarHBondContact O-CB 3.35Å; Q244-I248 WeakPolarHBondContact O-CD1 3.17Å; Q244-I248 VanDerWaalsContact O-CG1 3.27Å; Q244-I248 WeakPolarHBondContact O-CG1 3.49Å; Q244-I248 PolarHBondContact O-N 3.4Å; A246-I248 VanDerWaalsContact C-N 3.31Å; A246-I248 PolarHBondContact O-N 2.94Å; I248-A250 VanDerWaalsContact C-N 3.27Å; I248-A250 PolarHBondContact O-N 2.78Å; I248-A251 PolarHBondContact O-N 2.97Å; I248-L252 HydrophobicContact CG2-CD1 3.68Å; I248-L252 HydrophobicContact CG2-CG 4.37Å; I248-L252 WeakPolarHBondContact O-CB 3.38Å; I248-L252 WeakPolarHBondContact O-CD1 3.47Å; I248-L252 WeakPolarHBondContact O-CG 3.49Å; I248-L252 PolarHBondContact O-N 3.44Å
249	A	54.3	Low	52.1	Low	17 Å²	17	61.2 Å²	61.2	14%	0.14	34%	0.343	C	S	.	.	H	α-helix	trans	-57.6	-39.1	178.9	0	0	0	0	0	112.6	A245 A246 A253	A245-A249 WeakPolarHBondContact O-CB 3.42Å; A245-A249 PolarHBondContact O-N 3.28Å; A246-A249 PolarHBondContact O-N 2.69Å; A249-A253 PolarHBondContact O-N 3.32Å
250	A	54	Low	52.3	Low	5 Å²	5	58.1 Å²	58.1	4%	0.041	33%	0.325	C	S	.	.	H	α-helix	trans	-76.3	-37.2	179.3	0	0	0	0	0	113.4	A246 I248 L252 A253 K254 A487	A246-A250 PolarHBondContact O-N 3.28Å; I248-A250 VanDerWaalsContact C-N 3.27Å; I248-A250 PolarHBondContact O-N 2.78Å; A250-L252 VanDerWaalsContact C-N 3.26Å; A250-L252 PolarHBondContact O-N 2.86Å; A250-A253 PolarHBondContact O-N 3.47Å; A250-K254 PolarHBondContact O-N 2.97Å; A250-A487 HydrophobicContact CB-CB 3.46Å; A250-A487 VanDerWaalsContact CB-CB 3.46Å
251	A	57.2	Low	51.8	Low	60 Å²	60	63.1 Å²	63.1	50%	0.496	34%	0.344	S	S	.	.	H	α-helix	trans	-61.9	-36.2	171	0	0	0	0	0	111.8	L247 I248 K254 A255	L247-A251 VanDerWaalsContact O-CB 3.29Å; L247-A251 WeakPolarHBondContact O-CB 3.47Å; L247-A251 PolarHBondContact O-N 3.27Å; I248-A251 PolarHBondContact O-N 2.97Å; A251-K254 PolarHBondContact O-N 3.12Å; A251-A255 PolarHBondContact O-N 3.38Å
252	L	59.8	Low	51.2	Low	45 Å²	45	68.7 Å²	68.7	24%	0.236	37%	0.372	C	S	.	.	H	α-helix	trans	-72.3	-36.2	174.3	-66.7	168.2	0	0	0	112.8	I248 A250 K254 A255 S256 L355	I248-L252 HydrophobicContact CG2-CD1 3.68Å; I248-L252 HydrophobicContact CG2-CG 4.37Å; I248-L252 WeakPolarHBondContact O-CB 3.38Å; I248-L252 WeakPolarHBondContact O-CD1 3.47Å; I248-L252 WeakPolarHBondContact O-CG 3.49Å; I248-L252 PolarHBondContact O-N 3.44Å; A250-L252 VanDerWaalsContact C-N 3.26Å; A250-L252 PolarHBondContact O-N 2.86Å; L252-K254 VanDerWaalsContact C-N 3.29Å; L252-K254 PolarHBondContact O-N 3.08Å; L252-A255 PolarHBondContact O-N 3.48Å; L252-S256 VanDerWaalsContact O-CB 3.24Å; L252-S256 WeakPolarHBondContact O-CB 3.34Å; L252-S256 PolarHBondContact O-N 3.15Å; L252-L355 HydrophobicContact CD1-CD2 3.38Å; L252-L355 HydrophobicContact CD1-CG 3.73Å; L252-L355 HydrophobicContact CD2-CD2 3.5Å; L252-L355 VanDerWaalsContact CD2-CD2 3.5Å; L252-L355 HydrophobicContact CG-CD2 4.05Å
253	A	55.2	Low	50.3	Low	4 Å²	4	66.4 Å²	66.4	3%	0.033	37%	0.37	C	S	.	.	H	α-helix	trans	-62.6	-37	171.5	0	0	0	0	0	112	A249 A250 S256 A257 L357 A483 W540	A249-A253 PolarHBondContact O-N 3.32Å; A250-A253 PolarHBondContact O-N 3.47Å; A253-S256 WeakPolarHBondContact O-CB 3.33Å; A253-S256 PolarHBondContact O-N 3.41Å; A253-A257 PolarHBondContact O-N 3.06Å; A253-A257 VanDerWaalsContact O-N 3.12Å; A253-L357 HydrophobicContact CB-CD2 3.72Å; A253-A483 HydrophobicContact CB-CB 4.02Å; A253-W540 HydrophobicContact CB-CD2 4.31Å; A253-W540 HydrophobicContact CB-CE3 4.2Å; A253-W540 HydrophobicContact CB-CZ3 4.41Å
254	K	56.3	Low	49.1	Very low	101 Å²	101	69.6 Å²	69.6	44%	0.439	39%	0.394	S	S	.	.	H	α-helix	trans	-64.9	-52.2	171.7	-171.7	176.2	-178.7	175.1	0	111.7	A250 A251 L252 S256 A257 D258 T480 A483	A250-K254 PolarHBondContact O-N 2.97Å; A251-K254 PolarHBondContact O-N 3.12Å; L252-K254 VanDerWaalsContact C-N 3.29Å; L252-K254 PolarHBondContact O-N 3.08Å; K254-S256 PolarHBondContact O-N 3.18Å; K254-A257 PolarHBondContact O-N 3.31Å; K254-A257 VanDerWaalsContact O-N 3.14Å; K254-D258 PolarHBondContact O-N 2.93Å; K254-T480 HydrophobicContact CG-CG2 4.26Å; K254-A483 HydrophobicContact CB-CB 4.43Å
255	A	54.2	Low	48.3	Very low	55 Å²	55	74.2 Å²	74.2	46%	0.455	41%	0.413	S	S	.	.	H	α-helix	trans	-62.7	-24	177.6	0	0	0	0	0	113.8	A251 L252 K259	A251-A255 PolarHBondContact O-N 3.38Å; L252-A255 PolarHBondContact O-N 3.48Å; A255-K259 WeakPolarHBondContact O-CB 3.48Å
256	S	53.2	Low	47.4	Very low	10 Å²	10	76.9 Å²	76.9	7%	0.07	43%	0.429	C	S	.	.	H	α-helix	trans	-69.1	-52.3	170.7	176.2	0	0	0	0	111.9	L252 A253 K254 D258 K259 T260 L357	L252-S256 VanDerWaalsContact O-CB 3.24Å; L252-S256 WeakPolarHBondContact O-CB 3.34Å; L252-S256 PolarHBondContact O-N 3.15Å; A253-S256 WeakPolarHBondContact O-CB 3.33Å; A253-S256 PolarHBondContact O-N 3.41Å; K254-S256 PolarHBondContact O-N 3.18Å; S256-D258 VanDerWaalsContact C-N 3.27Å; S256-D258 PolarHBondContact O-N 3.19Å; S256-K259 PolarHBondContact O-N 3.16Å; S256-T260 PolarHBondContact O-N 2.79Å; S256-L357 WeakPolarHBondContact CB-O 3.44Å; S256-L357 PolarHBondContact OG-O 3.27Å
257	A	52.5	Low	46.2	Very low	2 Å²	2	83 Å²	83	2%	0.017	46%	0.461	C	S	.	.	H	α-helix	trans	-56.8	-41.9	-179.6	0	0	0	0	0	112	A253 K254 K259 T260 T480 W540	A253-A257 PolarHBondContact O-N 3.06Å; A253-A257 VanDerWaalsContact O-N 3.12Å; K254-A257 PolarHBondContact O-N 3.31Å; K254-A257 VanDerWaalsContact O-N 3.14Å; A257-K259 PolarHBondContact O-N 2.89Å; A257-T260 PolarHBondContact O-OG1 3.16Å; A257-T480 VanDerWaalsContact CB-OG1 3.29Å; A257-T480 WeakPolarHBondContact CB-OG1 3.49Å; A257-W540 HydrophobicContact CB-CH2 4.12Å
258	D	49.5	Very low	45	Very low	86 Å²	86	83.7 Å²	83.7	46%	0.46	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-13.7	-179	-58.8	-19.6	0	0	0	113	K254 S256 T480	K254-D258 PolarHBondContact O-N 2.93Å; S256-D258 VanDerWaalsContact C-N 3.27Å; S256-D258 PolarHBondContact O-N 3.19Å; D258-T480 WeakPolarHBondContact OD1-CG2 3.49Å; D258-T480 PolarHBondContact OD1-OG1 3.07Å
259	K	48.1	Very low	43.5	Very low	184 Å²	184	86.3 Å²	86.3	80%	0.8	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-13.2	-177.8	-158.5	168	-173.3	177.2	0	113.7	A255 S256 A257 M261	A255-K259 WeakPolarHBondContact O-CB 3.48Å; S256-K259 PolarHBondContact O-N 3.16Å; A257-K259 PolarHBondContact O-N 2.89Å; K259-M261 PolarHBondContact O-N 3.48Å
260	T	45.8	Very low	42.3	Very low	31 Å²	31	96.2 Å²	96.2	19%	0.19	51%	0.508	C	S	.	.	S	Bend	trans	-73.5	94	174.7	24	0	0	0	0	112.7	S256 A257 F359 G434	S256-T260 PolarHBondContact O-N 2.79Å; A257-T260 PolarHBondContact O-OG1 3.16Å; T260-F359 HydrophobicContact CG2-CB 4.29Å; T260-F359 HydrophobicContact CG2-CD2 3.73Å; T260-F359 HydrophobicContact CG2-CE2 4.49Å; T260-F359 HydrophobicContact CG2-CG 4.35Å; T260-G434 WeakPolarHBondContact O-CA 3.45Å
261	M	34.9	Very low	41.2	Very low	157 Å²	157	101.8 Å²	101.8	77%	0.773	54%	0.541	S	S	*	.			trans	66.4	62.6	156.1	-57.8	-60.3	-70.5	0	0	118	K259 G263	K259-M261 PolarHBondContact O-N 3.48Å; M261-G263 VanDerWaalsContact C-N 3.27Å; M261-G263 PolarHBondContact O-N 3.41Å
262	N	31.4	Very low	39.7	Very low	166 Å²	166	105 Å²	105	89%	0.888	56%	0.555	S	S	*	*			trans	-66.8	85.2	152.8	-88.1	-58.2	0	0	0	110.5
263	G	30.6	Very low	38.2	Very low	40 Å²	40	108.8 Å²	108.8	41%	0.412	58%	0.58	S	S	.	*			trans	-132.8	123.9	177.3	0	0	0	0	0	111.6	M261 F265	M261-G263 VanDerWaalsContact C-N 3.27Å; M261-G263 PolarHBondContact O-N 3.41Å; G263-F265 PolarHBondContact O-N 3.32Å
264	P	28.2	Very low	37	Very low	133 Å²	133	116 Å²	116	86%	0.864	62%	0.617	S	S	*	*			trans	-78	95.9	-170.6	30.6	-35.3	0	0	0	112.5
265	F	33.9	Very low	35.8	Very low	210 Å²	210	116.4 Å²	116.4	92%	0.921	63%	0.629	S	S	*	*			trans	-92.7	95.3	167.9	-91.7	-82.9	0	0	0	111.4	G263	G263-F265 PolarHBondContact O-N 3.32Å
266	S	29.6	Very low	34.7	Very low	93 Å²	93	121.4 Å²	121.4	65%	0.65	65%	0.647	S	S	*	*			trans	-71.8	129.6	164	53.5	0	0	0	0	109.9	I268	S266-I268 PolarHBondContact O-N 2.93Å
267	L	27.1	Very low	33.5	Very low	134 Å²	134	127.1 Å²	127.1	70%	0.702	68%	0.677	S	S	*	*			trans	-82.6	57.9	-174.1	-147.5	169	0	0	0	111.3
268	I	30.5	Very low	32.6	Very low	122 Å²	122	134.1 Å²	134.1	63%	0.626	71%	0.714	S	S	*	*			trans	-93.5	127.7	172	-88.9	59.5	0	0	0	109	S266 R270	S266-I268 PolarHBondContact O-N 2.93Å; I268-R270 HydrophobicContact CG2-CG 4.21Å; I268-R270 PolarHBondContact O-N 2.83Å; I268-R270 VanDerWaalsContact O-N 3.08Å
269	E	28.5	Very low	31.8	Very low	158 Å²	158	136.6 Å²	136.6	74%	0.738	73%	0.727	S	S	*	*			trans	-72.1	98.7	173.2	-68.3	176.6	170	0	0	109.7	T271	E269-T271 PolarHBondContact O-N 3.17Å; E269-T271 VanDerWaalsContact O-N 3.17Å
270	R	27.5	Very low	31.1	Very low	225 Å²	225	133.5 Å²	133.5	85%	0.849	72%	0.724	S	S	*	*			trans	-82.1	86.4	170	-76.5	-170.9	174.2	150	0.7	110.5	I268 T272	I268-R270 HydrophobicContact CG2-CG 4.21Å; I268-R270 PolarHBondContact O-N 2.83Å; I268-R270 VanDerWaalsContact O-N 3.08Å; R270-T272 PolarHBondContact O-N 3.39Å
271	T	30.4	Very low	30.5	Very low	121 Å²	121	140.2 Å²	140.2	74%	0.742	76%	0.758	S	S	*	*			trans	-52	120.2	161.7	-56.8	0	0	0	0	109.4	E269 T273	E269-T271 PolarHBondContact O-N 3.17Å; E269-T271 VanDerWaalsContact O-N 3.17Å; T271-T273 PolarHBondContact O-N 3.2Å
272	T	27.4	Very low	30.5	Very low	129 Å²	129	136.2 Å²	136.2	79%	0.791	76%	0.757	S	S	*	*			trans	-80.4	100.6	-173.6	48	0	0	0	0	112	R270	R270-T272 PolarHBondContact O-N 3.39Å
273	T	27.2	Very low	30.6	Very low	123 Å²	123	135.9 Å²	135.9	76%	0.755	75%	0.752	S	S	*	*			trans	-132.4	109.1	164.1	54.6	0	0	0	0	110.3	T271	T271-T273 PolarHBondContact O-N 3.2Å
274	I	29.6	Very low	30.9	Very low	157 Å²	157	140.7 Å²	140.7	81%	0.805	77%	0.766	S	S	*	*			trans	-146.4	137.3	179.9	-53.1	176.1	0	0	0	107.4
275	P	31	Very low	31.2	Very low	108 Å²	108	140.6 Å²	140.6	70%	0.701	76%	0.758	S	S	*	*			cis	-121.7	-171.8	-30.9	39	-23.9	0	0	0	110.3
276	L	32.1	Very low	31.4	Very low	160 Å²	160	136.3 Å²	136.3	84%	0.838	75%	0.745	S	S	*	*				-170	120.2	127.2	-106.2	159.9	0	0	0	111.1
277	N	28.8	Very low	31.7	Very low	131 Å²	131	140.6 Å²	140.6	70%	0.701	75%	0.752	S	S	*	*			trans	-75.3	129.2	165.1	173.3	26.2	0	0	0	108.7
278	N	33.5	Very low	32.2	Very low	149 Å²	149	139.3 Å²	139.3	80%	0.797	75%	0.754	S	S	*	*			trans	-165.6	115.5	152.2	-98.7	-22	0	0	0	110.3
279	N	32	Very low	32.6	Very low	137 Å²	137	142.8 Å²	142.8	73%	0.733	76%	0.759	S	S	*	*			trans	-80.4	171	165.7	-82.2	-41.3	0	0	0	110.9
280	T	34.2	Very low	33.1	Very low	119 Å²	119	145 Å²	145	73%	0.73	76%	0.76	S	S	*	*			trans	65.5	106.4	162.4	41.8	0	0	0	0	119.6
281	L	33	Very low	33.4	Very low	172 Å²	172	141.8 Å²	141.8	90%	0.901	76%	0.76	S	S	*	*				69.3	136.9	129.6	-60.3	164.7	0	0	0	120.3
282	G	33.1	Very low	33.6	Very low	74 Å²	74	141.7 Å²	141.7	76%	0.763	76%	0.764	S	S	*	*			trans	127.6	72.6	146.3	0	0	0	0	0	119.1
283	M	35.3	Very low	33.8	Very low	158 Å²	158	142.6 Å²	142.6	78%	0.778	76%	0.764	S	S	*	*			trans	30.5	126.4	142.7	-61.9	-110.3	83	0	0	122
284	M	35.2	Very low	34.1	Very low	142 Å²	142	143.7 Å²	143.7	70%	0.7	77%	0.77	S	S	*	*			trans	77.5	113.5	135	-70.4	-173.6	175.3	0	0	123.1
285	N	35.6	Very low	34.4	Very low	130 Å²	130	143.6 Å²	143.6	70%	0.695	77%	0.77	S	S	*	*				93.9	121.8	122.6	-70.4	-16.7	0	0	0	123.7
286	N	37.5	Very low	34.6	Very low	120 Å²	120	143.4 Å²	143.4	64%	0.642	77%	0.768	S	S	*	*			trans	81.6	94.1	138.4	-71.3	-35.8	0	0	0	122.6
287	K	35.7	Very low	34.4	Very low	184 Å²	184	142.5 Å²	142.5	80%	0.8	76%	0.764	S	S	*	*				43.8	113.3	117	-62.9	171	178.8	169.5	0	118.8
288	S	38.8	Very low	34.9	Very low	106 Å²	106	145 Å²	145	74%	0.741	77%	0.771	S	S	*	*				179.1	132.4	109.8	-86.2	0	0	0	0	117.8
289	R	38.8	Very low	34.6	Very low	196 Å²	196	145.3 Å²	145.3	74%	0.74	77%	0.773	S	S	*	*			trans	67	112.5	135.7	-65.9	-179.6	175.4	-167.3	-0	123.1
290	R	38.1	Very low	34.9	Very low	203 Å²	203	146.4 Å²	146.4	77%	0.766	78%	0.778	S	S	*	*				80.5	115.7	120.7	-66.5	178.1	-177.5	172.5	-2.2	122
291	N	33.1	Very low	34.8	Very low	159 Å²	159	149.2 Å²	149.2	85%	0.85	78%	0.782	S	S	*	*			trans	-5.9	140.8	138.7	-42.2	10.8	0	0	0	119.1
292	S	34.7	Very low	34.5	Very low	118 Å²	118	148.4 Å²	148.4	83%	0.825	78%	0.778	S	S	*	*				-157.5	167.7	114.6	-160.1	0	0	0	0	111.5
293	L	32.2	Very low	34.4	Very low	149 Å²	149	149.8 Å²	149.8	78%	0.78	78%	0.776	S	S	*	*			trans	-93.1	152	-178.5	-67.7	64.8	0	0	0	111.6
294	T	34.4	Very low	34.1	Very low	145 Å²	145	146.6 Å²	146.6	89%	0.89	77%	0.769	S	S	*	*				-166.9	153.7	126.1	25.9	0	0	0	0	113.3
295	I	34.4	Very low	34.3	Very low	156 Å²	156	148.2 Å²	148.2	80%	0.8	78%	0.779	S	S	*	*			trans	-130.9	146.2	171.2	-43.1	168.5	0	0	0	102.6
296	P	36.4	Very low	34.3	Very low	103 Å²	103	148.1 Å²	148.1	67%	0.669	78%	0.779	S	S	*	*			cis	-154.7	178.5	48.1	44.6	-22.5	0	0	0	120.2
297	N	28.3	Very low	34.5	Very low	141 Å²	141	148.6 Å²	148.6	75%	0.754	78%	0.781	S	S	*	*			trans	28	124.4	146.2	-59.1	-0.6	0	0	0	121.4
298	H	37.7	Very low	34.6	Very low	183 Å²	183	147.8 Å²	147.8	85%	0.847	78%	0.781	S	S	*	*			trans	-142.9	130.7	139.7	-91.9	-77.7	0	0	0	111.3
299	N	28.5	Very low	34.5	Very low	156 Å²	156	148.3 Å²	148.3	83%	0.834	78%	0.784	S	S	*	*			trans	-77.6	144.2	160	-68.6	-19	0	0	0	108.7
300	I	37.5	Very low	34.4	Very low	161 Å²	161	148 Å²	148	83%	0.826	79%	0.788	S	S	*	*			trans	-160.1	125	152.4	-113.7	152.4	0	0	0	113.8
301	H	32.5	Very low	34.3	Very low	177 Å²	177	146 Å²	146	82%	0.819	79%	0.792	S	S	*	*			trans	64.1	151.4	145.1	-142.5	-98.7	0	0	0	122.8
302	L	26.4	Very low	34.6	Very low	155 Å²	155	145.6 Å²	145.6	81%	0.812	79%	0.788	S	S	*	*			trans	-125.7	133.4	-174.5	178.8	89.2	0	0	0	108.7
303	S	31.9	Very low	34.5	Very low	104 Å²	104	144.2 Å²	144.2	73%	0.727	78%	0.778	S	S	*	*			trans	-164.5	123.5	162.9	54.5	0	0	0	0	114.4
304	S	28.2	Very low	34.7	Very low	90 Å²	90	144 Å²	144	63%	0.629	77%	0.773	S	S	*	*			trans	19.1	133.8	148.1	-174	0	0	0	0	121.2	D306	S304-D306 PolarHBondContact OG-OD2 2.71Å
305	L	39.6	Very low	34.7	Very low	176 Å²	176	145 Å²	145	92%	0.921	77%	0.766	S	S	*	*			trans	-151.1	114.8	130.9	-109.1	160.1	0	0	0	108.9
306	D	36.5	Very low	34.4	Very low	129 Å²	129	142.7 Å²	142.7	69%	0.69	76%	0.759	S	S	*	*			trans	-77.5	154.7	174.3	-56.6	-84.7	0	0	0	111.6	S304	S304-D306 PolarHBondContact OG-OD2 2.71Å
307	D	41	Very low	34.1	Very low	129 Å²	129	142.8 Å²	142.8	69%	0.69	76%	0.762	S	S	*	*				-175.6	143.9	115.1	-117.3	-16.4	0	0	0	116.1
308	Q	38.4	Very low	34.2	Very low	167 Å²	167	141 Å²	141	78%	0.78	76%	0.76	S	S	*	*			trans	57	141.8	146.8	-65.1	174.9	65.8	0	0	120.2
309	S	36.5	Very low	34.1	Very low	117 Å²	117	137.7 Å²	137.7	82%	0.818	76%	0.758	S	S	*	*			cis	-149.1	-165.1	14.5	58.9	0	0	0	0	113.1
310	K	35.4	Very low	34	Very low	189 Å²	189	139 Å²	139	82%	0.822	76%	0.759	S	S	*	*			trans	-116.3	-179.5	-156.9	-65.6	178.7	175.1	175	0	115.4
311	L	36.8	Very low	34	Very low	161 Å²	161	141 Å²	141	84%	0.843	76%	0.762	S	S	*	*			trans	93.4	137.1	160.1	-57.8	134.6	0	0	0	114.2
312	I	38.4	Very low	33.8	Very low	152 Å²	152	140.2 Å²	140.2	78%	0.779	76%	0.758	S	S	*	*			cis	-146	163.5	14.7	-121.6	151.8	0	0	0	114.2
313	S	34	Very low	34.2	Very low	88 Å²	88	141.2 Å²	141.2	62%	0.615	76%	0.756	S	S	*	*			trans	-62.8	167.6	174	-84.8	0	0	0	0	115
314	Q	36.5	Very low	34	Very low	144 Å²	144	142.1 Å²	142.1	67%	0.673	75%	0.752	S	S	*	*			cis	-162.3	-172.4	3.5	-119.8	165.5	73.7	0	0	107.4
315	K	33.4	Very low	34.4	Very low	167 Å²	167	144.2 Å²	144.2	73%	0.726	75%	0.751	S	S	*	*			cis	-143.7	-129.9	9.8	-152.3	159.2	-172.6	157.5	0	113.3
316	T	28.2	Very low	34	Very low	108 Å²	108	143 Å²	143	66%	0.663	74%	0.741	S	S	*	*			trans	-153.7	160.4	-165.6	57.5	0	0	0	0	111.9
317	S	30.4	Very low	33.9	Very low	104 Å²	104	143.1 Å²	143.1	73%	0.727	74%	0.74	S	S	*	*			trans	60.3	149.3	142.4	59.5	0	0	0	0	120.6
318	S	30.7	Very low	33.4	Very low	104 Å²	104	142.2 Å²	142.2	73%	0.727	74%	0.744	S	S	*	*			cis	-178.4	170.4	-13.9	51.4	0	0	0	0	109.7
319	S	34.5	Very low	33.4	Very low	114 Å²	114	138.7 Å²	138.7	80%	0.797	74%	0.738	S	S	*	*			trans	120.7	132.2	149	-46.9	0	0	0	0	116.3
320	E	27.6	Very low	33.1	Very low	182 Å²	182	139.6 Å²	139.6	85%	0.85	73%	0.734	S	S	*	*			trans	-88.5	157.2	166.3	-54	153.2	107.1	0	0	110.9
321	K	36.9	Very low	33	Very low	205 Å²	205	137.6 Å²	137.6	89%	0.891	73%	0.732	S	S	*	*			trans	-179	122.7	136.4	-101.9	154.3	-172.4	175.3	0	114.8
322	H	29.6	Very low	33	Very low	159 Å²	159	139.5 Å²	139.5	74%	0.736	74%	0.736	S	S	*	*			trans	32.1	121.8	131.6	-113.2	-89.9	0	0	0	120.8
323	F	33.1	Very low	32.7	Very low	177 Å²	177	140.6 Å²	140.6	78%	0.776	74%	0.738	S	S	*	*			trans	-144.9	151	132.1	-160.4	-101.3	0	0	0	110.5	E325	F323-E325 HydrophobicContact CE1-CB 4.32Å
324	I	29.4	Very low	32.5	Very low	122 Å²	122	142 Å²	142	63%	0.626	75%	0.749	S	S	*	*			trans	-142.8	131.5	179.4	-66.3	177.1	0	0	0	107.4
325	E	34.9	Very low	32.3	Very low	134 Å²	134	142.2 Å²	142.2	63%	0.626	75%	0.753	S	S	*	*			trans	-172.6	127	149	-104.9	163.8	172.4	0	0	108.6	F323	F323-E325 HydrophobicContact CE1-CB 4.32Å
326	Q	32.3	Very low	32.2	Very low	152 Å²	152	142.4 Å²	142.4	71%	0.71	76%	0.762	S	S	*	*				69.6	144.8	101.3	-68.7	-176.7	22	0	0	114.8
327	I	34.3	Very low	32.4	Very low	130 Å²	130	148.7 Å²	148.7	67%	0.667	77%	0.774	S	S	*	*			cis	-162.7	147	-4.5	-114.6	165.7	0	0	0	108.2
328	S	31.2	Very low	32.6	Very low	111 Å²	111	150.3 Å²	150.3	78%	0.776	77%	0.774	S	S	*	*			trans	53.6	156.6	158.6	-72.4	0	0	0	0	121
329	S	36.5	Very low	32.7	Very low	92 Å²	92	156.1 Å²	156.1	64%	0.643	78%	0.779	S	S	*	*			cis	-169	151.2	-13	46.8	0	0	0	0	111.1
330	N	31.5	Very low	32.7	Very low	137 Å²	137	155.4 Å²	155.4	73%	0.733	78%	0.775	S	S	*	*			trans	74.4	151.1	157.8	-60.9	3.8	0	0	0	120.1
331	D	33.7	Very low	33.1	Very low	147 Å²	147	149.9 Å²	149.9	79%	0.786	76%	0.756	S	S	*	*			trans	47.5	104.8	157.5	-47.5	-31.7	0	0	0	117.5
332	E	35.1	Very low	33.2	Very low	200 Å²	200	146.8 Å²	146.8	94%	0.935	75%	0.745	S	S	*	*				-155	-179.3	77.7	-112.8	-170.4	162.8	0	0	115.4
333	Q	32.5	Very low	33.6	Very low	175 Å²	175	146.4 Å²	146.4	82%	0.818	74%	0.743	S	S	*	*			trans	-91.2	162.6	-176.5	-62.3	177.2	-2.4	0	0	113.4
334	S	31.1	Very low	33.9	Very low	119 Å²	119	142.8 Å²	142.8	83%	0.832	73%	0.727	S	S	*	*			trans	59.8	62.6	155	54.2	0	0	0	0	119.4
335	L	32.1	Very low	34.1	Very low	147 Å²	147	141.8 Å²	141.8	77%	0.77	72%	0.723	S	S	*	*			trans	-140.4	81.8	162.4	-156.2	78.5	0	0	0	113.8
336	N	31	Very low	34.2	Very low	171 Å²	171	141.4 Å²	141.4	91%	0.914	73%	0.726	S	S	*	*	S	Bend	trans	-151.1	28.7	177.6	-111.3	-31.4	0	0	0	114.5
337	R	31.4	Very low	34.5	Very low	241 Å²	241	139.3 Å²	139.3	91%	0.909	72%	0.719	S	S	*	*	S	Bend	trans	-142.6	16.6	-176.6	-139.4	-179.4	-166.3	-174.8	4	115.9
338	L	35.2	Very low	34.8	Very low	138 Å²	138	138.3 Å²	138.3	72%	0.723	71%	0.714	S	S	*	*			trans	-131.1	29.5	-172.8	-81.5	165.6	0	0	0	112.9
339	R	32	Very low	35	Very low	225 Å²	225	140.2 Å²	140.2	85%	0.849	72%	0.716	S	S	*	*			trans	-108.1	18.4	-172.5	-136.6	-179.5	-167	-146.6	0.8	115
340	S	35.2	Very low	34.9	Very low	100 Å²	100	138.1 Å²	138.1	70%	0.699	70%	0.701	S	S	*	*	S	Bend	trans	-123.7	11	-172.5	64.5	0	0	0	0	114.4
341	S	36.6	Very low	34.9	Very low	65 Å²	65	139.9 Å²	139.9	46%	0.455	71%	0.711	S	S	.	*	S	Bend	trans	-94	-41.3	172	46.9	0	0	0	0	112.1	E343 F344	S341-E343 VanDerWaalsContact C-N 3.29Å; S341-E343 PolarHBondContact O-N 3.13Å; S341-F344 VanDerWaalsContact O-CB 3.23Å; S341-F344 WeakPolarHBondContact O-CB 3.48Å; S341-F344 PolarHBondContact O-N 3.15Å
342	E	38.3	Very low	35	Very low	141 Å²	141	136.8 Å²	136.8	66%	0.659	70%	0.697	S	S	*	*	H	α-helix	trans	-71.1	-22	-172.8	-62.8	176.7	172.8	0	0	113.3	F344 N346	E342-F344 VanDerWaalsContact C-N 3.28Å; E342-N346 PolarHBondContact O-ND2 2.9Å
343	E	38.3	Very low	34.8	Very low	151 Å²	151	131.7 Å²	131.7	71%	0.706	68%	0.681	S	S	*	*	H	α-helix	trans	-73	-19.6	169.9	-66.3	-173.6	140.9	0	0	112.9	S341	S341-E343 VanDerWaalsContact C-N 3.29Å; S341-E343 PolarHBondContact O-N 3.13Å
344	F	38.4	Very low	35.1	Very low	100 Å²	100	126.4 Å²	126.4	44%	0.439	66%	0.658	S	S	.	*	H	α-helix	trans	-79.5	-44.7	-178.3	-168.4	-106.3	0	0	0	111.6	V241 S341 E342 L347	V241-F344 HydrophobicContact CB-CE1 4.2Å; V241-F344 HydrophobicContact CG1-CE1 3.77Å; V241-F344 HydrophobicContact CG1-CZ 4.45Å; S341-F344 VanDerWaalsContact O-CB 3.23Å; S341-F344 WeakPolarHBondContact O-CB 3.48Å; S341-F344 PolarHBondContact O-N 3.15Å; E342-F344 VanDerWaalsContact C-N 3.28Å; F344-L347 WeakPolarHBondContact O-CB 3.27Å; F344-L347 PolarHBondContact O-N 3.19Å; F344-L347 VanDerWaalsContact O-N 3.16Å
345	D	35.3	Very low	35.4	Very low	101 Å²	101	125.5 Å²	125.5	54%	0.54	64%	0.643	S	S	.	*	H	α-helix	trans	-68.6	-36.5	179.1	-63.9	-40.7	0	0	0	112	L347 L348	D345-L347 PolarHBondContact O-N 3.23Å; D345-L348 PolarHBondContact O-N 3.21Å; D345-L348 VanDerWaalsContact O-N 3.09Å
346	N	35.3	Very low	35.6	Very low	126 Å²	126	122.8 Å²	122.8	67%	0.674	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-16.8	173.9	-79.2	-79.6	0	0	0	113.5	E342 L348	E342-N346 PolarHBondContact O-ND2 2.9Å; N346-L348 VanDerWaalsContact C-N 3.34Å
347	L	39	Very low	36.2	Very low	108 Å²	108	115.7 Å²	115.7	57%	0.565	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-17.6	174.2	-144.4	85	0	0	0	112.8	F344 D345	F344-L347 WeakPolarHBondContact O-CB 3.27Å; F344-L347 PolarHBondContact O-N 3.19Å; F344-L347 VanDerWaalsContact O-N 3.16Å; D345-L347 PolarHBondContact O-N 3.23Å
348	L	41.6	Very low	36.7	Very low	109 Å²	109	107 Å²	107	57%	0.571	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-26.7	-176.8	-67.4	168.9	0	0	0	113.4	V241 D345 N346	V241-L348 HydrophobicContact CG1-CD1 4.46Å; D345-L348 PolarHBondContact O-N 3.21Å; D345-L348 VanDerWaalsContact O-N 3.09Å; N346-L348 VanDerWaalsContact C-N 3.34Å
349	D	35.7	Very low	37.3	Very low	151 Å²	151	101.8 Å²	101.8	81%	0.807	54%	0.537	S	S	*	.	S	Bend	trans	-95.1	4.2	-177.3	-154.9	33	0	0	0	113.6
350	S	32.6	Very low	38.1	Very low	49 Å²	49	95.9 Å²	95.9	34%	0.343	53%	0.53	S	S	.	.	S	Bend	trans	-97.7	127.9	172.4	84.4	0	0	0	0	110.9	T352	S350-T352 PolarHBondContact O-N 3.27Å; S350-T352 PolarHBondContact OG-OG1 2.89Å
351	N	32.6	Very low	39.3	Very low	174 Å²	174	96 Å²	96	93%	0.93	52%	0.522	S	S	*	.			trans	-75	40.6	173.6	-79.3	-87.2	0	0	0	112.3
352	T	35.6	Very low	41	Very low	81 Å²	81	94.6 Å²	94.6	50%	0.497	51%	0.511	S	S	.	.			trans	-82.2	131.4	173.2	57.5	0	0	0	0	109.1	S350 I354	S350-T352 PolarHBondContact O-N 3.27Å; S350-T352 PolarHBondContact OG-OG1 2.89Å; T352-I354 PolarHBondContact O-N 2.99Å
353	P	31.5	Very low	43.2	Very low	93 Å²	93	95 Å²	95	60%	0.604	51%	0.513	S	S	*	.			trans	-77.8	94.7	-163	28.5	-35.1	0	0	0	112.6	L355	P353-L355 HydrophobicContact CB-CB 4.04Å; P353-L355 PolarHBondContact O-N 2.89Å
354	I	38.1	Very low	45.8	Very low	64 Å²	64	91.7 Å²	91.7	33%	0.328	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	22.6	158.8	-36.1	-175.5	0	0	0	111.1	T352	T352-I354 PolarHBondContact O-N 2.99Å
355	L	38.1	Very low	48.5	Very low	100 Å²	100	88 Å²	88	52%	0.524	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.6	-19.8	-134.3	-99.2	147.1	0	0	0	113.8	L252 P353 L357	L252-L355 HydrophobicContact CD1-CD2 3.38Å; L252-L355 HydrophobicContact CD1-CG 3.73Å; L252-L355 HydrophobicContact CD2-CD2 3.5Å; L252-L355 VanDerWaalsContact CD2-CD2 3.5Å; L252-L355 HydrophobicContact CG-CD2 4.05Å; P353-L355 HydrophobicContact CB-CB 4.04Å; P353-L355 PolarHBondContact O-N 2.89Å; L355-L357 PolarHBondContact O-N 3.26Å
356	D	35.9	Very low	51.3	Low	91 Å²	91	83.2 Å²	83.2	49%	0.487	45%	0.452	S	S	.	.			trans	-76.9	74.4	164.8	-159.5	-26	0	0	0	108.8	T358	D356-T358 PolarHBondContact O-N 2.94Å; D356-T358 WeakPolarHBondContact OD1-CG2 3.29Å; D356-T358 PolarHBondContact OD1-N 2.95Å; D356-T358 PolarHBondContact OD1-OG1 3.09Å
357	L	43	Very low	54.3	Low	22 Å²	22	77.8 Å²	77.8	12%	0.115	42%	0.424	C	S	.	.			trans	-87.5	87.8	157.7	-85.2	71.4	0	0	0	106.4	A253 S256 L355 W540 R543	A253-L357 HydrophobicContact CB-CD2 3.72Å; S256-L357 WeakPolarHBondContact CB-O 3.44Å; S256-L357 PolarHBondContact OG-O 3.27Å; L355-L357 PolarHBondContact O-N 3.26Å; L357-W540 HydrophobicContact CD2-CG 4.46Å; L357-R543 VanDerWaalsContact CD1-NH1 3.32Å
358	T	41.8	Very low	57.1	Low	57 Å²	57	72.6 Å²	72.6	35%	0.35	40%	0.397	S	S	.	.			trans	-120.7	146.8	156.7	60.3	0	0	0	0	109	D356 S360	D356-T358 PolarHBondContact O-N 2.94Å; D356-T358 WeakPolarHBondContact OD1-CG2 3.29Å; D356-T358 PolarHBondContact OD1-N 2.95Å; D356-T358 PolarHBondContact OD1-OG1 3.09Å; T358-S360 VanDerWaalsContact CB-OG 3.23Å; T358-S360 WeakPolarHBondContact CB-OG 3.26Å; T358-S360 PolarHBondContact O-N 3.27Å; T358-S360 VanDerWaalsContact O-N 3.1Å; T358-S360 WeakPolarHBondContact OG1-CB 3.38Å; T358-S360 PolarHBondContact OG1-OG 2.86Å
359	F	48.7	Very low	59.7	Low	30 Å²	30	69 Å²	69	13%	0.132	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-62.6	-14.8	176	-82.9	-103.2	0	0	0	112.5	T260 D361 V362 H432 W540	T260-F359 HydrophobicContact CG2-CB 4.29Å; T260-F359 HydrophobicContact CG2-CD2 3.73Å; T260-F359 HydrophobicContact CG2-CE2 4.49Å; T260-F359 HydrophobicContact CG2-CG 4.35Å; F359-D361 PolarHBondContact O-N 3.43Å; F359-V362 PolarHBondContact O-N 2.91Å; F359-H432 AromaticContact CD1-CE1 3.9Å; F359-H432 AromaticContact CE1-CE1 3.95Å; F359-H432 AromaticContact CE1-NE2 3.88Å; F359-W540 HydrophobicContact CD2-CZ2 4.46Å; F359-W540 AromaticContact CE2-CH2 3.98Å; F359-W540 HydrophobicContact CE2-CH2 3.98Å; F359-W540 AromaticContact CE2-CZ2 3.66Å; F359-W540 HydrophobicContact CE2-CZ2 3.66Å; F359-W540 HydrophobicContact CZ-CH2 4.14Å; F359-W540 HydrophobicContact CZ-CZ2 4.02Å
360	S	48.6	Very low	62.7	Low	100 Å²	100	61.8 Å²	61.8	70%	0.699	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-48.1	-37.8	179.9	-34.4	0	0	0	0	114.6	T358 V362	T358-S360 VanDerWaalsContact CB-OG 3.23Å; T358-S360 WeakPolarHBondContact CB-OG 3.26Å; T358-S360 PolarHBondContact O-N 3.27Å; T358-S360 VanDerWaalsContact O-N 3.1Å; T358-S360 WeakPolarHBondContact OG1-CB 3.38Å; T358-S360 PolarHBondContact OG1-OG 2.86Å; S360-V362 PolarHBondContact O-N 3.03Å
361	D	59.9	Low	65.9	Low	102 Å²	102	61.6 Å²	61.6	55%	0.545	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-64.1	-24.8	179.8	-89.4	8	0	0	0	113.7	F359 Q363 K539	F359-D361 PolarHBondContact O-N 3.43Å; D361-Q363 PolarHBondContact O-N 2.88Å; D361-K539 VanDerWaalsContact CG-NZ 3.32Å; D361-K539 IonicContact OD2-NZ 3.69Å; D361-K539 PolarHBondContact OD2-NZ 3.28Å
362	V	73.2	Confident	69	Low	36 Å²	36	53.4 Å²	53.4	22%	0.218	29%	0.286	C	S	.	.			trans	-97.5	96.4	-168.4	-163.7	0	0	0	0	109.2	F359 S360 Y364 N535 K539	F359-V362 PolarHBondContact O-N 2.91Å; S360-V362 PolarHBondContact O-N 3.03Å; V362-Y364 VanDerWaalsContact CG1-O 3.3Å; V362-Y364 WeakPolarHBondContact CG1-O 3.39Å; V362-Y364 PolarHBondContact O-N 2.94Å; V362-N535 HydrophobicContact CG1-CB 3.74Å; V362-K539 HydrophobicContact CG2-CD 3.93Å
363	Q	85	Confident	72	Confident	149 Å²	149	52 Å²	52	70%	0.696	28%	0.276	S	S	*	.	S	Bend	trans	-50.4	-26.5	-178	-171.4	179.1	16.6	0	0	114.3	D361	D361-Q363 PolarHBondContact O-N 2.88Å
364	Y	92.6	Very high	75.1	Confident	82 Å²	82	53.5 Å²	53.5	32%	0.322	28%	0.278	S	S	.	.			trans	-135	116.5	178.6	-51.7	-77	0	0	0	110.1	V362 C366 H382 A383 N535	V362-Y364 VanDerWaalsContact CG1-O 3.3Å; V362-Y364 WeakPolarHBondContact CG1-O 3.39Å; V362-Y364 PolarHBondContact O-N 2.94Å; Y364-C366 VanDerWaalsContact C-N 3.33Å; Y364-C366 PolarHBondContact O-N 3.17Å; Y364-H382 HydrophobicContact CD1-CB 3.51Å; Y364-H382 WeakPolarHBondContact CD1-O 3.35Å; Y364-H382 HydrophobicContact CD2-CB 3.96Å; Y364-H382 HydrophobicContact CE1-CB 3.83Å; Y364-H382 HydrophobicContact CE2-CB 4.26Å; Y364-H382 HydrophobicContact CG-CB 3.57Å; Y364-A383 CarbonylContact C-O 3.4Å; Y364-A383 VanDerWaalsContact CA-O 3.27Å; Y364-A383 WeakPolarHBondContact CA-O 3.28Å; Y364-N535 WeakPolarHBondContact O-CB 3.39Å; Y364-N535 PolarHBondContact O-ND2 3.27Å
365	W	93.6	Very high	77.9	Confident	24 Å²	24	53.2 Å²	53.2	9%	0.091	28%	0.28	C	S	.	.	S	Bend	trans	-70.9	-28.6	-173.6	66.5	-89.4	0	0	0	113	A383 R385 L430 H432 V437 L534 N535	W365-A383 HydrophobicContact CZ2-CB 4.24Å; W365-A383 PolarHBondContact N-O 3.01Å; W365-R385 PolarHBondContact NE1-O 3.24Å; W365-L430 HydrophobicContact CH2-CB 3.98Å; W365-L430 HydrophobicContact CH2-CD1 4.49Å; W365-L430 HydrophobicContact CZ2-CB 4.38Å; W365-H432 HydrophobicContact CD2-CB 3.78Å; W365-H432 HydrophobicContact CE3-CB 3.87Å; W365-H432 AromaticContact CE3-CG 3.97Å; W365-H432 HydrophobicContact CG-CB 4.32Å; W365-H432 HydrophobicContact CH2-CB 4.28Å; W365-H432 HydrophobicContact CZ2-CB 4.2Å; W365-H432 HydrophobicContact CZ3-CB 4.12Å; W365-V437 HydrophobicContact CH2-CG1 4.14Å; W365-V437 HydrophobicContact CZ3-CG1 3.9Å; W365-V437 HydrophobicContact CZ3-CG2 4Å; W365-L534 HydrophobicContact CE3-CD2 4.25Å; W365-L534 HydrophobicContact CZ3-CD2 3.93Å; W365-N535 PolarHBondContact O-N 3.26Å
366	C	95.8	Very high	80.8	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	160.1	167.2	69.8	0	0	0	0	112.9	Y364 A383 V532 H533 L534 N535	Y364-C366 VanDerWaalsContact C-N 3.33Å; Y364-C366 PolarHBondContact O-N 3.17Å; C366-A383 WeakPolarHBondContact O-CB 3.34Å; C366-A383 PolarHBondContact O-N 3.42Å; C366-A383 WeakPolarHBondContact SG-CB 3.45Å; C366-V532 HydrophobicContact CB-CG1 3.9Å; C366-H533 CarbonylContact C-O 3.58Å; C366-H533 WeakPolarHBondContact CA-O 3.49Å; C366-H533 WeakPolarHBondContact CB-O 3.4Å; C366-L534 HydrophobicContact CB-CD2 3.96Å; C366-N535 VanDerWaalsContact C-ND2 3.31Å
367	S	96.5	Very high	83.7	Confident	11 Å²	11	50 Å²	50	8%	0.077	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.8	171.1	-58.1	0	0	0	0	109	F381 H382 V532 H533 N535	S367-F381 CarbonylContact C-O 3.52Å; S367-F381 WeakPolarHBondContact CA-O 3.25Å; S367-H382 PolarHBondContact OG-CD2 3.19Å; S367-V532 WeakPolarHBondContact O-CA 3.47Å; S367-H533 PolarHBondContact N-O 2.85Å; S367-H533 PolarHBondContact O-N 2.85Å; S367-N535 PolarHBondContact N-ND2 2.99Å; S367-N535 PolarHBondContact OG-ND2 3.41Å; S367-N535 PolarHBondContact OG-OD1 2.71Å
368	V	97.8	Very high	86.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	130.9	-174.4	-171.7	0	0	0	0	111	A380 F381 L388 I390 F403 I530 E531 V532	V368-A380 WeakPolarHBondContact O-CA 3.41Å; V368-F381 HydrophobicContact CB-CB 4.39Å; V368-F381 PolarHBondContact N-O 3.19Å; V368-F381 PolarHBondContact O-N 2.83Å; V368-L388 HydrophobicContact CG2-CD2 3.87Å; V368-I390 HydrophobicContact CG1-CD1 4.03Å; V368-I390 HydrophobicContact CG2-CD1 4.29Å; V368-F403 HydrophobicContact CB-CD1 4.3Å; V368-F403 HydrophobicContact CB-CE1 4.31Å; V368-F403 HydrophobicContact CG1-CD1 4.05Å; V368-F403 HydrophobicContact CG1-CE1 3.98Å; V368-I530 HydrophobicContact CG1-CB 3.98Å; V368-I530 HydrophobicContact CG1-CD1 4.15Å; V368-I530 HydrophobicContact CG1-CG2 4.03Å; V368-E531 WeakPolarHBondContact CA-O 3.33Å; V368-V532 HydrophobicContact CG1-CG2 4.23Å; V368-V532 HydrophobicContact CG2-CG1 4.35Å; V368-V532 HydrophobicContact CG2-CG2 4.19Å
369	F	98.2	Very high	88.6	Confident	32 Å²	32	54.4 Å²	54.4	14%	0.14	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.3	179.5	-53.4	-87.6	0	0	0	109.2	Y371 A380 I530 E531 H533	F369-Y371 HydrophobicContact CB-CD2 4.46Å; F369-Y371 HydrophobicContact CB-CE2 3.68Å; F369-A380 HydrophobicContact CD1-CB 3.81Å; F369-A380 HydrophobicContact CE1-CB 3.52Å; F369-A380 HydrophobicContact CZ-CB 4.25Å; F369-I530 CarbonylContact O-C 3.6Å; F369-I530 WeakPolarHBondContact O-CA 3.46Å; F369-I530 WeakPolarHBondContact O-CB 3.17Å; F369-E531 PolarHBondContact N-O 3.15Å; F369-E531 PolarHBondContact O-N 3.1Å; F369-H533 HydrophobicContact CE2-CB 4.4Å; F369-H533 AromaticContact CE2-CE1 3.82Å; F369-H533 AromaticContact CE2-CG 3.86Å; F369-H533 AromaticContact CE2-ND1 3.45Å; F369-H533 WeakPolarHBondContact CE2-ND1 3.42Å
370	Y	98.3	Very high	90.8	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	142.2	177.4	176.4	-116.6	0	0	0	112.1	E372 V377 L405 L408 R421 C528 W529 I530	Y370-E372 HydrophobicContact CE1-CG 3.7Å; Y370-E372 WeakPolarHBondContact CE1-OE1 3.49Å; Y370-E372 WeakPolarHBondContact OH-CG 3.25Å; Y370-E372 PolarHBondContact OH-OE1 3.42Å; Y370-E372 VanDerWaalsContact OH-OE1 3.14Å; Y370-V377 HydrophobicContact CD1-CB 3.76Å; Y370-V377 HydrophobicContact CD1-CG1 3.9Å; Y370-V377 HydrophobicContact CE1-CB 4.01Å; Y370-V377 HydrophobicContact CE1-CG1 3.94Å; Y370-V377 PolarHBondContact O-N 2.88Å; Y370-L405 HydrophobicContact CD1-CD2 4.31Å; Y370-L405 HydrophobicContact CD2-CD1 3.8Å; Y370-L405 HydrophobicContact CD2-CD2 3.85Å; Y370-L405 HydrophobicContact CD2-CG 4.34Å; Y370-L405 HydrophobicContact CE2-CD1 3.83Å; Y370-L405 HydrophobicContact CE2-CD2 4.48Å; Y370-L405 HydrophobicContact CG-CD2 3.75Å; Y370-L408 HydrophobicContact CD1-CD1 3.52Å; Y370-L408 HydrophobicContact CE1-CD1 4.22Å; Y370-L408 HydrophobicContact CG-CD1 4.15Å; Y370-R421 PolarHBondContact OH-NH1 3.46Å; Y370-C528 HydrophobicContact CE2-CB 4.19Å; Y370-C528 PolarHBondContact OH-SG 3.02Å; Y370-C528 VanDerWaalsContact OH-SG 3.4Å; Y370-W529 VanDerWaalsContact CD2-O 3.22Å; Y370-W529 WeakPolarHBondContact CD2-O 3.41Å; Y370-I530 HydrophobicContact CD2-CG2 3.93Å
371	Y	98.6	Very high	93	Very high	46 Å²	46	50.1 Å²	50.1	18%	0.18	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	142.4	-176.8	-66.1	-92.8	0	0	0	112	F369 T375 R376 W529 E531	F369-Y371 HydrophobicContact CB-CD2 4.46Å; F369-Y371 HydrophobicContact CB-CE2 3.68Å; Y371-T375 CarbonylContact C-O 3.56Å; Y371-T375 WeakPolarHBondContact CA-O 3.32Å; Y371-R376 HydrophobicContact CD1-CB 3.88Å; Y371-R376 HydrophobicContact CE1-CB 3.63Å; Y371-R376 HydrophobicContact CE1-CG 4.2Å; Y371-W529 HydrophobicContact CD1-CH2 4.05Å; Y371-W529 AromaticContact CD1-CZ2 3.83Å; Y371-W529 HydrophobicContact CD1-CZ2 3.83Å; Y371-W529 HydrophobicContact CD2-CD2 4.11Å; Y371-W529 AromaticContact CD2-CE3 3.82Å; Y371-W529 HydrophobicContact CD2-CE3 3.82Å; Y371-W529 AromaticContact CD2-CH2 3.59Å; Y371-W529 HydrophobicContact CD2-CH2 3.59Å; Y371-W529 AromaticContact CD2-CZ2 3.88Å; Y371-W529 HydrophobicContact CD2-CZ2 3.88Å; Y371-W529 AromaticContact CD2-CZ3 3.57Å; Y371-W529 HydrophobicContact CD2-CZ3 3.57Å; Y371-W529 HydrophobicContact CE1-CH2 4.28Å; Y371-W529 HydrophobicContact CE1-CZ2 4.44Å; Y371-W529 HydrophobicContact CE2-CE3 4.5Å; Y371-W529 AromaticContact CE2-CH2 3.82Å; Y371-W529 HydrophobicContact CE2-CH2 3.82Å; Y371-W529 HydrophobicContact CE2-CZ2 4.47Å; Y371-W529 AromaticContact CE2-CZ3 3.85Å; Y371-W529 HydrophobicContact CE2-CZ3 3.85Å; Y371-W529 HydrophobicContact CG-CD2 4.15Å; Y371-W529 AromaticContact CG-CE2 3.75Å; Y371-W529 HydrophobicContact CG-CE3 4.3Å; Y371-W529 AromaticContact CG-CH2 3.72Å; Y371-W529 HydrophobicContact CG-CH2 3.72Å; Y371-W529 AromaticContact CG-CZ2 3.52Å; Y371-W529 HydrophobicContact CG-CZ2 3.52Å; Y371-W529 HydrophobicContact CG-CZ3 4.12Å; Y371-W529 PolarHBondContact N-O 3.5Å; Y371-W529 PolarHBondContact O-N 3.46Å; Y371-E531 HydrophobicContact CE2-CB 4.06Å
372	E	98.3	Very high	94.7	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.009	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	110.8	168.9	-66.8	-177.5	-175.5	0	0	107.7	Y370 N374 T375 V377 H410 R413 V417 R421 P527	Y370-E372 HydrophobicContact CE1-CG 3.7Å; Y370-E372 WeakPolarHBondContact CE1-OE1 3.49Å; Y370-E372 WeakPolarHBondContact OH-CG 3.25Å; Y370-E372 PolarHBondContact OH-OE1 3.42Å; Y370-E372 VanDerWaalsContact OH-OE1 3.14Å; E372-N374 PolarHBondContact O-N 3.01Å; E372-T375 PolarHBondContact N-O 3.41Å; E372-T375 PolarHBondContact O-N 3.45Å; E372-V377 HydrophobicContact CB-CG2 3.94Å; E372-V377 HydrophobicContact CG-CB 4.39Å; E372-V377 HydrophobicContact CG-CG2 3.86Å; E372-H410 IonicContact OE2-CE1 2.61Å; E372-H410 IonicContact OE2-CG 2.78Å; E372-H410 IonicContact OE2-ND1 3.88Å; E372-H410 PolarHBondContact OE2-ND1 2.8Å; E372-R413 IonicContact OE1-CZ 3.62Å; E372-R413 VanDerWaalsContact OE1-CZ 3.26Å; E372-R413 IonicContact OE1-NE 2.85Å; E372-R413 PolarHBondContact OE1-NE 2.87Å; E372-R413 IonicContact OE1-NH2 3.52Å; E372-R413 PolarHBondContact OE1-NH2 3.27Å; E372-R413 IonicContact OE2-CZ 3.87Å; E372-R413 IonicContact OE2-NE 3.15Å; E372-R413 PolarHBondContact OE2-NE 3.38Å; E372-R413 IonicContact OE2-NH2 2.69Å; E372-V417 HydrophobicContact CB-CG1 3.93Å; E372-V417 HydrophobicContact CB-CG2 4.49Å; E372-V417 VanDerWaalsContact CD-CG1 3.41Å; E372-V417 HydrophobicContact CG-CG1 3.63Å; E372-V417 WeakPolarHBondContact OE2-CG1 3.23Å; E372-R421 WeakPolarHBondContact OE1-CD 3.35Å; E372-R421 IonicContact OE1-CZ 2.72Å; E372-R421 IonicContact OE1-NE 3.19Å; E372-R421 IonicContact OE1-NH1 3.89Å; E372-R421 PolarHBondContact OE1-NH1 2.99Å; E372-P527 WeakPolarHBondContact CA-O 3.39Å
373	L	97.9	Very high	95.7	Very high	52 Å²	52	47.4 Å²	47.4	27%	0.272	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	-116.5	-167.8	-57.8	168.6	0	0	0	111.6	P414 V417 T524 T526 W529	L373-P414 HydrophobicContact CD1-CG 3.93Å; L373-V417 HydrophobicContact CD1-CG2 4.36Å; L373-V417 HydrophobicContact CG-CG2 4.15Å; L373-T524 CarbonylContact C-O 3.18Å; L373-T524 VanDerWaalsContact CA-O 3.26Å; L373-T524 WeakPolarHBondContact CA-O 3.41Å; L373-T526 WeakPolarHBondContact CA-O 3.29Å; L373-T526 PolarHBondContact N-O 3.38Å; L373-W529 PolarHBondContact O-NE1 3.32Å
374	N	97.1	Very high	95.9	Very high	123 Å²	123	42 Å²	42	66%	0.658	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-0.1	174.5	65.4	-18.5	0	0	0	113.6	E372 T524	E372-N374 PolarHBondContact O-N 3.01Å; N374-T524 HydrophobicContact CB-CG2 4.2Å
375	T	97.7	Very high	95.9	Very high	58 Å²	58	45.4 Å²	45.4	36%	0.356	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	125.1	-174.3	-62.5	0	0	0	0	110.4	Y371 E372 V377	Y371-T375 CarbonylContact C-O 3.56Å; Y371-T375 WeakPolarHBondContact CA-O 3.32Å; E372-T375 PolarHBondContact N-O 3.41Å; E372-T375 PolarHBondContact O-N 3.45Å; T375-V377 HydrophobicContact CG2-CG2 4.3Å
376	R	97.6	Very high	95.8	Very high	120 Å²	120	47.9 Å²	47.9	45%	0.453	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	132.2	169.9	-178.6	175	160.4	178.6	-6.1	109.6	Y371 G378	Y371-R376 HydrophobicContact CD1-CB 3.88Å; Y371-R376 HydrophobicContact CE1-CB 3.63Å; Y371-R376 HydrophobicContact CE1-CG 4.2Å; R376-G378 PolarHBondContact NE-O 3.38Å
377	V	97.3	Very high	95.8	Very high	5 Å²	5	50.2 Å²	50.2	3%	0.03	27%	0.268	C	S	.	.			trans	-124.4	113.7	-176.2	172.5	0	0	0	0	109.6	Y370 E372 T375 L408 H410	Y370-V377 HydrophobicContact CD1-CB 3.76Å; Y370-V377 HydrophobicContact CD1-CG1 3.9Å; Y370-V377 HydrophobicContact CE1-CB 4.01Å; Y370-V377 HydrophobicContact CE1-CG1 3.94Å; Y370-V377 PolarHBondContact O-N 2.88Å; E372-V377 HydrophobicContact CB-CG2 3.94Å; E372-V377 HydrophobicContact CG-CB 4.39Å; E372-V377 HydrophobicContact CG-CG2 3.86Å; T375-V377 HydrophobicContact CG2-CG2 4.3Å; V377-L408 HydrophobicContact CG1-CB 4Å; V377-H410 HydrophobicContact CG1-CB 4.05Å; V377-H410 HydrophobicContact CG2-CB 3.97Å
378	G	94.7	Very high	95.8	Very high	35 Å²	35	49.7 Å²	49.7	36%	0.361	27%	0.265	S	S	.	.	S	Bend	trans	83.3	176.1	-178.6	0	0	0	0	0	115.2	R376	R376-G378 PolarHBondContact NE-O 3.38Å
379	D	93.4	Very high	95.8	Very high	136 Å²	136	51.1 Å²	51.1	73%	0.727	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-72.4	169.6	178.8	-64.6	-54.5	0	0	0	112.6
380	A	94.6	Very high	95.7	Very high	22 Å²	22	49.6 Å²	49.6	18%	0.182	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-77.1	126.1	172.2	0	0	0	0	0	109.9	V368 F369 H382	V368-A380 WeakPolarHBondContact O-CA 3.41Å; F369-A380 HydrophobicContact CD1-CB 3.81Å; F369-A380 HydrophobicContact CE1-CB 3.52Å; F369-A380 HydrophobicContact CZ-CB 4.25Å; A380-H382 PolarHBondContact O-CE1 3.48Å; A380-H382 VanDerWaalsContact O-CE1 3.25Å; A380-H382 PolarHBondContact O-ND1 3.41Å
381	F	95	Very high	95.7	Very high	18 Å²	18	49.7 Å²	49.7	8%	0.079	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	136.8	171.4	-174.6	-81.1	0	0	0	109.7	S367 V368 L388 C397 R402 F403	S367-F381 CarbonylContact C-O 3.52Å; S367-F381 WeakPolarHBondContact CA-O 3.25Å; V368-F381 HydrophobicContact CB-CB 4.39Å; V368-F381 PolarHBondContact N-O 3.19Å; V368-F381 PolarHBondContact O-N 2.83Å; F381-L388 HydrophobicContact CD1-CD1 4.02Å; F381-L388 HydrophobicContact CD1-CD2 3.83Å; F381-L388 HydrophobicContact CE1-CD1 3.32Å; F381-L388 HydrophobicContact CE1-CD2 3.79Å; F381-L388 HydrophobicContact CE1-CG 4.19Å; F381-L388 HydrophobicContact CZ-CD1 3.68Å; F381-C397 HydrophobicContact CD2-CB 4.4Å; F381-C397 HydrophobicContact CE2-CB 4.23Å; F381-R402 VanDerWaalsContact CE2-O 3.24Å; F381-R402 WeakPolarHBondContact CE2-O 3.2Å; F381-F403 HydrophobicContact CB-CB 4.28Å; F381-F403 HydrophobicContact CB-CD1 3.57Å; F381-F403 HydrophobicContact CB-CD2 3.95Å; F381-F403 HydrophobicContact CB-CE1 3.73Å; F381-F403 HydrophobicContact CB-CE2 4.09Å; F381-F403 HydrophobicContact CB-CG 3.68Å; F381-F403 HydrophobicContact CB-CZ 3.99Å; F381-F403 HydrophobicContact CD1-CB 4.18Å; F381-F403 HydrophobicContact CD1-CG 4.5Å; F381-F403 HydrophobicContact CD2-CB 3.62Å; F381-F403 HydrophobicContact CD2-CD1 4.44Å; F381-F403 AromaticContact CD2-CD2 3.75Å; F381-F403 HydrophobicContact CD2-CD2 3.75Å; F381-F403 AromaticContact CD2-CG 3.71Å; F381-F403 HydrophobicContact CD2-CG 3.71Å; F381-F403 HydrophobicContact CE2-CB 3.95Å; F381-F403 HydrophobicContact CG-CB 3.75Å; F381-F403 AromaticContact CG-CD1 3.99Å; F381-F403 HydrophobicContact CG-CD1 3.99Å; F381-F403 HydrophobicContact CG-CD2 4.09Å; F381-F403 AromaticContact CG-CG 3.7Å; F381-F403 HydrophobicContact CG-CG 3.7Å; F381-F403 HydrophobicContact CZ-CB 4.38Å
382	H	95	Very high	95.6	Very high	81 Å²	81	48.4 Å²	48.4	38%	0.375	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	117.3	-175.4	-61.8	88.1	0	0	0	110.6	Y364 S367 A380 G384	Y364-H382 HydrophobicContact CD1-CB 3.51Å; Y364-H382 WeakPolarHBondContact CD1-O 3.35Å; Y364-H382 HydrophobicContact CD2-CB 3.96Å; Y364-H382 HydrophobicContact CE1-CB 3.83Å; Y364-H382 HydrophobicContact CE2-CB 4.26Å; Y364-H382 HydrophobicContact CG-CB 3.57Å; S367-H382 PolarHBondContact OG-CD2 3.19Å; A380-H382 PolarHBondContact O-CE1 3.48Å; A380-H382 VanDerWaalsContact O-CE1 3.25Å; A380-H382 PolarHBondContact O-ND1 3.41Å; H382-G384 PolarHBondContact O-N 3.06Å
383	A	93.9	Very high	95.6	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	97.6	-168.7	0	0	0	0	0	112.3	Y364 W365 C366 L388	Y364-A383 CarbonylContact C-O 3.4Å; Y364-A383 VanDerWaalsContact CA-O 3.27Å; Y364-A383 WeakPolarHBondContact CA-O 3.28Å; W365-A383 HydrophobicContact CZ2-CB 4.24Å; W365-A383 PolarHBondContact N-O 3.01Å; C366-A383 WeakPolarHBondContact O-CB 3.34Å; C366-A383 PolarHBondContact O-N 3.42Å; C366-A383 WeakPolarHBondContact SG-CB 3.45Å; A383-L388 HydrophobicContact CB-CB 4.49Å; A383-L388 HydrophobicContact CB-CD2 3.94Å
384	G	89.2	Confident	95.4	Very high	34 Å²	34	55.2 Å²	55.2	35%	0.351	30%	0.304	S	S	.	.			trans	-89.8	-7	179.9	0	0	0	0	0	114.6	H382 S400	H382-G384 PolarHBondContact O-N 3.06Å; G384-S400 PolarHBondContact N-O 3.19Å
385	R	92.3	Very high	95.1	Very high	154 Å²	154	52 Å²	52	58%	0.581	29%	0.285	S	S	*	.	S	Bend	trans	-113.4	146.3	175.4	-63.3	-59.9	-169.4	153.7	2.2	110	W365 T387 D401	W365-R385 PolarHBondContact NE1-O 3.24Å; R385-T387 PolarHBondContact O-N 3.22Å; R385-D401 HydrophobicContact CB-CB 4.13Å; R385-D401 HydrophobicContact CG-CB 4.05Å
386	P	93.2	Very high	94.2	Very high	77 Å²	77	52.5 Å²	52.5	50%	0.5	29%	0.289	S	S	.	.	S	Bend	trans	-67.9	3.8	-179.9	30.7	-37.8	0	0	0	113.8	H432	P386-H432 PolarHBondContact O-N 2.61Å
387	T	95.4	Very high	93	Very high	49 Å²	49	49.5 Å²	49.5	30%	0.301	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	130.9	171.4	-64.9	0	0	0	0	108.3	R385 R429 L430 H431	R385-T387 PolarHBondContact O-N 3.22Å; T387-R429 HydrophobicContact CG2-CG 3.66Å; T387-L430 VanDerWaalsContact CA-O 3.3Å; T387-L430 WeakPolarHBondContact CA-O 3.23Å; T387-H431 WeakPolarHBondContact CG2-ND1 3.34Å; T387-H431 PolarHBondContact OG1-ND1 3.45Å
388	L	96.1	Very high	91.7	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	123.4	178.9	169.4	57.2	0	0	0	109.2	V368 F381 A383 I390 D401 F403 R429 L430	V368-L388 HydrophobicContact CG2-CD2 3.87Å; F381-L388 HydrophobicContact CD1-CD1 4.02Å; F381-L388 HydrophobicContact CD1-CD2 3.83Å; F381-L388 HydrophobicContact CE1-CD1 3.32Å; F381-L388 HydrophobicContact CE1-CD2 3.79Å; F381-L388 HydrophobicContact CE1-CG 4.19Å; F381-L388 HydrophobicContact CZ-CD1 3.68Å; A383-L388 HydrophobicContact CB-CB 4.49Å; A383-L388 HydrophobicContact CB-CD2 3.94Å; L388-I390 HydrophobicContact CD1-CG1 4.35Å; L388-I390 HydrophobicContact CD2-CD1 4.04Å; L388-I390 HydrophobicContact CD2-CG1 4.02Å; L388-I390 HydrophobicContact CG-CD1 4.31Å; L388-I390 HydrophobicContact CG-CG1 3.81Å; L388-D401 CarbonylContact C-O 3.55Å; L388-D401 WeakPolarHBondContact CA-O 3.35Å; L388-D401 WeakPolarHBondContact CD1-O 3.5Å; L388-F403 HydrophobicContact CD1-CB 4.24Å; L388-R429 CarbonylContact O-C 3.6Å; L388-R429 WeakPolarHBondContact O-CA 3.45Å; L388-L430 PolarHBondContact N-O 2.97Å; L388-L430 PolarHBondContact O-N 3.37Å
389	T	97.2	Very high	90.7	Very high	29 Å²	29	63.8 Å²	63.8	18%	0.178	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.8	169.2	-55.1	0	0	0	0	109.6	D391 D401 R402 F403 I428 L442	T389-D391 HydrophobicContact CG2-CB 4.43Å; T389-D401 PolarHBondContact N-O 2.85Å; T389-R402 CarbonylContact O-C 3.58Å; T389-R402 WeakPolarHBondContact O-CA 3.33Å; T389-F403 PolarHBondContact O-N 3.08Å; T389-I428 WeakPolarHBondContact CA-O 3.45Å; T389-L442 HydrophobicContact CG2-CD1 4.06Å
390	I	97.7	Very high	90.1	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	113.3	178.9	-51.3	173.9	0	0	0	107.2	V368 L388 F403 L405 G427 I428 L430 F510 I530	V368-I390 HydrophobicContact CG1-CD1 4.03Å; V368-I390 HydrophobicContact CG2-CD1 4.29Å; L388-I390 HydrophobicContact CD1-CG1 4.35Å; L388-I390 HydrophobicContact CD2-CD1 4.04Å; L388-I390 HydrophobicContact CD2-CG1 4.02Å; L388-I390 HydrophobicContact CG-CD1 4.31Å; L388-I390 HydrophobicContact CG-CG1 3.81Å; I390-F403 WeakPolarHBondContact CA-O 3.42Å; I390-F403 HydrophobicContact CG1-CB 4.27Å; I390-F403 HydrophobicContact CG2-CB 4.31Å; I390-F403 HydrophobicContact CG2-CD1 4.07Å; I390-F403 HydrophobicContact CG2-CG 4.46Å; I390-L405 HydrophobicContact CG2-CD1 3.83Å; I390-L405 HydrophobicContact CG2-CD2 4.07Å; I390-L405 HydrophobicContact CG2-CG 3.91Å; I390-G427 CarbonylContact O-C 3.55Å; I390-G427 VanDerWaalsContact O-CA 3.31Å; I390-G427 WeakPolarHBondContact O-CA 3.4Å; I390-I428 HydrophobicContact CB-CG1 4Å; I390-I428 HydrophobicContact CD1-CD1 4.3Å; I390-I428 HydrophobicContact CD1-CG1 4.46Å; I390-I428 PolarHBondContact N-O 2.98Å; I390-I428 PolarHBondContact O-N 3.49Å; I390-L430 HydrophobicContact CD1-CD1 3.9Å; I390-L430 HydrophobicContact CD1-CG 4.38Å; I390-F510 HydrophobicContact CG2-CZ 4.18Å; I390-I530 HydrophobicContact CD1-CD1 3.57Å
391	D	97.6	Very high	89.9	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.016	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	173.8	-165.7	75.2	43.3	0	0	0	114.5	T389 F393 R402 F403 L405	T389-D391 HydrophobicContact CG2-CB 4.43Å; D391-F393 HydrophobicContact CB-CD2 4.09Å; D391-F393 WeakPolarHBondContact OD1-CA 3.37Å; D391-F393 WeakPolarHBondContact OD1-CB 3.29Å; D391-F393 PolarHBondContact OD1-N 3.11Å; D391-R402 IonicContact OD1-NH2 2.85Å; D391-R402 IonicContact OD2-CZ 3.91Å; D391-R402 IonicContact OD2-NE 2.86Å; D391-R402 PolarHBondContact OD2-NE 3.43Å; D391-R402 IonicContact OD2-NH2 3.04Å; D391-R402 PolarHBondContact OD2-NH2 3.41Å; D391-F403 PolarHBondContact N-O 3.15Å; D391-L405 VanDerWaalsContact O-CB 3.25Å; D391-L405 WeakPolarHBondContact O-CB 3.29Å; D391-L405 WeakPolarHBondContact O-CG 3.41Å; D391-L405 PolarHBondContact O-N 3.34Å
392	G	97.4	Very high	89.9	Confident	19 Å²	19	63.9 Å²	63.9	20%	0.196	33%	0.327	C	S	.	.	S	Bend	trans	-93.8	8	-178.5	0	0	0	0	0	114.7	G406 G425	G392-G406 WeakPolarHBondContact O-CA 3.24Å; G392-G425 PolarHBondContact N-O 3.1Å
393	F	96.4	Very high	89.9	Confident	96 Å²	96	60.4 Å²	60.4	42%	0.421	31%	0.31	S	S	.	.	S	Bend	trans	-86.6	-170.3	-179.4	-58	-65.3	0	0	0	111.3	D391 S404 G406 S407 R426	D391-F393 HydrophobicContact CB-CD2 4.09Å; D391-F393 WeakPolarHBondContact OD1-CA 3.37Å; D391-F393 WeakPolarHBondContact OD1-CB 3.29Å; D391-F393 PolarHBondContact OD1-N 3.11Å; F393-S404 WeakPolarHBondContact O-CB 3.4Å; F393-G406 WeakPolarHBondContact O-CA 3.43Å; F393-G406 PolarHBondContact O-N 2.97Å; F393-S407 PolarHBondContact O-N 3.37Å; F393-R426 HydrophobicContact CE2-CB 4.46Å; F393-R426 HydrophobicContact CE2-CG 3.97Å; F393-R426 HydrophobicContact CZ-CG 4.2Å
394	T	94.8	Very high	90	Very high	101 Å²	101	60.4 Å²	60.4	62%	0.62	31%	0.31	S	S	*	.			trans	-126	23.8	-168.8	62.1	0	0	0	0	113.4	P396	T394-P396 WeakPolarHBondContact O-CD 3.08Å
395	E	90	Very high	90.4	Very high	56 Å²	56	58.8 Å²	58.8	26%	0.262	29%	0.294	S	S	.	.			trans	-71.6	123.4	175.5	-169.4	175.2	-148.4	0	0	109.4	R399 R402 S404	E395-R399 IonicContact OE1-CZ 3.26Å; E395-R399 VanDerWaalsContact OE1-CZ 3.26Å; E395-R399 IonicContact OE1-NH1 2.78Å; E395-R399 PolarHBondContact OE1-NH1 2.7Å; E395-R399 IonicContact OE1-NH2 2.88Å; E395-R399 PolarHBondContact OE1-NH2 3.3Å; E395-R399 IonicContact OE2-NH1 2.89Å; E395-R399 PolarHBondContact OE2-NH1 2.87Å; E395-R402 WeakPolarHBondContact OE2-CD 3.43Å; E395-R402 IonicContact OE2-CZ 3.26Å; E395-R402 IonicContact OE2-NE 2.69Å; E395-R402 IonicContact OE2-NH1 2.69Å; E395-R402 PolarHBondContact OE2-NH1 3.25Å; E395-S404 PolarHBondContact N-OG 3.11Å; E395-S404 WeakPolarHBondContact O-CB 3.2Å; E395-S404 PolarHBondContact O-OG 3.37Å
396	P	79.7	Confident	90.5	Very high	67 Å²	67	52.6 Å²	52.6	44%	0.435	28%	0.278	S	S	.	.			trans	-61.5	141.9	-178.4	24.5	-34.3	0	0	0	111.6	T394 Y398	T394-P396 WeakPolarHBondContact O-CD 3.08Å; P396-Y398 HydrophobicContact CB-CD2 3.9Å; P396-Y398 HydrophobicContact CB-CE2 3.58Å; P396-Y398 HydrophobicContact CG-CD2 3.67Å; P396-Y398 HydrophobicContact CG-CE2 3.35Å; P396-Y398 PolarHBondContact O-N 2.84Å
397	C	71.9	Confident	90.5	Very high	58 Å²	58	51.6 Å²	51.6	39%	0.392	27%	0.273	S	S	.	.	S	Bend	trans	-76.5	44.7	-169	-63.3	0	0	0	0	114	F381 R399	F381-C397 HydrophobicContact CD2-CB 4.4Å; F381-C397 HydrophobicContact CE2-CB 4.23Å; C397-R399 PolarHBondContact O-N 3.33Å
398	Y	70.8	Confident	90.5	Very high	210 Å²	210	50.8 Å²	50.8	82%	0.824	27%	0.266	S	S	*	.			trans	-73.5	-11.7	173.9	-56.7	-52.1	0	0	0	113.3	P396	P396-Y398 HydrophobicContact CB-CD2 3.9Å; P396-Y398 HydrophobicContact CB-CE2 3.58Å; P396-Y398 HydrophobicContact CG-CD2 3.67Å; P396-Y398 HydrophobicContact CG-CE2 3.35Å; P396-Y398 PolarHBondContact O-N 2.84Å
399	R	72.9	Confident	90.4	Very high	130 Å²	130	55.8 Å²	55.8	49%	0.491	30%	0.302	S	S	.	.	S	Bend	trans	-112.5	139.3	177.2	-51.4	-166.3	-163.8	96.2	11.3	110.9	E395 C397 D401	E395-R399 IonicContact OE1-CZ 3.26Å; E395-R399 VanDerWaalsContact OE1-CZ 3.26Å; E395-R399 IonicContact OE1-NH1 2.78Å; E395-R399 PolarHBondContact OE1-NH1 2.7Å; E395-R399 IonicContact OE1-NH2 2.88Å; E395-R399 PolarHBondContact OE1-NH2 3.3Å; E395-R399 IonicContact OE2-NH1 2.89Å; E395-R399 PolarHBondContact OE2-NH1 2.87Å; C397-R399 PolarHBondContact O-N 3.33Å; R399-D401 WeakPolarHBondContact CB-OD1 3.36Å; R399-D401 PolarHBondContact O-N 3.12Å
400	S	80.8	Confident	90.3	Very high	47 Å²	47	56.2 Å²	56.2	33%	0.329	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	19.1	-178.7	53.6	0	0	0	0	114.7	G384	G384-S400 PolarHBondContact N-O 3.19Å
401	D	90.5	Very high	90.1	Very high	64 Å²	64	63 Å²	63	34%	0.342	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-4.7	178.5	62.2	-5	0	0	0	113.9	R385 L388 T389 R399	R385-D401 HydrophobicContact CB-CB 4.13Å; R385-D401 HydrophobicContact CG-CB 4.05Å; L388-D401 CarbonylContact C-O 3.55Å; L388-D401 WeakPolarHBondContact CA-O 3.35Å; L388-D401 WeakPolarHBondContact CD1-O 3.5Å; T389-D401 PolarHBondContact N-O 2.85Å; R399-D401 WeakPolarHBondContact CB-OD1 3.36Å; R399-D401 PolarHBondContact O-N 3.12Å
402	R	94.9	Very high	89.9	Confident	67 Å²	67	69.3 Å²	69.3	25%	0.253	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	120.2	-177.2	-166.4	-176.7	-169.9	171	5.7	113.3	F381 T389 D391 E395	F381-R402 VanDerWaalsContact CE2-O 3.24Å; F381-R402 WeakPolarHBondContact CE2-O 3.2Å; T389-R402 CarbonylContact O-C 3.58Å; T389-R402 WeakPolarHBondContact O-CA 3.33Å; D391-R402 IonicContact OD1-NH2 2.85Å; D391-R402 IonicContact OD2-CZ 3.91Å; D391-R402 IonicContact OD2-NE 2.86Å; D391-R402 PolarHBondContact OD2-NE 3.43Å; D391-R402 IonicContact OD2-NH2 3.04Å; D391-R402 PolarHBondContact OD2-NH2 3.41Å; E395-R402 WeakPolarHBondContact OE2-CD 3.43Å; E395-R402 IonicContact OE2-CZ 3.26Å; E395-R402 IonicContact OE2-NE 2.69Å; E395-R402 IonicContact OE2-NH1 2.69Å; E395-R402 PolarHBondContact OE2-NH1 3.25Å
403	F	95.7	Very high	89.9	Confident	7 Å²	7	71.1 Å²	71.1	3%	0.031	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	97.3	173.4	-172.6	-162.9	0	0	0	110.4	V368 F381 L388 T389 I390 D391 L405 L408	V368-F403 HydrophobicContact CB-CD1 4.3Å; V368-F403 HydrophobicContact CB-CE1 4.31Å; V368-F403 HydrophobicContact CG1-CD1 4.05Å; V368-F403 HydrophobicContact CG1-CE1 3.98Å; F381-F403 HydrophobicContact CB-CB 4.28Å; F381-F403 HydrophobicContact CB-CD1 3.57Å; F381-F403 HydrophobicContact CB-CD2 3.95Å; F381-F403 HydrophobicContact CB-CE1 3.73Å; F381-F403 HydrophobicContact CB-CE2 4.09Å; F381-F403 HydrophobicContact CB-CG 3.68Å; F381-F403 HydrophobicContact CB-CZ 3.99Å; F381-F403 HydrophobicContact CD1-CB 4.18Å; F381-F403 HydrophobicContact CD1-CG 4.5Å; F381-F403 HydrophobicContact CD2-CB 3.62Å; F381-F403 HydrophobicContact CD2-CD1 4.44Å; F381-F403 AromaticContact CD2-CD2 3.75Å; F381-F403 HydrophobicContact CD2-CD2 3.75Å; F381-F403 AromaticContact CD2-CG 3.71Å; F381-F403 HydrophobicContact CD2-CG 3.71Å; F381-F403 HydrophobicContact CE2-CB 3.95Å; F381-F403 HydrophobicContact CG-CB 3.75Å; F381-F403 AromaticContact CG-CD1 3.99Å; F381-F403 HydrophobicContact CG-CD1 3.99Å; F381-F403 HydrophobicContact CG-CD2 4.09Å; F381-F403 AromaticContact CG-CG 3.7Å; F381-F403 HydrophobicContact CG-CG 3.7Å; F381-F403 HydrophobicContact CZ-CB 4.38Å; L388-F403 HydrophobicContact CD1-CB 4.24Å; T389-F403 PolarHBondContact O-N 3.08Å; I390-F403 WeakPolarHBondContact CA-O 3.42Å; I390-F403 HydrophobicContact CG1-CB 4.27Å; I390-F403 HydrophobicContact CG2-CB 4.31Å; I390-F403 HydrophobicContact CG2-CD1 4.07Å; I390-F403 HydrophobicContact CG2-CG 4.46Å; D391-F403 PolarHBondContact N-O 3.15Å; F403-L405 HydrophobicContact CD1-CD2 3.85Å; F403-L405 HydrophobicContact CD2-CD2 4.15Å; F403-L405 HydrophobicContact CE1-CD2 3.64Å; F403-L405 HydrophobicContact CE2-CD2 3.96Å; F403-L405 HydrophobicContact CG-CD2 4.11Å; F403-L405 HydrophobicContact CZ-CD2 3.71Å; F403-L405 PolarHBondContact O-N 3.06Å; F403-L408 HydrophobicContact CE2-CD1 3.96Å; F403-L408 HydrophobicContact CZ-CD1 4.09Å
404	S	95.6	Very high	89.9	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	101.3	179.4	-56.4	0	0	0	0	110.5	F393 E395 G406 S407	F393-S404 WeakPolarHBondContact O-CB 3.4Å; E395-S404 PolarHBondContact N-OG 3.11Å; E395-S404 WeakPolarHBondContact O-CB 3.2Å; E395-S404 PolarHBondContact O-OG 3.37Å; S404-G406 VanDerWaalsContact C-N 3.28Å; S404-G406 PolarHBondContact O-N 2.87Å; S404-S407 PolarHBondContact O-OG 3.31Å; S404-S407 VanDerWaalsContact O-OG 3.12Å
405	L	96.7	Very high	90	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-70.7	-25.2	-178.6	-55.8	178.7	0	0	0	112.5	Y370 I390 D391 F403 S407 L408 R421 I424 F510	Y370-L405 HydrophobicContact CD1-CD2 4.31Å; Y370-L405 HydrophobicContact CD2-CD1 3.8Å; Y370-L405 HydrophobicContact CD2-CD2 3.85Å; Y370-L405 HydrophobicContact CD2-CG 4.34Å; Y370-L405 HydrophobicContact CE2-CD1 3.83Å; Y370-L405 HydrophobicContact CE2-CD2 4.48Å; Y370-L405 HydrophobicContact CG-CD2 3.75Å; I390-L405 HydrophobicContact CG2-CD1 3.83Å; I390-L405 HydrophobicContact CG2-CD2 4.07Å; I390-L405 HydrophobicContact CG2-CG 3.91Å; D391-L405 VanDerWaalsContact O-CB 3.25Å; D391-L405 WeakPolarHBondContact O-CB 3.29Å; D391-L405 WeakPolarHBondContact O-CG 3.41Å; D391-L405 PolarHBondContact O-N 3.34Å; F403-L405 HydrophobicContact CD1-CD2 3.85Å; F403-L405 HydrophobicContact CD2-CD2 4.15Å; F403-L405 HydrophobicContact CE1-CD2 3.64Å; F403-L405 HydrophobicContact CE2-CD2 3.96Å; F403-L405 HydrophobicContact CG-CD2 4.11Å; F403-L405 HydrophobicContact CZ-CD2 3.71Å; F403-L405 PolarHBondContact O-N 3.06Å; L405-S407 VanDerWaalsContact C-N 3.33Å; L405-S407 PolarHBondContact O-N 3.06Å; L405-L408 HydrophobicContact CD2-CD1 4.01Å; L405-L408 WeakPolarHBondContact O-CB 3.36Å; L405-L408 PolarHBondContact O-N 3.4Å; L405-L408 VanDerWaalsContact O-N 3.16Å; L405-R421 PolarHBondContact O-NH1 3.48Å; L405-R421 VanDerWaalsContact O-NH1 3.14Å; L405-R421 PolarHBondContact O-NH2 2.77Å; L405-I424 HydrophobicContact CD1-CD1 4.24Å; L405-F510 HydrophobicContact CD1-CE2 3.7Å; L405-F510 HydrophobicContact CD1-CZ 3.9Å
406	G	95.9	Very high	90.3	Very high	24 Å²	24	72.5 Å²	72.5	25%	0.247	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-64	-31.8	-174.5	0	0	0	0	0	114.2	G392 F393 S404 L408 R421	G392-G406 WeakPolarHBondContact O-CA 3.24Å; F393-G406 WeakPolarHBondContact O-CA 3.43Å; F393-G406 PolarHBondContact O-N 2.97Å; S404-G406 VanDerWaalsContact C-N 3.28Å; S404-G406 PolarHBondContact O-N 2.87Å; G406-L408 VanDerWaalsContact C-N 3.34Å; G406-R421 VanDerWaalsContact C-NH2 3.27Å; G406-R421 VanDerWaalsContact CA-NH2 3.31Å; G406-R421 PolarHBondContact O-NH2 3.25Å
407	S	92.7	Very high	91.2	Very high	57 Å²	57	69.4 Å²	69.4	40%	0.399	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-78.2	-12.3	176.1	43.8	0	0	0	0	114.3	F393 S404 L405 S409	F393-S407 PolarHBondContact O-N 3.37Å; S404-S407 PolarHBondContact O-OG 3.31Å; S404-S407 VanDerWaalsContact O-OG 3.12Å; L405-S407 VanDerWaalsContact C-N 3.33Å; L405-S407 PolarHBondContact O-N 3.06Å; S407-S409 PolarHBondContact O-N 2.96Å
408	L	95	Very high	92.4	Very high	31 Å²	31	70.2 Å²	70.2	16%	0.162	36%	0.364	C	S	.	.			trans	-70.1	124.4	179.4	-56.9	176.5	0	0	0	111.4	Y370 V377 F403 L405 G406 R413 R421	Y370-L408 HydrophobicContact CD1-CD1 3.52Å; Y370-L408 HydrophobicContact CE1-CD1 4.22Å; Y370-L408 HydrophobicContact CG-CD1 4.15Å; V377-L408 HydrophobicContact CG1-CB 4Å; F403-L408 HydrophobicContact CE2-CD1 3.96Å; F403-L408 HydrophobicContact CZ-CD1 4.09Å; L405-L408 HydrophobicContact CD2-CD1 4.01Å; L405-L408 WeakPolarHBondContact O-CB 3.36Å; L405-L408 PolarHBondContact O-N 3.4Å; L405-L408 VanDerWaalsContact O-N 3.16Å; G406-L408 VanDerWaalsContact C-N 3.34Å; L408-R413 PolarHBondContact O-NH1 3.4Å; L408-R413 PolarHBondContact O-NH2 2.6Å; L408-R421 PolarHBondContact O-NH2 2.89Å
409	S	94.7	Very high	93.7	Very high	106 Å²	106	64.6 Å²	64.6	74%	0.741	35%	0.346	S	S	*	.			trans	-85	146.6	176.7	55.4	0	0	0	0	111.8	S407	S407-S409 PolarHBondContact O-N 2.96Å
410	H	93.9	Very high	94.8	Very high	38 Å²	38	58.7 Å²	58.7	18%	0.176	32%	0.324	C	S	.	.			trans	-153.2	115	171.6	174.4	-153.3	0	0	0	107.2	E372 V377 R413	E372-H410 IonicContact OE2-CE1 2.61Å; E372-H410 IonicContact OE2-CG 2.78Å; E372-H410 IonicContact OE2-ND1 3.88Å; E372-H410 PolarHBondContact OE2-ND1 2.8Å; V377-H410 HydrophobicContact CG1-CB 4.05Å; V377-H410 HydrophobicContact CG2-CB 3.97Å; H410-R413 HydrophobicContact CB-CB 4.23Å; H410-R413 WeakPolarHBondContact O-CB 3.49Å; H410-R413 PolarHBondContact O-N 3.1Å
411	V	94.6	Very high	95.7	Very high	143 Å²	143	57.5 Å²	57.5	87%	0.867	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-37.9	-171.5	-179	0	0	0	0	111.7	R413	V411-R413 VanDerWaalsContact C-N 3.3Å; V411-R413 PolarHBondContact O-N 2.91Å
412	N	93.1	Very high	96	Very high	135 Å²	135	61.3 Å²	61.3	72%	0.722	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	25.5	-176.5	-59	-23.7	0	0	0	112.6	P414	N412-P414 VanDerWaalsContact O-CD 3.28Å; N412-P414 WeakPolarHBondContact O-CD 3.38Å
413	R	97.2	Very high	96.1	Very high	57 Å²	57	63.2 Å²	63.2	22%	0.215	33%	0.334	C	S	.	.			trans	-67.7	116.4	-177.5	178.4	176.7	-70	143.1	-0.9	111.1	E372 L408 H410 V411 V417 R421	E372-R413 IonicContact OE1-CZ 3.62Å; E372-R413 VanDerWaalsContact OE1-CZ 3.26Å; E372-R413 IonicContact OE1-NE 2.85Å; E372-R413 PolarHBondContact OE1-NE 2.87Å; E372-R413 IonicContact OE1-NH2 3.52Å; E372-R413 PolarHBondContact OE1-NH2 3.27Å; E372-R413 IonicContact OE2-CZ 3.87Å; E372-R413 IonicContact OE2-NE 3.15Å; E372-R413 PolarHBondContact OE2-NE 3.38Å; E372-R413 IonicContact OE2-NH2 2.69Å; L408-R413 PolarHBondContact O-NH1 3.4Å; L408-R413 PolarHBondContact O-NH2 2.6Å; H410-R413 HydrophobicContact CB-CB 4.23Å; H410-R413 WeakPolarHBondContact O-CB 3.49Å; H410-R413 PolarHBondContact O-N 3.1Å; V411-R413 VanDerWaalsContact C-N 3.3Å; V411-R413 PolarHBondContact O-N 2.91Å; R413-V417 HydrophobicContact CG-CB 4.01Å; R413-V417 HydrophobicContact CG-CG1 3.85Å; R413-R421 VanDerWaalsContact CZ-CZ 3.48Å
414	P	96.8	Very high	96.3	Very high	55 Å²	55	62.9 Å²	62.9	36%	0.357	33%	0.333	S	S	.	.			trans	-79.3	154	178	32.3	-33.7	0	0	0	111.6	L373 N412 Q416 V417 E418	L373-P414 HydrophobicContact CD1-CG 3.93Å; N412-P414 VanDerWaalsContact O-CD 3.28Å; N412-P414 WeakPolarHBondContact O-CD 3.38Å; P414-Q416 PolarHBondContact O-N 3.23Å; P414-Q416 VanDerWaalsContact O-N 3.07Å; P414-V417 HydrophobicContact CG-CB 4.28Å; P414-V417 HydrophobicContact CG-CG2 3.69Å; P414-V417 WeakPolarHBondContact O-CA 3.5Å; P414-V417 WeakPolarHBondContact O-CB 3.5Å; P414-V417 PolarHBondContact O-N 3.12Å; P414-E418 PolarHBondContact O-N 3.37Å
415	L	96.8	Very high	96.3	Very high	120 Å²	120	63.9 Å²	63.9	63%	0.628	34%	0.343	S	S	*	.	H	α-helix	trans	-53	-35.5	-174.8	-178.3	61.4	0	0	0	114.2	V417 E418 M419	L415-V417 VanDerWaalsContact C-N 3.27Å; L415-V417 PolarHBondContact O-N 3.2Å; L415-E418 PolarHBondContact O-N 2.9Å; L415-M419 HydrophobicContact CD1-CG 4.07Å; L415-M419 HydrophobicContact CG-CG 4.27Å; L415-M419 WeakPolarHBondContact O-CB 3.42Å; L415-M419 VanDerWaalsContact O-CG 3.3Å; L415-M419 WeakPolarHBondContact O-CG 3.24Å; L415-M419 PolarHBondContact O-N 3.21Å
416	Q	96.4	Very high	96.4	Very high	107 Å²	107	68.1 Å²	68.1	50%	0.5	36%	0.359	S	S	.	.	H	α-helix	trans	-61.8	-34.8	176.7	-177	174.4	100.6	0	0	112.6	P414 T420 P527	P414-Q416 PolarHBondContact O-N 3.23Å; P414-Q416 VanDerWaalsContact O-N 3.07Å; Q416-T420 WeakPolarHBondContact O-CB 3.26Å; Q416-T420 PolarHBondContact O-N 2.87Å; Q416-T420 VanDerWaalsContact O-N 3.12Å; Q416-T420 PolarHBondContact O-OG1 3.14Å; Q416-P527 HydrophobicContact CG-CB 4.42Å; Q416-P527 HydrophobicContact CG-CG 3.94Å
417	V	98	Very high	96.5	Very high	1 Å²	1	67 Å²	67	1%	0.006	35%	0.347	C	S	.	.	H	α-helix	trans	-72.3	-46.3	176.1	173.7	0	0	0	0	110	E372 L373 R413 P414 L415 M419 T420 R421 P527	E372-V417 HydrophobicContact CB-CG1 3.93Å; E372-V417 HydrophobicContact CB-CG2 4.49Å; E372-V417 VanDerWaalsContact CD-CG1 3.41Å; E372-V417 HydrophobicContact CG-CG1 3.63Å; E372-V417 WeakPolarHBondContact OE2-CG1 3.23Å; L373-V417 HydrophobicContact CD1-CG2 4.36Å; L373-V417 HydrophobicContact CG-CG2 4.15Å; R413-V417 HydrophobicContact CG-CB 4.01Å; R413-V417 HydrophobicContact CG-CG1 3.85Å; P414-V417 HydrophobicContact CG-CB 4.28Å; P414-V417 HydrophobicContact CG-CG2 3.69Å; P414-V417 WeakPolarHBondContact O-CA 3.5Å; P414-V417 WeakPolarHBondContact O-CB 3.5Å; P414-V417 PolarHBondContact O-N 3.12Å; L415-V417 VanDerWaalsContact C-N 3.27Å; L415-V417 PolarHBondContact O-N 3.2Å; V417-M419 PolarHBondContact O-N 3.49Å; V417-T420 CarbonylContact O-C 3.57Å; V417-T420 WeakPolarHBondContact O-CA 3.19Å; V417-T420 WeakPolarHBondContact O-CB 3.15Å; V417-T420 PolarHBondContact O-N 3.19Å; V417-R421 HydrophobicContact CG1-CG 4.36Å; V417-R421 WeakPolarHBondContact O-CG 3.38Å; V417-R421 PolarHBondContact O-N 2.82Å; V417-P527 HydrophobicContact CB-CB 4.3Å; V417-P527 WeakPolarHBondContact CG1-O 3.46Å; V417-P527 HydrophobicContact CG2-CB 3.78Å; V417-P527 WeakPolarHBondContact CG2-O 3.06Å
418	E	97.3	Very high	96.7	Very high	76 Å²	76	64.3 Å²	64.3	36%	0.355	33%	0.328	S	S	.	.	H	α-helix	trans	-59.1	-44.2	177.5	-159.3	-159.3	120.8	0	0	112.3	P414 L415 T420 R421 R422	P414-E418 PolarHBondContact O-N 3.37Å; L415-E418 PolarHBondContact O-N 2.9Å; E418-T420 VanDerWaalsContact C-N 3.28Å; E418-T420 PolarHBondContact O-N 2.75Å; E418-R421 PolarHBondContact O-N 3.22Å; E418-R422 PolarHBondContact O-N 3.32Å; E418-R422 IonicContact OE1-CZ 2.78Å; E418-R422 IonicContact OE1-NH1 3.22Å; E418-R422 PolarHBondContact OE1-NH1 3.36Å; E418-R422 IonicContact OE1-NH2 3.72Å; E418-R422 PolarHBondContact OE1-NH2 3.17Å
419	M	97.1	Very high	96.9	Very high	92 Å²	92	66.4 Å²	66.4	45%	0.453	33%	0.334	S	S	.	.	H	α-helix	trans	-64.2	-30.3	172.9	-70	-62.4	-77	0	0	112.9	L415 V417 R422 H423	L415-M419 HydrophobicContact CD1-CG 4.07Å; L415-M419 HydrophobicContact CG-CG 4.27Å; L415-M419 WeakPolarHBondContact O-CB 3.42Å; L415-M419 VanDerWaalsContact O-CG 3.3Å; L415-M419 WeakPolarHBondContact O-CG 3.24Å; L415-M419 PolarHBondContact O-N 3.21Å; V417-M419 PolarHBondContact O-N 3.49Å; M419-R422 PolarHBondContact SD-NH1 3.34Å; M419-H423 PolarHBondContact O-ND1 3.14Å
420	T	98	Very high	97.1	Very high	5 Å²	5	61.4 Å²	61.4	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-76.1	-41.2	176.1	-59.4	0	0	0	0	111.6	Q416 V417 E418 R422 H423 I424 V511 P527 C528	Q416-T420 WeakPolarHBondContact O-CB 3.26Å; Q416-T420 PolarHBondContact O-N 2.87Å; Q416-T420 VanDerWaalsContact O-N 3.12Å; Q416-T420 PolarHBondContact O-OG1 3.14Å; V417-T420 CarbonylContact O-C 3.57Å; V417-T420 WeakPolarHBondContact O-CA 3.19Å; V417-T420 WeakPolarHBondContact O-CB 3.15Å; V417-T420 PolarHBondContact O-N 3.19Å; E418-T420 VanDerWaalsContact C-N 3.28Å; E418-T420 PolarHBondContact O-N 2.75Å; T420-R422 VanDerWaalsContact C-N 3.29Å; T420-R422 PolarHBondContact O-N 2.83Å; T420-H423 PolarHBondContact O-N 2.97Å; T420-I424 PolarHBondContact O-N 3.43Å; T420-V511 HydrophobicContact CG2-CB 4Å; T420-V511 HydrophobicContact CG2-CG2 4.01Å; T420-P527 HydrophobicContact CG2-CB 4.06Å; T420-P527 HydrophobicContact CG2-CG 4.33Å; T420-P527 WeakPolarHBondContact OG1-CB 3.37Å; T420-P527 WeakPolarHBondContact OG1-CG 3.25Å; T420-C528 HydrophobicContact CG2-CB 4.04Å
421	R	98.1	Very high	97.2	Very high	22 Å²	22	61.8 Å²	61.8	8%	0.083	30%	0.301	C	S	.	.	H	α-helix	trans	-55.5	-41.9	176.6	-72.2	168.4	63.5	84.8	2.7	112.3	Y370 E372 L405 G406 L408 R413 V417 E418 H423 I424 C528	Y370-R421 PolarHBondContact OH-NH1 3.46Å; E372-R421 WeakPolarHBondContact OE1-CD 3.35Å; E372-R421 IonicContact OE1-CZ 2.72Å; E372-R421 IonicContact OE1-NE 3.19Å; E372-R421 IonicContact OE1-NH1 3.89Å; E372-R421 PolarHBondContact OE1-NH1 2.99Å; L405-R421 PolarHBondContact O-NH1 3.48Å; L405-R421 VanDerWaalsContact O-NH1 3.14Å; L405-R421 PolarHBondContact O-NH2 2.77Å; G406-R421 VanDerWaalsContact C-NH2 3.27Å; G406-R421 VanDerWaalsContact CA-NH2 3.31Å; G406-R421 PolarHBondContact O-NH2 3.25Å; L408-R421 PolarHBondContact O-NH2 2.89Å; R413-R421 VanDerWaalsContact CZ-CZ 3.48Å; V417-R421 HydrophobicContact CG1-CG 4.36Å; V417-R421 WeakPolarHBondContact O-CG 3.38Å; V417-R421 PolarHBondContact O-N 2.82Å; E418-R421 PolarHBondContact O-N 3.22Å; R421-H423 PolarHBondContact O-N 3.05Å; R421-H423 VanDerWaalsContact O-N 3.15Å; R421-I424 HydrophobicContact CG-CD1 4.47Å; R421-I424 WeakPolarHBondContact O-CB 3.41Å; R421-I424 PolarHBondContact O-N 2.64Å; R421-I424 VanDerWaalsContact O-N 3.1Å; R421-C528 VanDerWaalsContact CG-SG 3.55Å
422	R	97.5	Very high	97.2	Very high	145 Å²	145	56.7 Å²	56.7	55%	0.547	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-33.7	173.7	-71.5	177.4	172.5	89.6	6.4	113.5	E418 M419 T420	E418-R422 PolarHBondContact O-N 3.32Å; E418-R422 IonicContact OE1-CZ 2.78Å; E418-R422 IonicContact OE1-NH1 3.22Å; E418-R422 PolarHBondContact OE1-NH1 3.36Å; E418-R422 IonicContact OE1-NH2 3.72Å; E418-R422 PolarHBondContact OE1-NH2 3.17Å; M419-R422 PolarHBondContact SD-NH1 3.34Å; T420-R422 VanDerWaalsContact C-N 3.29Å; T420-R422 PolarHBondContact O-N 2.83Å
423	H	97.8	Very high	97.3	Very high	106 Å²	106	54.7 Å²	54.7	49%	0.491	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-0.9	-176.1	-67.1	88.3	0	0	0	113.9	M419 T420 R421 S443 V511	M419-H423 PolarHBondContact O-ND1 3.14Å; T420-H423 PolarHBondContact O-N 2.97Å; R421-H423 PolarHBondContact O-N 3.05Å; R421-H423 VanDerWaalsContact O-N 3.15Å; H423-S443 PolarHBondContact O-OG 3.47Å; H423-V511 HydrophobicContact CB-CG1 4.08Å; H423-V511 HydrophobicContact CB-CG2 3.71Å
424	I	98.2	Very high	96.9	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-46.4	171.9	-60.3	176.1	0	0	0	109.1	L405 T420 R421 R426 G427 S443 F510 C528	L405-I424 HydrophobicContact CD1-CD1 4.24Å; T420-I424 PolarHBondContact O-N 3.43Å; R421-I424 HydrophobicContact CG-CD1 4.47Å; R421-I424 WeakPolarHBondContact O-CB 3.41Å; R421-I424 PolarHBondContact O-N 2.64Å; R421-I424 VanDerWaalsContact O-N 3.1Å; I424-R426 PolarHBondContact O-N 3.14Å; I424-G427 WeakPolarHBondContact O-CA 3.45Å; I424-G427 PolarHBondContact O-N 3.01Å; I424-S443 VanDerWaalsContact O-CB 3.27Å; I424-S443 WeakPolarHBondContact O-CB 3.5Å; I424-S443 PolarHBondContact O-OG 3.09Å; I424-F510 HydrophobicContact CD1-CB 4.46Å; I424-F510 HydrophobicContact CD1-CD2 4.32Å; I424-F510 HydrophobicContact CD1-CG 4.3Å; I424-F510 HydrophobicContact CG1-CB 3.95Å; I424-F510 HydrophobicContact CG1-CD1 4.36Å; I424-F510 HydrophobicContact CG1-CG 4.07Å; I424-F510 HydrophobicContact CG2-CD1 3.89Å; I424-F510 HydrophobicContact CG2-CE1 4.02Å; I424-F510 HydrophobicContact CG2-CG 4.39Å; I424-C528 HydrophobicContact CD1-CB 4.23Å
425	G	97	Very high	96.5	Very high	21 Å²	21	51.6 Å²	51.6	22%	0.216	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	-123.2	179.1	0	0	0	0	0	111.4	G392 G427	G392-G425 PolarHBondContact N-O 3.1Å; G425-G427 PolarHBondContact O-N 3.02Å
426	R	97.6	Very high	96.4	Very high	89 Å²	89	48.1 Å²	48.1	34%	0.336	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-5.3	174.8	-57.9	175.9	-56.6	-86.4	-10.2	114.5	F393 I424 I428 L442 D444	F393-R426 HydrophobicContact CE2-CB 4.46Å; F393-R426 HydrophobicContact CE2-CG 3.97Å; F393-R426 HydrophobicContact CZ-CG 4.2Å; I424-R426 PolarHBondContact O-N 3.14Å; R426-I428 PolarHBondContact O-N 2.77Å; R426-L442 HydrophobicContact CB-CB 3.84Å; R426-L442 VanDerWaalsContact CZ-O 3.26Å; R426-L442 PolarHBondContact NE-O 2.84Å; R426-L442 PolarHBondContact NH2-O 2.58Å; R426-D444 IonicContact CZ-OD1 3.58Å; R426-D444 IonicContact CZ-OD2 3.66Å; R426-D444 IonicContact NH1-OD1 2.68Å; R426-D444 IonicContact NH1-OD2 3.71Å; R426-D444 PolarHBondContact NH1-OD2 2.76Å; R426-D444 IonicContact NH2-OD1 2.85Å; R426-D444 PolarHBondContact NH2-OD1 3.26Å; R426-D444 IonicContact NH2-OD2 3.56Å; R426-D444 PolarHBondContact NH2-OD2 3.22Å
427	G	98.1	Very high	96.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.206	C	C	.	.			trans	58.5	-124.1	172.5	0	0	0	0	0	114.7	I390 I424 G425 L442 S443	I390-G427 CarbonylContact O-C 3.55Å; I390-G427 VanDerWaalsContact O-CA 3.31Å; I390-G427 WeakPolarHBondContact O-CA 3.4Å; I424-G427 WeakPolarHBondContact O-CA 3.45Å; I424-G427 PolarHBondContact O-N 3.01Å; G425-G427 PolarHBondContact O-N 3.02Å; G427-L442 CarbonylContact O-C 3.55Å; G427-L442 PolarHBondContact O-N 2.78Å; G427-L442 VanDerWaalsContact O-N 3.12Å; G427-S443 WeakPolarHBondContact O-CB 3.17Å; G427-S443 PolarHBondContact O-N 3.49Å
428	I	98.5	Very high	96.5	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	162.5	179.6	62.8	171.9	0	0	0	111.1	T389 I390 R426 L430 L439 E440 V447 V508 F510 I530	T389-I428 WeakPolarHBondContact CA-O 3.45Å; I390-I428 HydrophobicContact CB-CG1 4Å; I390-I428 HydrophobicContact CD1-CD1 4.3Å; I390-I428 HydrophobicContact CD1-CG1 4.46Å; I390-I428 PolarHBondContact N-O 2.98Å; I390-I428 PolarHBondContact O-N 3.49Å; R426-I428 PolarHBondContact O-N 2.77Å; I428-L430 HydrophobicContact CD1-CD2 3.98Å; I428-L430 HydrophobicContact CD1-CG 4.35Å; I428-L439 HydrophobicContact CB-CG 4.31Å; I428-L439 HydrophobicContact CD1-CD1 3.76Å; I428-L439 HydrophobicContact CD1-CG 4.32Å; I428-L439 HydrophobicContact CG2-CD1 4.39Å; I428-L439 HydrophobicContact CG2-CD2 4.21Å; I428-L439 HydrophobicContact CG2-CG 4.39Å; I428-E440 CarbonylContact C-O 3.6Å; I428-E440 WeakPolarHBondContact CA-O 3.2Å; I428-V447 HydrophobicContact CG2-CB 4.32Å; I428-V447 HydrophobicContact CG2-CG1 3.71Å; I428-V447 HydrophobicContact CG2-CG2 3.94Å; I428-V508 HydrophobicContact CD1-CG1 4.33Å; I428-F510 HydrophobicContact CG1-CE1 4.22Å; I428-F510 HydrophobicContact CG1-CZ 4.42Å; I428-F510 HydrophobicContact CG2-CE1 4.12Å; I428-I530 HydrophobicContact CD1-CD1 3.86Å
429	R	98.2	Very high	96.5	Very high	76 Å²	76	41.8 Å²	41.8	29%	0.287	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.5	165.8	-176.5	-176.6	-66.8	146	-10.1	109.5	T387 L388 H431 L439 E440 L442	T387-R429 HydrophobicContact CG2-CG 3.66Å; L388-R429 CarbonylContact O-C 3.6Å; L388-R429 WeakPolarHBondContact O-CA 3.45Å; R429-H431 WeakPolarHBondContact CD-CE1 3.2Å; R429-H431 WeakPolarHBondContact CD-NE2 3.31Å; R429-L439 CarbonylContact O-C 3.58Å; R429-L439 WeakPolarHBondContact O-CA 3.47Å; R429-E440 HydrophobicContact CB-CB 4.32Å; R429-E440 IonicContact CZ-OE2 3.57Å; R429-E440 PolarHBondContact N-O 2.86Å; R429-E440 IonicContact NE-OE2 2.7Å; R429-E440 IonicContact NH1-OE1 3.77Å; R429-E440 IonicContact NH1-OE2 2.73Å; R429-E440 PolarHBondContact NH1-OE2 2.97Å; R429-E440 PolarHBondContact O-N 2.92Å; R429-L442 HydrophobicContact CB-CD1 3.84Å; R429-L442 HydrophobicContact CB-CG 4.15Å
430	L	98	Very high	96.6	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	135.1	172.1	-56.2	179.6	0	0	0	108.7	W365 T387 L388 I390 I428 Y438 L439 L476 V532	W365-L430 HydrophobicContact CH2-CB 3.98Å; W365-L430 HydrophobicContact CH2-CD1 4.49Å; W365-L430 HydrophobicContact CZ2-CB 4.38Å; T387-L430 VanDerWaalsContact CA-O 3.3Å; T387-L430 WeakPolarHBondContact CA-O 3.23Å; L388-L430 PolarHBondContact N-O 2.97Å; L388-L430 PolarHBondContact O-N 3.37Å; I390-L430 HydrophobicContact CD1-CD1 3.9Å; I390-L430 HydrophobicContact CD1-CG 4.38Å; I428-L430 HydrophobicContact CD1-CD2 3.98Å; I428-L430 HydrophobicContact CD1-CG 4.35Å; L430-Y438 CarbonylContact C-O 3.57Å; L430-Y438 WeakPolarHBondContact CA-O 3.39Å; L430-L439 HydrophobicContact CD2-CB 3.95Å; L430-L439 HydrophobicContact CD2-CD1 3.98Å; L430-L439 HydrophobicContact CD2-CG 4.03Å; L430-L476 HydrophobicContact CD2-CD1 3.88Å; L430-V532 HydrophobicContact CD1-CG1 4.3Å; L430-V532 HydrophobicContact CD1-CG2 4.1Å
431	H	96.7	Very high	96.6	Very high	46 Å²	46	39.3 Å²	39.3	21%	0.213	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	130.2	174.5	-65.5	-80.2	0	0	0	109.9	T387 R429 I433 V437 Y438 E440	T387-H431 WeakPolarHBondContact CG2-ND1 3.34Å; T387-H431 PolarHBondContact OG1-ND1 3.45Å; R429-H431 WeakPolarHBondContact CD-CE1 3.2Å; R429-H431 WeakPolarHBondContact CD-NE2 3.31Å; H431-I433 HydrophobicContact CB-CD1 3.89Å; H431-I433 HydrophobicContact CB-CG1 3.91Å; H431-V437 CarbonylContact O-C 3.57Å; H431-V437 WeakPolarHBondContact O-CA 3.42Å; H431-Y438 PolarHBondContact N-O 3.43Å; H431-Y438 PolarHBondContact O-N 3.22Å; H431-E440 IonicContact NE2-OE2 3.57Å
432	H	95	Very high	96.6	Very high	35 Å²	35	39.1 Å²	39.1	16%	0.162	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	112.1	168.2	-174.6	-133.6	0	0	0	107.6	F359 W365 P386 E436	F359-H432 AromaticContact CD1-CE1 3.9Å; F359-H432 AromaticContact CE1-CE1 3.95Å; F359-H432 AromaticContact CE1-NE2 3.88Å; W365-H432 HydrophobicContact CD2-CB 3.78Å; W365-H432 HydrophobicContact CE3-CB 3.87Å; W365-H432 AromaticContact CE3-CG 3.97Å; W365-H432 HydrophobicContact CG-CB 4.32Å; W365-H432 HydrophobicContact CH2-CB 4.28Å; W365-H432 HydrophobicContact CZ2-CB 4.2Å; W365-H432 HydrophobicContact CZ3-CB 4.12Å; P386-H432 PolarHBondContact O-N 2.61Å; H432-E436 WeakPolarHBondContact CA-O 3.42Å
433	I	94	Very high	96.6	Very high	94 Å²	94	32.4 Å²	32.4	48%	0.482	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	115	-171.1	-53.9	178.6	0	0	0	108	H431 S435 E436 Y438	H431-I433 HydrophobicContact CB-CD1 3.89Å; H431-I433 HydrophobicContact CB-CG1 3.91Å; I433-S435 PolarHBondContact O-N 3.46Å; I433-E436 PolarHBondContact N-O 2.84Å; I433-E436 WeakPolarHBondContact O-CB 3.4Å; I433-E436 PolarHBondContact O-N 2.79Å; I433-Y438 HydrophobicContact CD1-CD2 4.27Å
434	G	89.4	Confident	96.6	Very high	27 Å²	27	32.5 Å²	32.5	28%	0.278	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	-120.3	-174.7	0	0	0	0	0	111.5	T260	T260-G434 WeakPolarHBondContact O-CA 3.45Å
435	S	89	Confident	96.6	Very high	20 Å²	20	33.4 Å²	33.4	14%	0.14	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	0	173.6	58.1	0	0	0	0	114	I433 S479 T480	I433-S435 PolarHBondContact O-N 3.46Å; S435-S479 WeakPolarHBondContact O-CB 3.34Å; S435-S479 PolarHBondContact O-N 2.69Å; S435-S479 PolarHBondContact O-OG 2.84Å; S435-T480 PolarHBondContact OG-OG1 2.77Å
436	E	95.5	Very high	96.7	Very high	47 Å²	47	33.2 Å²	33.2	22%	0.22	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	153.8	-166.5	-55.3	-179	126.3	0	0	113.1	H432 I433 Y438 K475 F477	H432-E436 WeakPolarHBondContact CA-O 3.42Å; I433-E436 PolarHBondContact N-O 2.84Å; I433-E436 WeakPolarHBondContact O-CB 3.4Å; I433-E436 PolarHBondContact O-N 2.79Å; E436-Y438 HydrophobicContact CB-CD2 4.24Å; E436-Y438 HydrophobicContact CB-CE2 3.61Å; E436-Y438 VanDerWaalsContact CD-OH 3.27Å; E436-Y438 HydrophobicContact CG-CE2 4.41Å; E436-Y438 PolarHBondContact OE1-OH 2.95Å; E436-Y438 VanDerWaalsContact OE2-CE2 3.23Å; E436-Y438 WeakPolarHBondContact OE2-CE2 3.28Å; E436-Y438 PolarHBondContact OE2-OH 2.87Å; E436-K475 WeakPolarHBondContact OE1-CE 3.45Å; E436-K475 IonicContact OE1-NZ 2.75Å; E436-K475 PolarHBondContact OE1-NZ 3.4Å; E436-F477 WeakPolarHBondContact CA-O 3.47Å
437	V	97.2	Very high	96.7	Very high	3 Å²	3	29 Å²	29	2%	0.018	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128.7	170.2	-174.6	0	0	0	0	109.8	W365 H431 L476 F477 L534	W365-V437 HydrophobicContact CH2-CG1 4.14Å; W365-V437 HydrophobicContact CZ3-CG1 3.9Å; W365-V437 HydrophobicContact CZ3-CG2 4Å; H431-V437 CarbonylContact O-C 3.57Å; H431-V437 WeakPolarHBondContact O-CA 3.42Å; V437-L476 HydrophobicContact CB-CB 4.42Å; V437-L476 HydrophobicContact CG1-CB 4.38Å; V437-L476 HydrophobicContact CG1-CD1 4.17Å; V437-L476 WeakPolarHBondContact O-CA 3.31Å; V437-L476 WeakPolarHBondContact O-CB 3.18Å; V437-L476 PolarHBondContact O-N 2.93Å; V437-F477 HydrophobicContact CB-CB 4.06Å; V437-F477 HydrophobicContact CG2-CB 4.2Å; V437-F477 PolarHBondContact N-O 3.17Å; V437-F477 PolarHBondContact O-N 3.02Å; V437-L534 HydrophobicContact CG2-CD1 4.21Å; V437-L534 HydrophobicContact CG2-CD2 4.13Å
438	Y	97.9	Very high	96.8	Very high	47 Å²	47	29.6 Å²	29.6	18%	0.184	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	152.5	176.7	-68.1	-96	0	0	0	111.7	L430 H431 I433 E436 L474 K475	L430-Y438 CarbonylContact C-O 3.57Å; L430-Y438 WeakPolarHBondContact CA-O 3.39Å; H431-Y438 PolarHBondContact N-O 3.43Å; H431-Y438 PolarHBondContact O-N 3.22Å; I433-Y438 HydrophobicContact CD1-CD2 4.27Å; E436-Y438 HydrophobicContact CB-CD2 4.24Å; E436-Y438 HydrophobicContact CB-CE2 3.61Å; E436-Y438 VanDerWaalsContact CD-OH 3.27Å; E436-Y438 HydrophobicContact CG-CE2 4.41Å; E436-Y438 PolarHBondContact OE1-OH 2.95Å; E436-Y438 VanDerWaalsContact OE2-CE2 3.23Å; E436-Y438 WeakPolarHBondContact OE2-CE2 3.28Å; E436-Y438 PolarHBondContact OE2-OH 2.87Å; Y438-L474 WeakPolarHBondContact CA-O 3.47Å; Y438-K475 HydrophobicContact CD1-CB 3.99Å; Y438-K475 HydrophobicContact CE1-CB 3.68Å; Y438-K475 HydrophobicContact CE1-CD 4.45Å; Y438-K475 HydrophobicContact CE1-CG 4.13Å
439	L	98.4	Very high	96.8	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.4	170.5	179.9	155.2	0	0	0	110.1	I428 R429 L430 V447 V449 V468 N473 L474 L476 V508	I428-L439 HydrophobicContact CB-CG 4.31Å; I428-L439 HydrophobicContact CD1-CD1 3.76Å; I428-L439 HydrophobicContact CD1-CG 4.32Å; I428-L439 HydrophobicContact CG2-CD1 4.39Å; I428-L439 HydrophobicContact CG2-CD2 4.21Å; I428-L439 HydrophobicContact CG2-CG 4.39Å; R429-L439 CarbonylContact O-C 3.58Å; R429-L439 WeakPolarHBondContact O-CA 3.47Å; L430-L439 HydrophobicContact CD2-CB 3.95Å; L430-L439 HydrophobicContact CD2-CD1 3.98Å; L430-L439 HydrophobicContact CD2-CG 4.03Å; L439-V447 HydrophobicContact CD2-CG2 4Å; L439-V449 HydrophobicContact CD1-CG2 4.02Å; L439-V468 HydrophobicContact CD2-CG1 4.2Å; L439-V468 HydrophobicContact CD2-CG2 4.46Å; L439-N473 CarbonylContact O-C 3.53Å; L439-N473 WeakPolarHBondContact O-CA 3.42Å; L439-N473 VanDerWaalsContact O-CB 3.26Å; L439-N473 WeakPolarHBondContact O-CB 3.2Å; L439-L474 PolarHBondContact N-O 2.83Å; L439-L474 PolarHBondContact O-N 2.79Å; L439-L476 HydrophobicContact CB-CD1 3.8Å; L439-L476 HydrophobicContact CB-CD2 3.92Å; L439-L476 HydrophobicContact CB-CG 3.81Å; L439-L476 HydrophobicContact CD1-CD1 4.29Å; L439-L476 HydrophobicContact CD1-CD2 4.34Å; L439-V508 HydrophobicContact CD1-CG1 4.19Å; L439-V508 HydrophobicContact CD1-CG2 3.96Å
440	E	98.4	Very high	96.8	Very high	44 Å²	44	27.4 Å²	27.4	21%	0.206	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126	169.7	-178.9	-170.4	-163	0	0	109.5	I428 R429 H431 L442	I428-E440 CarbonylContact C-O 3.6Å; I428-E440 WeakPolarHBondContact CA-O 3.2Å; R429-E440 HydrophobicContact CB-CB 4.32Å; R429-E440 IonicContact CZ-OE2 3.57Å; R429-E440 PolarHBondContact N-O 2.86Å; R429-E440 IonicContact NE-OE2 2.7Å; R429-E440 IonicContact NH1-OE1 3.77Å; R429-E440 IonicContact NH1-OE2 2.73Å; R429-E440 PolarHBondContact NH1-OE2 2.97Å; R429-E440 PolarHBondContact O-N 2.92Å; H431-E440 IonicContact NE2-OE2 3.57Å; E440-L442 VanDerWaalsContact CD-CD2 3.47Å; E440-L442 HydrophobicContact CG-CD2 3.99Å; E440-L442 PolarHBondContact O-N 2.82Å; E440-L442 WeakPolarHBondContact OE2-CD2 3.49Å
441	C	98.5	Very high	96.8	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	91.2	177.9	-173.5	0	0	0	0	110.9	A445 V447 V468 P469 K471 C472	C441-A445 PolarHBondContact SG-O 2.84Å; C441-V447 HydrophobicContact CB-CG2 4.32Å; C441-V468 HydrophobicContact CB-CG1 3.81Å; C441-P469 VanDerWaalsContact CB-O 3.3Å; C441-P469 WeakPolarHBondContact CB-O 3.48Å; C441-K471 PolarHBondContact O-N 3.3Å; C441-C472 PolarHBondContact N-O 3.1Å
442	L	98.2	Very high	96.8	Very high	19 Å²	19	26.1 Å²	26.1	10%	0.099	14%	0.144	C	C	.	.			trans	-74.4	-28.1	179.7	-67.2	-176.4	0	0	0	113.8	T389 R426 G427 R429 E440 K471	T389-L442 HydrophobicContact CG2-CD1 4.06Å; R426-L442 HydrophobicContact CB-CB 3.84Å; R426-L442 VanDerWaalsContact CZ-O 3.26Å; R426-L442 PolarHBondContact NE-O 2.84Å; R426-L442 PolarHBondContact NH2-O 2.58Å; G427-L442 CarbonylContact O-C 3.55Å; G427-L442 PolarHBondContact O-N 2.78Å; G427-L442 VanDerWaalsContact O-N 3.12Å; R429-L442 HydrophobicContact CB-CD1 3.84Å; R429-L442 HydrophobicContact CB-CG 4.15Å; E440-L442 VanDerWaalsContact CD-CD2 3.47Å; E440-L442 HydrophobicContact CG-CD2 3.99Å; E440-L442 PolarHBondContact O-N 2.82Å; E440-L442 WeakPolarHBondContact OE2-CD2 3.49Å; L442-K471 PolarHBondContact O-NZ 2.85Å
443	S	97.8	Very high	96.8	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.021	14%	0.141	C	C	.	.	S	Bend	trans	-58.8	160.3	179.3	-169.6	0	0	0	0	112.5	H423 I424 G427 A445 P470	H423-S443 PolarHBondContact O-OG 3.47Å; I424-S443 VanDerWaalsContact O-CB 3.27Å; I424-S443 WeakPolarHBondContact O-CB 3.5Å; I424-S443 PolarHBondContact O-OG 3.09Å; G427-S443 WeakPolarHBondContact O-CB 3.17Å; G427-S443 PolarHBondContact O-N 3.49Å; S443-A445 VanDerWaalsContact C-N 3.34Å; S443-A445 WeakPolarHBondContact CB-O 3.44Å; S443-A445 PolarHBondContact OG-N 2.8Å; S443-A445 VanDerWaalsContact OG-N 3.16Å; S443-P470 WeakPolarHBondContact O-CB 3.23Å
444	D	97.9	Very high	96.9	Very high	109 Å²	109	20.9 Å²	20.9	58%	0.583	12%	0.12	S	C	*	.	S	Bend	trans	-88	-8.8	170.4	-59.5	-58.6	0	0	0	111.6	R426 P470	R426-D444 IonicContact CZ-OD1 3.58Å; R426-D444 IonicContact CZ-OD2 3.66Å; R426-D444 IonicContact NH1-OD1 2.68Å; R426-D444 IonicContact NH1-OD2 3.71Å; R426-D444 PolarHBondContact NH1-OD2 2.76Å; R426-D444 IonicContact NH2-OD1 2.85Å; R426-D444 PolarHBondContact NH2-OD1 3.26Å; R426-D444 IonicContact NH2-OD2 3.56Å; R426-D444 PolarHBondContact NH2-OD2 3.22Å; D444-P470 VanDerWaalsContact O-CG 3.28Å; D444-P470 WeakPolarHBondContact O-CG 3.49Å
445	A	97.9	Very high	97.2	Very high	19 Å²	19	19.6 Å²	19.6	16%	0.157	11%	0.107	C	C	.	.	S	Bend	trans	-101.7	153.1	166.4	0	0	0	0	0	111.1	C441 S443 V511	C441-A445 PolarHBondContact SG-O 2.84Å; S443-A445 VanDerWaalsContact C-N 3.34Å; S443-A445 WeakPolarHBondContact CB-O 3.44Å; S443-A445 PolarHBondContact OG-N 2.8Å; S443-A445 VanDerWaalsContact OG-N 3.16Å; A445-V511 HydrophobicContact CB-CB 4.34Å; A445-V511 HydrophobicContact CB-CG1 4.12Å; A445-V511 HydrophobicContact CB-CG2 3.96Å
446	A	98.4	Very high	97.4	Very high	18 Å²	18	24.8 Å²	24.8	15%	0.149	12%	0.123	C	C	.	.			trans	-69.5	152.5	173.9	0	0	0	0	0	111.9	F448 K467 V468 V511	A446-F448 HydrophobicContact CB-CE2 4.29Å; A446-F448 HydrophobicContact CB-CZ 4.34Å; A446-K467 HydrophobicContact CB-CG 4.37Å; A446-V468 WeakPolarHBondContact CA-O 3.41Å; A446-V468 WeakPolarHBondContact CB-O 3.49Å; A446-V511 WeakPolarHBondContact O-CA 3.39Å; A446-V511 PolarHBondContact O-N 3.23Å
447	V	98.6	Very high	97.3	Very high	1 Å²	1	28 Å²	28	1%	0.006	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	161.2	168.2	-58	0	0	0	0	110.7	I428 L439 C441 V468 V508 S509 F510	I428-V447 HydrophobicContact CG2-CB 4.32Å; I428-V447 HydrophobicContact CG2-CG1 3.71Å; I428-V447 HydrophobicContact CG2-CG2 3.94Å; L439-V447 HydrophobicContact CD2-CG2 4Å; C441-V447 HydrophobicContact CB-CG2 4.32Å; V447-V468 HydrophobicContact CG2-CB 3.92Å; V447-V468 PolarHBondContact N-O 2.87Å; V447-V468 PolarHBondContact O-N 3.43Å; V447-V508 HydrophobicContact CB-CG1 4.07Å; V447-V508 HydrophobicContact CG2-CG1 4.3Å; V447-S509 WeakPolarHBondContact CA-O 3.27Å; V447-F510 HydrophobicContact CG1-CD1 3.87Å; V447-F510 HydrophobicContact CG1-CE1 4.47Å
448	F	98.7	Very high	97.1	Very high	12 Å²	12	31.3 Å²	31.3	5%	0.053	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	128.6	-172	-59.3	-96.9	0	0	0	108.2	A446 V465 V466 K467 V508 S509 K512 W514 Y518	A446-F448 HydrophobicContact CB-CE2 4.29Å; A446-F448 HydrophobicContact CB-CZ 4.34Å; F448-V465 HydrophobicContact CB-CG1 3.89Å; F448-V466 CarbonylContact C-O 3.49Å; F448-V466 WeakPolarHBondContact CA-O 3.32Å; F448-K467 HydrophobicContact CD1-CB 3.97Å; F448-K467 HydrophobicContact CD1-CG 4.09Å; F448-K467 HydrophobicContact CE1-CB 3.95Å; F448-K467 HydrophobicContact CE1-CD 3.91Å; F448-K467 HydrophobicContact CE1-CG 3.64Å; F448-K467 HydrophobicContact CZ-CD 4.41Å; F448-K467 HydrophobicContact CZ-CG 4.19Å; F448-V508 CarbonylContact O-C 3.58Å; F448-V508 VanDerWaalsContact O-CA 3.28Å; F448-V508 WeakPolarHBondContact O-CA 3.45Å; F448-S509 PolarHBondContact N-O 2.91Å; F448-S509 PolarHBondContact O-N 2.72Å; F448-K512 VanDerWaalsContact CD2-C 3.46Å; F448-W514 HydrophobicContact CB-CE3 4.12Å; F448-W514 HydrophobicContact CB-CZ3 3.74Å; F448-W514 VanDerWaalsContact O-CZ3 3.31Å; F448-W514 WeakPolarHBondContact O-CZ3 3.36Å; F448-Y518 HydrophobicContact CD1-CE1 4.44Å; F448-Y518 AromaticContact CE1-CE1 3.78Å; F448-Y518 HydrophobicContact CE1-CE1 3.78Å; F448-Y518 AromaticContact CE1-CZ 3.72Å
449	V	98.5	Very high	97	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	127.6	-162.5	178	0	0	0	0	110.3	L439 V465 V466 V468 L474 L476 I506 R507 V508	L439-V449 HydrophobicContact CD1-CG2 4.02Å; V449-V465 CarbonylContact O-C 3.52Å; V449-V465 WeakPolarHBondContact O-CA 3.42Å; V449-V466 PolarHBondContact N-O 2.86Å; V449-V466 PolarHBondContact O-N 3.41Å; V449-V468 HydrophobicContact CG2-CG2 3.85Å; V449-L474 HydrophobicContact CB-CD2 4.2Å; V449-L474 HydrophobicContact CG1-CD2 4.13Å; V449-L474 HydrophobicContact CG2-CD2 4.39Å; V449-L476 HydrophobicContact CG1-CD2 3.5Å; V449-I506 HydrophobicContact CG1-CG2 4.39Å; V449-R507 WeakPolarHBondContact CA-O 3.44Å; V449-V508 HydrophobicContact CG2-CG1 4.15Å; V449-V508 HydrophobicContact CG2-CG2 4.23Å
450	Q	98.2	Very high	96.8	Very high	29 Å²	29	39 Å²	39	14%	0.136	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	106.7	166	179.1	179.6	78.8	0	0	107.8	A463 V465 R507 W514	Q450-A463 PolarHBondContact NE2-O 3.33Å; Q450-V465 HydrophobicContact CB-CG2 4.44Å; Q450-R507 HydrophobicContact CB-CB 4.39Å; Q450-R507 PolarHBondContact N-O 3.5Å; Q450-R507 PolarHBondContact O-N 2.9Å; Q450-W514 HydrophobicContact CB-CH2 4Å; Q450-W514 HydrophobicContact CB-CZ2 3.54Å
451	S	97.8	Very high	96.7	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.007	22%	0.215	C	C	.	.			trans	-124.4	114.5	168.2	170.3	0	0	0	0	108.3	S453 C454 N455 L476	S451-S453 PolarHBondContact O-N 3.03Å; S451-S453 PolarHBondContact OG-N 2.75Å; S451-C454 PolarHBondContact O-N 3.32Å; S451-C454 PolarHBondContact OG-N 3.3Å; S451-N455 WeakPolarHBondContact O-CB 3.46Å; S451-N455 VanDerWaalsContact O-CG 3.25Å; S451-N455 PolarHBondContact O-N 3.29Å; S451-N455 PolarHBondContact O-ND2 3.15Å; S451-L476 WeakPolarHBondContact CB-O 3.4Å; S451-L476 PolarHBondContact OG-O 3.01Å
452	P	96.5	Very high	96.5	Very high	19 Å²	19	47.1 Å²	47.1	12%	0.123	24%	0.24	C	C	.	.	H	α-helix	trans	-60.3	-26.9	175.4	-27.4	38.1	0	0	0	113.3	R456 M503	P452-R456 VanDerWaalsContact O-CB 3.25Å; P452-R456 WeakPolarHBondContact O-CB 3.42Å; P452-R456 PolarHBondContact O-N 2.9Å; P452-M503 HydrophobicContact CB-CE 4.25Å; P452-M503 HydrophobicContact CB-SD 3.65Å; P452-M503 WeakPolarHBondContact O-CE 3.22Å
453	S	95.3	Very high	96.4	Very high	14 Å²	14	48.6 Å²	48.6	10%	0.098	26%	0.255	C	S	.	.	H	α-helix	trans	-68.4	-48.3	174.1	-178.6	0	0	0	0	111.9	S451 R456 F457 F477	S451-S453 PolarHBondContact O-N 3.03Å; S451-S453 PolarHBondContact OG-N 2.75Å; S453-R456 PolarHBondContact O-N 3.2Å; S453-F457 PolarHBondContact O-N 2.92Å; S453-F477 VanDerWaalsContact CB-CD2 3.44Å
454	C	95.8	Very high	96.4	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.034	27%	0.268	C	S	.	.	H	α-helix	trans	-61.5	-46.8	174.4	-172	0	0	0	0	111.5	S451 R456 F457 Y458 K475 L476	S451-C454 PolarHBondContact O-N 3.32Å; S451-C454 PolarHBondContact OG-N 3.3Å; C454-R456 VanDerWaalsContact C-N 3.35Å; C454-R456 PolarHBondContact O-N 3.04Å; C454-F457 WeakPolarHBondContact O-CB 3.47Å; C454-F457 PolarHBondContact O-N 3.26Å; C454-Y458 WeakPolarHBondContact O-CD2 3.16Å; C454-Y458 PolarHBondContact O-N 3.21Å; C454-K475 PolarHBondContact SG-O 3.3Å; C454-L476 PolarHBondContact N-O 3.3Å
455	N	96.6	Very high	96.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-43.3	178.3	-68.9	-19.4	0	0	0	111.4	S451 F457 Y458 S459 W460 P462 T464	S451-N455 WeakPolarHBondContact O-CB 3.46Å; S451-N455 VanDerWaalsContact O-CG 3.25Å; S451-N455 PolarHBondContact O-N 3.29Å; S451-N455 PolarHBondContact O-ND2 3.15Å; N455-F457 PolarHBondContact O-N 2.67Å; N455-Y458 PolarHBondContact O-N 3.41Å; N455-S459 PolarHBondContact O-N 2.88Å; N455-W460 HydrophobicContact CB-CB 4.27Å; N455-W460 PolarHBondContact O-N 2.95Å; N455-P462 PolarHBondContact ND2-O 2.88Å; N455-T464 PolarHBondContact ND2-N 3.45Å; N455-T464 PolarHBondContact ND2-O 2.91Å
456	R	94.3	Very high	96.4	Very high	129 Å²	129	46.4 Å²	46.4	49%	0.487	24%	0.244	S	C	.	.	H	α-helix	trans	-63.9	-38.6	176.3	-170.6	176.7	-173.2	-122.2	-6.7	112.5	P452 S453 C454 S459 Q485 M503	P452-R456 VanDerWaalsContact O-CB 3.25Å; P452-R456 WeakPolarHBondContact O-CB 3.42Å; P452-R456 PolarHBondContact O-N 2.9Å; S453-R456 PolarHBondContact O-N 3.2Å; C454-R456 VanDerWaalsContact C-N 3.35Å; C454-R456 PolarHBondContact O-N 3.04Å; R456-S459 PolarHBondContact O-N 2.99Å; R456-Q485 VanDerWaalsContact CD-OE1 3.26Å; R456-M503 HydrophobicContact CB-CE 4.36Å
457	F	92.1	Very high	96.4	Very high	116 Å²	116	51.3 Å²	51.3	51%	0.509	26%	0.262	S	S	.	.	H	α-helix	trans	-61.9	-42.4	177.8	-177.1	-98.2	0	0	0	112.2	S453 C454 N455 S459	S453-F457 PolarHBondContact O-N 2.92Å; C454-F457 WeakPolarHBondContact O-CB 3.47Å; C454-F457 PolarHBondContact O-N 3.26Å; N455-F457 PolarHBondContact O-N 2.67Å; F457-S459 VanDerWaalsContact C-N 3.31Å; F457-S459 PolarHBondContact O-N 2.98Å
458	Y	93.4	Very high	96.4	Very high	71 Å²	71	51.5 Å²	51.5	28%	0.278	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	11.9	177.3	-63.7	-66.3	0	0	0	114.5	C454 N455 W460	C454-Y458 WeakPolarHBondContact O-CD2 3.16Å; C454-Y458 PolarHBondContact O-N 3.21Å; N455-Y458 PolarHBondContact O-N 3.41Å; Y458-W460 HydrophobicContact CD2-CE3 4.19Å; Y458-W460 AromaticContact CD2-CH2 3.75Å; Y458-W460 HydrophobicContact CD2-CH2 3.75Å; Y458-W460 HydrophobicContact CD2-CZ2 4.41Å; Y458-W460 AromaticContact CD2-CZ3 3.62Å; Y458-W460 HydrophobicContact CD2-CZ3 3.62Å; Y458-W460 HydrophobicContact CE2-CH2 4.46Å; Y458-W460 HydrophobicContact CE2-CZ3 4.46Å; Y458-W460 HydrophobicContact CG-CE3 4.38Å; Y458-W460 AromaticContact CG-CH2 3.85Å; Y458-W460 HydrophobicContact CG-CH2 3.85Å; Y458-W460 HydrophobicContact CG-CZ2 4.04Å; Y458-W460 HydrophobicContact CG-CZ3 4.02Å; Y458-W460 PolarHBondContact O-N 2.87Å
459	S	94.8	Very high	96.3	Very high	115 Å²	115	53.6 Å²	53.6	80%	0.804	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	29.3	-175.7	-56.1	0	0	0	0	114.9	N455 R456 F457	N455-S459 PolarHBondContact O-N 2.88Å; R456-S459 PolarHBondContact O-N 2.99Å; F457-S459 VanDerWaalsContact C-N 3.31Å; F457-S459 PolarHBondContact O-N 2.98Å
460	W	95.7	Very high	96.3	Very high	95 Å²	95	55.9 Å²	55.9	36%	0.36	29%	0.293	S	S	.	.			trans	-86.6	157	174	-61	-27	0	0	0	111.7	N455 Y458 T464 V466	N455-W460 HydrophobicContact CB-CB 4.27Å; N455-W460 PolarHBondContact O-N 2.95Å; Y458-W460 HydrophobicContact CD2-CE3 4.19Å; Y458-W460 AromaticContact CD2-CH2 3.75Å; Y458-W460 HydrophobicContact CD2-CH2 3.75Å; Y458-W460 HydrophobicContact CD2-CZ2 4.41Å; Y458-W460 AromaticContact CD2-CZ3 3.62Å; Y458-W460 HydrophobicContact CD2-CZ3 3.62Å; Y458-W460 HydrophobicContact CE2-CH2 4.46Å; Y458-W460 HydrophobicContact CE2-CZ3 4.46Å; Y458-W460 HydrophobicContact CG-CE3 4.38Å; Y458-W460 AromaticContact CG-CH2 3.85Å; Y458-W460 HydrophobicContact CG-CH2 3.85Å; Y458-W460 HydrophobicContact CG-CZ2 4.04Å; Y458-W460 HydrophobicContact CG-CZ3 4.02Å; Y458-W460 PolarHBondContact O-N 2.87Å; W460-T464 HydrophobicContact CB-CG2 4.23Å; W460-T464 HydrophobicContact CD2-CG2 4.48Å; W460-T464 HydrophobicContact CE3-CG2 4.29Å; W460-T464 HydrophobicContact CG-CG2 4.49Å; W460-V466 HydrophobicContact CE3-CG2 3.94Å; W460-V466 HydrophobicContact CZ3-CG1 4.38Å; W460-V466 HydrophobicContact CZ3-CG2 3.54Å
461	H	96	Very high	96.2	Very high	134 Å²	134	58.9 Å²	58.9	62%	0.62	31%	0.305	S	S	*	.			trans	-54.3	137	173.2	-178.1	-106.7	0	0	0	110.9	A463 T464	H461-A463 PolarHBondContact ND1-N 3.44Å; H461-A463 PolarHBondContact O-N 3.37Å; H461-T464 VanDerWaalsContact O-CB 3.23Å; H461-T464 WeakPolarHBondContact O-CB 3.39Å; H461-T464 PolarHBondContact O-N 3.06Å; H461-T464 PolarHBondContact O-OG1 2.88Å
462	P	94.8	Very high	96.2	Very high	80 Å²	80	60.7 Å²	60.7	52%	0.519	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-28.6	-172.3	-29.6	36.9	0	0	0	115	N455	N455-P462 PolarHBondContact ND2-O 2.88Å
463	A	95.6	Very high	96.2	Very high	50 Å²	50	61.4 Å²	61.4	41%	0.413	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-0.2	177.5	0	0	0	0	0	115	Q450 H461	Q450-A463 PolarHBondContact NE2-O 3.33Å; H461-A463 PolarHBondContact ND1-N 3.44Å; H461-A463 PolarHBondContact O-N 3.37Å
464	T	97.1	Very high	96.3	Very high	46 Å²	46	61.6 Å²	61.6	28%	0.282	32%	0.32	S	S	.	.			trans	-54.9	144	179.2	-69.5	0	0	0	0	112.2	N455 W460 H461	N455-T464 PolarHBondContact ND2-N 3.45Å; N455-T464 PolarHBondContact ND2-O 2.91Å; W460-T464 HydrophobicContact CB-CG2 4.23Å; W460-T464 HydrophobicContact CD2-CG2 4.48Å; W460-T464 HydrophobicContact CE3-CG2 4.29Å; W460-T464 HydrophobicContact CG-CG2 4.49Å; H461-T464 VanDerWaalsContact O-CB 3.23Å; H461-T464 WeakPolarHBondContact O-CB 3.39Å; H461-T464 PolarHBondContact O-N 3.06Å; H461-T464 PolarHBondContact O-OG1 2.88Å
465	V	98.2	Very high	96.4	Very high	16 Å²	16	62.3 Å²	62.3	10%	0.097	32%	0.322	C	S	.	.			trans	-117.2	106.6	-178.5	-176.7	0	0	0	0	109.2	F448 V449 Q450 W514	F448-V465 HydrophobicContact CB-CG1 3.89Å; V449-V465 CarbonylContact O-C 3.52Å; V449-V465 WeakPolarHBondContact O-CA 3.42Å; Q450-V465 HydrophobicContact CB-CG2 4.44Å; V465-W514 WeakPolarHBondContact CB-O 3.46Å; V465-W514 HydrophobicContact CG1-CD2 3.97Å; V465-W514 HydrophobicContact CG1-CE3 3.75Å; V465-W514 HydrophobicContact CG1-CH2 3.82Å; V465-W514 HydrophobicContact CG1-CZ2 4.04Å; V465-W514 HydrophobicContact CG1-CZ3 3.65Å; V465-W514 WeakPolarHBondContact CG1-O 3.4Å; V465-W514 HydrophobicContact CG2-CD2 3.97Å; V465-W514 VanDerWaalsContact CG2-CE2 3.5Å; V465-W514 HydrophobicContact CG2-CG 4.33Å; V465-W514 HydrophobicContact CG2-CH2 4.4Å; V465-W514 HydrophobicContact CG2-CZ2 3.77Å; V465-W514 WeakPolarHBondContact CG2-O 3.35Å
466	V	97.6	Very high	96.4	Very high	24 Å²	24	62.4 Å²	62.4	15%	0.145	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	125.1	-177.2	-171.2	0	0	0	0	109.8	F448 V449 W460 L474	F448-V466 CarbonylContact C-O 3.49Å; F448-V466 WeakPolarHBondContact CA-O 3.32Å; V449-V466 PolarHBondContact N-O 2.86Å; V449-V466 PolarHBondContact O-N 3.41Å; W460-V466 HydrophobicContact CE3-CG2 3.94Å; W460-V466 HydrophobicContact CZ3-CG1 4.38Å; W460-V466 HydrophobicContact CZ3-CG2 3.54Å; V466-L474 HydrophobicContact CB-CD2 4.09Å; V466-L474 HydrophobicContact CG1-CD1 4.44Å; V466-L474 HydrophobicContact CG1-CD2 3.87Å
467	K	98.3	Very high	96.6	Very high	121 Å²	121	56.3 Å²	56.3	53%	0.526	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	120.7	173.4	178.6	-177.3	177.4	-173.8	0	110	A446 F448 P469	A446-K467 HydrophobicContact CB-CG 4.37Å; F448-K467 HydrophobicContact CD1-CB 3.97Å; F448-K467 HydrophobicContact CD1-CG 4.09Å; F448-K467 HydrophobicContact CE1-CB 3.95Å; F448-K467 HydrophobicContact CE1-CD 3.91Å; F448-K467 HydrophobicContact CE1-CG 3.64Å; F448-K467 HydrophobicContact CZ-CD 4.41Å; F448-K467 HydrophobicContact CZ-CG 4.19Å; K467-P469 WeakPolarHBondContact O-CD 3.46Å
468	V	98.2	Very high	96.7	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.024	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	111.4	173.6	-172.5	0	0	0	0	108.9	L439 C441 A446 V447 V449 C472 L474	L439-V468 HydrophobicContact CD2-CG1 4.2Å; L439-V468 HydrophobicContact CD2-CG2 4.46Å; C441-V468 HydrophobicContact CB-CG1 3.81Å; A446-V468 WeakPolarHBondContact CA-O 3.41Å; A446-V468 WeakPolarHBondContact CB-O 3.49Å; V447-V468 HydrophobicContact CG2-CB 3.92Å; V447-V468 PolarHBondContact N-O 2.87Å; V447-V468 PolarHBondContact O-N 3.43Å; V449-V468 HydrophobicContact CG2-CG2 3.85Å; V468-C472 HydrophobicContact CG1-CB 3.98Å; V468-L474 HydrophobicContact CG2-CB 3.94Å; V468-L474 HydrophobicContact CG2-CD2 3.72Å; V468-L474 HydrophobicContact CG2-CG 4.46Å
469	P	98.4	Very high	96.6	Very high	56 Å²	56	48.6 Å²	48.6	36%	0.364	27%	0.269	S	S	.	.			trans	-68	162.1	177.4	-20.1	32.6	0	0	0	113.5	C441 K467 K471 C472	C441-P469 VanDerWaalsContact CB-O 3.3Å; C441-P469 WeakPolarHBondContact CB-O 3.48Å; K467-P469 WeakPolarHBondContact O-CD 3.46Å; P469-K471 PolarHBondContact O-N 2.8Å; P469-C472 HydrophobicContact CB-CB 4.46Å; P469-C472 WeakPolarHBondContact O-CB 3.3Å; P469-C472 PolarHBondContact O-N 2.98Å; P469-C472 VanDerWaalsContact O-N 3.1Å
470	P	98.1	Very high	96.5	Very high	49 Å²	49	44.5 Å²	44.5	32%	0.318	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	133.5	168.3	-29	37.3	0	0	0	112.5	S443 D444 C472	S443-P470 WeakPolarHBondContact O-CB 3.23Å; D444-P470 VanDerWaalsContact O-CG 3.28Å; D444-P470 WeakPolarHBondContact O-CG 3.49Å; P470-C472 PolarHBondContact O-N 3.48Å
471	K	96.1	Very high	96.3	Very high	92 Å²	92	42 Å²	42	40%	0.4	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	6.9	-178.8	-39.9	-56.5	174.2	-175.4	0	115.9	C441 L442 P469	C441-K471 PolarHBondContact O-N 3.3Å; L442-K471 PolarHBondContact O-NZ 2.85Å; P469-K471 PolarHBondContact O-N 2.8Å
472	C	97.7	Very high	96.2	Very high	38 Å²	38	35.8 Å²	35.8	26%	0.257	21%	0.21	S	C	.	.			trans	-88.8	164.7	165.6	-65	0	0	0	0	110.9	C441 V468 P469 P470	C441-C472 PolarHBondContact N-O 3.1Å; V468-C472 HydrophobicContact CG1-CB 3.98Å; P469-C472 HydrophobicContact CB-CB 4.46Å; P469-C472 WeakPolarHBondContact O-CB 3.3Å; P469-C472 PolarHBondContact O-N 2.98Å; P469-C472 VanDerWaalsContact O-N 3.1Å; P470-C472 PolarHBondContact O-N 3.48Å
473	N	97.1	Very high	96.1	Very high	35 Å²	35	32 Å²	32	19%	0.187	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	168.1	172.3	74.6	89.4	0	0	0	110.7	Y117 L439	Y117-N473 PolarHBondContact O-ND2 2.92Å; L439-N473 CarbonylContact O-C 3.53Å; L439-N473 WeakPolarHBondContact O-CA 3.42Å; L439-N473 VanDerWaalsContact O-CB 3.26Å; L439-N473 WeakPolarHBondContact O-CB 3.2Å
474	L	96.8	Very high	95.9	Very high	17 Å²	17	32 Å²	32	9%	0.089	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	131.7	-178.5	-179.1	64.8	0	0	0	110.7	Y438 L439 V449 V466 V468 L476	Y438-L474 WeakPolarHBondContact CA-O 3.47Å; L439-L474 PolarHBondContact N-O 2.83Å; L439-L474 PolarHBondContact O-N 2.79Å; V449-L474 HydrophobicContact CB-CD2 4.2Å; V449-L474 HydrophobicContact CG1-CD2 4.13Å; V449-L474 HydrophobicContact CG2-CD2 4.39Å; V466-L474 HydrophobicContact CB-CD2 4.09Å; V466-L474 HydrophobicContact CG1-CD1 4.44Å; V466-L474 HydrophobicContact CG1-CD2 3.87Å; V468-L474 HydrophobicContact CG2-CB 3.94Å; V468-L474 HydrophobicContact CG2-CD2 3.72Å; V468-L474 HydrophobicContact CG2-CG 4.46Å; L474-L476 HydrophobicContact CD2-CD2 4.24Å; L474-L476 HydrophobicContact CG-CD2 4.46Å; L474-L476 PolarHBondContact O-N 3.42Å
475	K	97.1	Very high	95.6	Very high	20 Å²	20	30.8 Å²	30.8	9%	0.087	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	113.3	166.3	-178.4	171.5	168.1	174.9	0	109.3	E436 Y438 C454 D478	E436-K475 WeakPolarHBondContact OE1-CE 3.45Å; E436-K475 IonicContact OE1-NZ 2.75Å; E436-K475 PolarHBondContact OE1-NZ 3.4Å; Y438-K475 HydrophobicContact CD1-CB 3.99Å; Y438-K475 HydrophobicContact CE1-CB 3.68Å; Y438-K475 HydrophobicContact CE1-CD 4.45Å; Y438-K475 HydrophobicContact CE1-CG 4.13Å; C454-K475 PolarHBondContact SG-O 3.3Å; K475-D478 WeakPolarHBondContact CE-OD2 3.41Å; K475-D478 IonicContact NZ-OD2 3.88Å; K475-D478 PolarHBondContact NZ-OD2 2.92Å
476	L	97.4	Very high	95.4	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.01	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-40.2	-177.9	-64.5	-173.9	0	0	0	113.2	L430 V437 L439 V449 S451 C454 L474 I506	L430-L476 HydrophobicContact CD2-CD1 3.88Å; V437-L476 HydrophobicContact CB-CB 4.42Å; V437-L476 HydrophobicContact CG1-CB 4.38Å; V437-L476 HydrophobicContact CG1-CD1 4.17Å; V437-L476 WeakPolarHBondContact O-CA 3.31Å; V437-L476 WeakPolarHBondContact O-CB 3.18Å; V437-L476 PolarHBondContact O-N 2.93Å; L439-L476 HydrophobicContact CB-CD1 3.8Å; L439-L476 HydrophobicContact CB-CD2 3.92Å; L439-L476 HydrophobicContact CB-CG 3.81Å; L439-L476 HydrophobicContact CD1-CD1 4.29Å; L439-L476 HydrophobicContact CD1-CD2 4.34Å; V449-L476 HydrophobicContact CG1-CD2 3.5Å; S451-L476 WeakPolarHBondContact CB-O 3.4Å; S451-L476 PolarHBondContact OG-O 3.01Å; C454-L476 PolarHBondContact N-O 3.3Å; L474-L476 HydrophobicContact CD2-CD2 4.24Å; L474-L476 HydrophobicContact CG-CD2 4.46Å; L474-L476 PolarHBondContact O-N 3.42Å; L476-I506 HydrophobicContact CB-CD1 4.07Å; L476-I506 HydrophobicContact CD1-CD1 4.35Å; L476-I506 HydrophobicContact CD1-CG2 4.23Å; L476-I506 HydrophobicContact CD2-CG2 4.47Å
477	F	97.3	Very high	95	Very high	1 Å²	1	30.1 Å²	30.1	0%	0.004	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	153.2	-168.9	-170.3	-92.4	0	0	0	111.7	E436 V437 S453 F482 M503 I506 L534 P537	E436-F477 WeakPolarHBondContact CA-O 3.47Å; V437-F477 HydrophobicContact CB-CB 4.06Å; V437-F477 HydrophobicContact CG2-CB 4.2Å; V437-F477 PolarHBondContact N-O 3.17Å; V437-F477 PolarHBondContact O-N 3.02Å; S453-F477 VanDerWaalsContact CB-CD2 3.44Å; F477-F482 HydrophobicContact CE1-CB 4.11Å; F477-F482 HydrophobicContact CE2-CB 4.28Å; F477-F482 HydrophobicContact CE2-CD2 4.25Å; F477-F482 HydrophobicContact CE2-CG 4.33Å; F477-F482 HydrophobicContact CZ-CB 3.54Å; F477-F482 HydrophobicContact CZ-CD1 4.16Å; F477-F482 AromaticContact CZ-CD2 3.97Å; F477-F482 HydrophobicContact CZ-CD2 3.97Å; F477-F482 AromaticContact CZ-CG 3.62Å; F477-F482 HydrophobicContact CZ-CG 3.62Å; F477-M503 WeakPolarHBondContact CE2-O 3.44Å; F477-I506 HydrophobicContact CB-CD1 4.27Å; F477-L534 HydrophobicContact CB-CD1 3.7Å; F477-L534 HydrophobicContact CD1-CD1 3.54Å; F477-L534 HydrophobicContact CD2-CD1 3.51Å; F477-L534 HydrophobicContact CE1-CD1 3.98Å; F477-L534 HydrophobicContact CE2-CD1 3.95Å; F477-L534 HydrophobicContact CG-CD1 3.29Å; F477-L534 HydrophobicContact CZ-CD1 4.17Å; F477-P537 HydrophobicContact CD1-CG 4.47Å; F477-P537 HydrophobicContact CE1-CB 4.28Å; F477-P537 HydrophobicContact CE1-CG 3.44Å; F477-P537 VanDerWaalsContact CE1-CG 3.44Å; F477-P537 HydrophobicContact CZ-CB 3.82Å; F477-P537 HydrophobicContact CZ-CG 3.5Å; F477-P537 VanDerWaalsContact CZ-CG 3.5Å
478	D	94.6	Very high	94.6	Very high	24 Å²	24	28 Å²	28	13%	0.128	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	113.2	178.8	-174.3	-43.4	0	0	0	109.3	K475 T480 A481 F482	K475-D478 WeakPolarHBondContact CE-OD2 3.41Å; K475-D478 IonicContact NZ-OD2 3.88Å; K475-D478 PolarHBondContact NZ-OD2 2.92Å; D478-T480 WeakPolarHBondContact OD1-CA 3.41Å; D478-T480 PolarHBondContact OD1-N 3.48Å; D478-A481 HydrophobicContact CB-CB 3.88Å; D478-A481 PolarHBondContact OD1-N 2.95Å; D478-F482 WeakPolarHBondContact O-CB 3.5Å; D478-F482 PolarHBondContact O-N 2.88Å
479	S	92.2	Very high	94.1	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.007	17%	0.172	C	C	.	.	H	α-helix	trans	-74.3	-27.5	-176.9	-50	0	0	0	0	112.7	S435 A483	S435-S479 WeakPolarHBondContact O-CB 3.34Å; S435-S479 PolarHBondContact O-N 2.69Å; S435-S479 PolarHBondContact O-OG 2.84Å; S479-A483 WeakPolarHBondContact O-CB 3.43Å; S479-A483 PolarHBondContact O-N 2.82Å
480	T	91.7	Very high	93.5	Very high	30 Å²	30	27 Å²	27	18%	0.184	16%	0.157	C	C	.	.	H	α-helix	trans	-71.9	-41.3	176.8	-55.8	0	0	0	0	110	K254 A257 D258 S435 D478 A483 S484	K254-T480 HydrophobicContact CG-CG2 4.26Å; A257-T480 VanDerWaalsContact CB-OG1 3.29Å; A257-T480 WeakPolarHBondContact CB-OG1 3.49Å; D258-T480 WeakPolarHBondContact OD1-CG2 3.49Å; D258-T480 PolarHBondContact OD1-OG1 3.07Å; S435-T480 PolarHBondContact OG-OG1 2.77Å; D478-T480 WeakPolarHBondContact OD1-CA 3.41Å; D478-T480 PolarHBondContact OD1-N 3.48Å; T480-A483 PolarHBondContact O-N 2.9Å; T480-S484 PolarHBondContact O-N 2.87Å
481	A	92.4	Very high	92.8	Very high	43 Å²	43	28.4 Å²	28.4	36%	0.355	17%	0.169	S	C	.	.	H	α-helix	trans	-66.3	-39.8	172.5	0	0	0	0	0	112.4	D478 S484 Q485	D478-A481 HydrophobicContact CB-CB 3.88Å; D478-A481 PolarHBondContact OD1-N 2.95Å; A481-S484 PolarHBondContact O-N 2.92Å; A481-Q485 PolarHBondContact O-N 2.87Å
482	F	94.6	Very high	92.3	Very high	3 Å²	3	32.4 Å²	32.4	1%	0.013	18%	0.181	C	C	.	.	H	α-helix	trans	-64.8	-41.2	174.4	178	-99.7	0	0	0	112.5	F477 D478 S484 Q485 L486 L500 M503 C504 P537 W540	F477-F482 HydrophobicContact CE1-CB 4.11Å; F477-F482 HydrophobicContact CE2-CB 4.28Å; F477-F482 HydrophobicContact CE2-CD2 4.25Å; F477-F482 HydrophobicContact CE2-CG 4.33Å; F477-F482 HydrophobicContact CZ-CB 3.54Å; F477-F482 HydrophobicContact CZ-CD1 4.16Å; F477-F482 AromaticContact CZ-CD2 3.97Å; F477-F482 HydrophobicContact CZ-CD2 3.97Å; F477-F482 AromaticContact CZ-CG 3.62Å; F477-F482 HydrophobicContact CZ-CG 3.62Å; D478-F482 WeakPolarHBondContact O-CB 3.5Å; D478-F482 PolarHBondContact O-N 2.88Å; F482-S484 VanDerWaalsContact C-N 3.32Å; F482-S484 PolarHBondContact O-N 3.04Å; F482-Q485 PolarHBondContact O-N 2.91Å; F482-Q485 VanDerWaalsContact O-N 3.17Å; F482-L486 HydrophobicContact CE1-CD2 4.38Å; F482-L486 WeakPolarHBondContact O-CB 3.44Å; F482-L486 PolarHBondContact O-N 3.05Å; F482-L500 HydrophobicContact CE2-CB 4.23Å; F482-M503 HydrophobicContact CD2-CB 4.05Å; F482-M503 HydrophobicContact CE2-CB 3.94Å; F482-C504 VanDerWaalsContact CZ-SG 3.52Å; F482-P537 HydrophobicContact CD1-CB 3.97Å; F482-P537 HydrophobicContact CE1-CB 3.73Å; F482-P537 HydrophobicContact CZ-CB 4.2Å; F482-W540 HydrophobicContact CD1-CE3 4.13Å; F482-W540 HydrophobicContact CE1-CE3 4.39Å
483	A	91.9	Very high	91.8	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-59.9	-41.2	175.4	0	0	0	0	0	112.1	A253 K254 S479 T480 L486 A487 W540	A253-A483 HydrophobicContact CB-CB 4.02Å; K254-A483 HydrophobicContact CB-CB 4.43Å; S479-A483 WeakPolarHBondContact O-CB 3.43Å; S479-A483 PolarHBondContact O-N 2.82Å; T480-A483 PolarHBondContact O-N 2.9Å; A483-L486 PolarHBondContact O-N 3.25Å; A483-A487 PolarHBondContact O-N 3.24Å; A483-A487 VanDerWaalsContact O-N 3.08Å; A483-W540 HydrophobicContact CB-CZ3 4.02Å
484	S	91.9	Very high	91.5	Very high	49 Å²	49	33.1 Å²	33.1	34%	0.343	18%	0.182	S	C	.	.	H	α-helix	trans	-63.2	-45.6	172.9	-158.5	0	0	0	0	111.6	T480 A481 F482 L486 A487 D488	T480-S484 PolarHBondContact O-N 2.87Å; A481-S484 PolarHBondContact O-N 2.92Å; F482-S484 VanDerWaalsContact C-N 3.32Å; F482-S484 PolarHBondContact O-N 3.04Å; S484-L486 VanDerWaalsContact C-N 3.27Å; S484-L486 PolarHBondContact O-N 3.15Å; S484-A487 VanDerWaalsContact O-CB 3.26Å; S484-A487 WeakPolarHBondContact O-CB 3.26Å; S484-A487 PolarHBondContact O-N 3.5Å; S484-A487 VanDerWaalsContact O-N 3.12Å; S484-D488 PolarHBondContact O-N 2.78Å
485	Q	91	Very high	91.2	Very high	20 Å²	20	35.7 Å²	35.7	9%	0.093	19%	0.193	C	C	.	.	H	α-helix	trans	-61.2	-35.6	177.2	-173.2	169.3	-15.1	0	0	112.7	R456 A481 F482 D488 N489 L500	R456-Q485 VanDerWaalsContact CD-OE1 3.26Å; A481-Q485 PolarHBondContact O-N 2.87Å; F482-Q485 PolarHBondContact O-N 2.91Å; F482-Q485 VanDerWaalsContact O-N 3.17Å; Q485-D488 PolarHBondContact O-N 2.93Å; Q485-N489 PolarHBondContact O-N 2.85Å; Q485-N489 PolarHBondContact O-ND2 2.88Å; Q485-L500 HydrophobicContact CG-CD1 4.45Å; Q485-L500 HydrophobicContact CG-CD2 3.82Å
486	L	92.4	Very high	91	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.016	20%	0.201	C	C	.	.	H	α-helix	trans	-66.1	-42.2	175.1	-174.7	56.1	0	0	0	111	F482 A483 S484 N489 M490 V497 L500 W540 L541 V544	F482-L486 HydrophobicContact CE1-CD2 4.38Å; F482-L486 WeakPolarHBondContact O-CB 3.44Å; F482-L486 PolarHBondContact O-N 3.05Å; A483-L486 PolarHBondContact O-N 3.25Å; S484-L486 VanDerWaalsContact C-N 3.27Å; S484-L486 PolarHBondContact O-N 3.15Å; L486-N489 PolarHBondContact O-N 2.9Å; L486-M490 WeakPolarHBondContact O-CB 3.05Å; L486-M490 PolarHBondContact O-N 3.07Å; L486-M490 VanDerWaalsContact O-N 3.1Å; L486-V497 HydrophobicContact CD1-CG1 3.67Å; L486-L500 HydrophobicContact CB-CD1 4.4Å; L486-L500 HydrophobicContact CD1-CD1 3.89Å; L486-W540 HydrophobicContact CD2-CB 4.17Å; L486-L541 HydrophobicContact CD1-CD1 3.73Å; L486-V544 HydrophobicContact CD1-CB 4.27Å; L486-V544 HydrophobicContact CD1-CG1 4.09Å; L486-V544 HydrophobicContact CD1-CG2 4.17Å; L486-V544 HydrophobicContact CD2-CG2 3.96Å; L486-V544 HydrophobicContact CG-CG2 4.12Å
487	A	90	Very high	90.7	Very high	23 Å²	23	36.3 Å²	36.3	19%	0.19	20%	0.2	C	C	.	.	H	α-helix	trans	-56.5	-51.2	171.9	0	0	0	0	0	112	A250 A483 S484 N489 M490	A250-A487 HydrophobicContact CB-CB 3.46Å; A250-A487 VanDerWaalsContact CB-CB 3.46Å; A483-A487 PolarHBondContact O-N 3.24Å; A483-A487 VanDerWaalsContact O-N 3.08Å; S484-A487 VanDerWaalsContact O-CB 3.26Å; S484-A487 WeakPolarHBondContact O-CB 3.26Å; S484-A487 PolarHBondContact O-N 3.5Å; S484-A487 VanDerWaalsContact O-N 3.12Å; A487-N489 PolarHBondContact O-N 3.25Å; A487-N489 VanDerWaalsContact O-N 3.13Å; A487-M490 PolarHBondContact O-N 2.88Å
488	D	89.8	Confident	90.5	Very high	76 Å²	76	41.4 Å²	41.4	41%	0.406	22%	0.223	S	C	.	.	H	α-helix	trans	-65	-17	-174.6	-60.9	-30.6	0	0	0	114.1	S484 Q485 R492	S484-D488 PolarHBondContact O-N 2.78Å; Q485-D488 PolarHBondContact O-N 2.93Å; D488-R492 PolarHBondContact O-NE 3.29Å
489	N	88.7	Confident	90.5	Very high	28 Å²	28	43 Å²	43	15%	0.15	24%	0.236	C	C	.	.	H	α-helix	trans	-107.6	-24.1	-178.4	-75.7	-82.1	0	0	0	113.8	Q485 L486 A487 S491 R492 V497 L500	Q485-N489 PolarHBondContact O-N 2.85Å; Q485-N489 PolarHBondContact O-ND2 2.88Å; L486-N489 PolarHBondContact O-N 2.9Å; A487-N489 PolarHBondContact O-N 3.25Å; A487-N489 VanDerWaalsContact O-N 3.13Å; N489-S491 PolarHBondContact O-N 2.98Å; N489-R492 WeakPolarHBondContact O-CB 3.35Å; N489-R492 PolarHBondContact O-N 3.35Å; N489-V497 HydrophobicContact CB-CG2 3.94Å; N489-V497 WeakPolarHBondContact O-CG2 3.3Å; N489-L500 HydrophobicContact CB-CD1 4.16Å
490	M	85.7	Confident	90.5	Very high	11 Å²	11	43.1 Å²	43.1	5%	0.054	24%	0.236	C	C	.	.	H	α-helix	trans	-65.1	-21.7	-178.9	-163	168.8	177.5	0	0	113.2	A246 L486 A487 V497 V544 Q547 M548	A246-M490 WeakPolarHBondContact CA-SD 3.4Å; A246-M490 HydrophobicContact CB-CB 4.29Å; A246-M490 HydrophobicContact CB-CE 3.53Å; A246-M490 HydrophobicContact CB-CG 3.6Å; A246-M490 HydrophobicContact CB-SD 3.34Å; A246-M490 WeakPolarHBondContact CB-SD 3.36Å; L486-M490 WeakPolarHBondContact O-CB 3.05Å; L486-M490 PolarHBondContact O-N 3.07Å; L486-M490 VanDerWaalsContact O-N 3.1Å; A487-M490 PolarHBondContact O-N 2.88Å; M490-V497 HydrophobicContact CB-CG2 4.36Å; M490-V544 HydrophobicContact CE-CB 4.23Å; M490-V544 HydrophobicContact CE-CG1 3.73Å; M490-V544 HydrophobicContact CE-CG2 4.11Å; M490-V544 HydrophobicContact CG-CG1 3.82Å; M490-V544 HydrophobicContact SD-CB 4.12Å; M490-V544 HydrophobicContact SD-CG1 3.47Å; M490-V544 WeakPolarHBondContact SD-CG1 3.07Å; M490-V544 HydrophobicContact SD-CG2 3.65Å; M490-Q547 HydrophobicContact CE-CB 4.32Å; M490-M548 HydrophobicContact CE-CG 4.24Å; M490-M548 HydrophobicContact CG-CG 4.43Å; M490-M548 HydrophobicContact CG-SD 3.72Å
491	S	83.1	Confident	90.7	Very high	80 Å²	80	43.8 Å²	43.8	56%	0.559	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-2.2	172.5	57.8	0	0	0	0	114.8	N489	N489-S491 PolarHBondContact O-N 2.98Å
492	R	84.7	Confident	90.7	Very high	175 Å²	175	47.9 Å²	47.9	66%	0.66	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-68.8	-172.3	-60.4	-178.2	-177.2	-115.5	-5.8	112.9	D488 N489	D488-R492 PolarHBondContact O-NE 3.29Å; N489-R492 WeakPolarHBondContact O-CB 3.35Å; N489-R492 PolarHBondContact O-N 3.35Å
493	S	88	Confident	90.7	Very high	36 Å²	36	48.7 Å²	48.7	25%	0.252	26%	0.256	S	S	.	.			trans	-167.6	162.8	-178.3	89.1	0	0	0	0	111.4	E495 S496 V497	S493-E495 VanDerWaalsContact C-N 3.29Å; S493-E495 WeakPolarHBondContact CB-OE2 3.28Å; S493-E495 PolarHBondContact O-N 2.85Å; S493-E495 PolarHBondContact OG-N 3.06Å; S493-E495 PolarHBondContact OG-OE2 3.25Å; S493-S496 PolarHBondContact O-N 3.46Å; S493-S496 PolarHBondContact OG-N 2.71Å; S493-S496 PolarHBondContact OG-OG 3.14Å; S493-V497 PolarHBondContact O-N 3.26Å
494	Y	90.8	Very high	90.9	Very high	52 Å²	52	48.6 Å²	48.6	20%	0.204	26%	0.255	C	S	.	.	H	α-helix	trans	-54.8	-48.4	172.7	-179.5	-83.2	0	0	0	111.2	S496 V497 F498 L545 M548 G549 P551	Y494-S496 VanDerWaalsContact C-N 3.33Å; Y494-S496 PolarHBondContact O-N 3.12Å; Y494-V497 PolarHBondContact O-N 3.31Å; Y494-F498 HydrophobicContact CD1-CB 4.23Å; Y494-F498 HydrophobicContact CE1-CB 3.96Å; Y494-F498 AromaticContact CE1-CD2 3.97Å; Y494-F498 HydrophobicContact CE1-CD2 3.97Å; Y494-F498 HydrophobicContact CE1-CG 4.11Å; Y494-F498 WeakPolarHBondContact O-CB 3.41Å; Y494-F498 PolarHBondContact O-N 3.46Å; Y494-L545 HydrophobicContact CD2-CD2 4.31Å; Y494-L545 HydrophobicContact CE2-CD2 3.91Å; Y494-M548 HydrophobicContact CD2-CB 4.36Å; Y494-G549 WeakPolarHBondContact CD2-O 3.49Å; Y494-G549 VanDerWaalsContact CE2-O 3.26Å; Y494-G549 WeakPolarHBondContact CE2-O 3.18Å; Y494-P551 HydrophobicContact CD1-CB 4.34Å; Y494-P551 HydrophobicContact CD1-CG 3.72Å; Y494-P551 HydrophobicContact CE1-CG 3.69Å; Y494-P551 HydrophobicContact CG-CG 4.44Å
495	E	91.2	Very high	91.1	Very high	72 Å²	72	47.2 Å²	47.2	34%	0.336	25%	0.245	S	C	.	.	H	α-helix	trans	-64.8	-36.2	-175.4	-53.7	80.6	-176.8	0	0	111.6	S493 F498 S499 T552	S493-E495 VanDerWaalsContact C-N 3.29Å; S493-E495 WeakPolarHBondContact CB-OE2 3.28Å; S493-E495 PolarHBondContact O-N 2.85Å; S493-E495 PolarHBondContact OG-N 3.06Å; S493-E495 PolarHBondContact OG-OE2 3.25Å; E495-F498 PolarHBondContact O-N 3.4Å; E495-S499 PolarHBondContact O-N 3.4Å; E495-T552 PolarHBondContact OE1-N 3.38Å; E495-T552 PolarHBondContact OE1-OG1 3.37Å
496	S	91.6	Very high	91.5	Very high	35 Å²	35	46.2 Å²	46.2	25%	0.245	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-47.6	175.2	-63	0	0	0	0	111.6	S493 Y494 S499	S493-S496 PolarHBondContact O-N 3.46Å; S493-S496 PolarHBondContact OG-N 2.71Å; S493-S496 PolarHBondContact OG-OG 3.14Å; Y494-S496 VanDerWaalsContact C-N 3.33Å; Y494-S496 PolarHBondContact O-N 3.12Å; S496-S499 PolarHBondContact O-OG 3.41Å
497	V	92.5	Very high	91.8	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-71.6	-40.8	176.8	178.7	0	0	0	0	111.5	L486 N489 M490 S493 Y494 S499 L500 L541 V544 L545 M548	L486-V497 HydrophobicContact CD1-CG1 3.67Å; N489-V497 HydrophobicContact CB-CG2 3.94Å; N489-V497 WeakPolarHBondContact O-CG2 3.3Å; M490-V497 HydrophobicContact CB-CG2 4.36Å; S493-V497 PolarHBondContact O-N 3.26Å; Y494-V497 PolarHBondContact O-N 3.31Å; V497-S499 PolarHBondContact O-N 2.84Å; V497-L500 HydrophobicContact CG1-CD1 4.44Å; V497-L500 WeakPolarHBondContact O-CA 3.36Å; V497-L500 WeakPolarHBondContact O-CB 3.36Å; V497-L500 WeakPolarHBondContact O-CG 3.46Å; V497-L500 PolarHBondContact O-N 2.96Å; V497-L541 HydrophobicContact CG1-CD1 3.42Å; V497-L541 VanDerWaalsContact CG1-CD1 3.42Å; V497-V544 HydrophobicContact CG1-CG1 3.79Å; V497-V544 HydrophobicContact CG2-CG1 4.5Å; V497-L545 HydrophobicContact CB-CD2 4.28Å; V497-L545 HydrophobicContact CG1-CD2 4Å; V497-L545 HydrophobicContact CG1-CG 4.28Å; V497-M548 HydrophobicContact CB-CE 3.42Å; V497-M548 VanDerWaalsContact CB-CE 3.42Å; V497-M548 HydrophobicContact CG1-CE 3.97Å; V497-M548 HydrophobicContact CG2-CE 3.42Å; V497-M548 VanDerWaalsContact CG2-CE 3.42Å; V497-M548 HydrophobicContact CG2-SD 4.02Å
498	F	93	Very high	92.2	Very high	108 Å²	108	49.1 Å²	49.1	47%	0.474	25%	0.247	S	C	.	.	H	α-helix	trans	-57.1	-36.4	178.7	-174.5	-94.9	0	0	0	111.8	Y494 E495 L500 T501 L545	Y494-F498 HydrophobicContact CD1-CB 4.23Å; Y494-F498 HydrophobicContact CE1-CB 3.96Å; Y494-F498 AromaticContact CE1-CD2 3.97Å; Y494-F498 HydrophobicContact CE1-CD2 3.97Å; Y494-F498 HydrophobicContact CE1-CG 4.11Å; Y494-F498 WeakPolarHBondContact O-CB 3.41Å; Y494-F498 PolarHBondContact O-N 3.46Å; E495-F498 PolarHBondContact O-N 3.4Å; F498-L500 PolarHBondContact O-N 3Å; F498-T501 WeakPolarHBondContact O-CB 3.35Å; F498-T501 PolarHBondContact O-N 2.75Å; F498-T501 VanDerWaalsContact O-N 3.13Å; F498-T501 PolarHBondContact O-OG1 2.89Å; F498-L545 HydrophobicContact CB-CD2 4.22Å; F498-L545 HydrophobicContact CD2-CD1 4.22Å; F498-L545 HydrophobicContact CD2-CD2 4.49Å
499	S	92.8	Very high	92.6	Very high	57 Å²	57	45.5 Å²	45.5	40%	0.399	23%	0.227	S	C	.	.	H	α-helix	trans	-58.9	-26.4	173.7	83.2	0	0	0	0	114.1	E495 S496 V497 T501 H502	E495-S499 PolarHBondContact O-N 3.4Å; S496-S499 PolarHBondContact O-OG 3.41Å; V497-S499 PolarHBondContact O-N 2.84Å; S499-T501 PolarHBondContact O-N 2.93Å; S499-T501 VanDerWaalsContact O-N 3.15Å; S499-H502 PolarHBondContact O-CD2 2.91Å; S499-H502 PolarHBondContact O-N 2.79Å
500	L	93.7	Very high	93.1	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.016	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-66.5	-13.8	178.4	-55.1	-177.2	0	0	0	113.1	F482 Q485 L486 N489 V497 F498 H502 M503 L541	F482-L500 HydrophobicContact CE2-CB 4.23Å; Q485-L500 HydrophobicContact CG-CD1 4.45Å; Q485-L500 HydrophobicContact CG-CD2 3.82Å; L486-L500 HydrophobicContact CB-CD1 4.4Å; L486-L500 HydrophobicContact CD1-CD1 3.89Å; N489-L500 HydrophobicContact CB-CD1 4.16Å; V497-L500 HydrophobicContact CG1-CD1 4.44Å; V497-L500 WeakPolarHBondContact O-CA 3.36Å; V497-L500 WeakPolarHBondContact O-CB 3.36Å; V497-L500 WeakPolarHBondContact O-CG 3.46Å; V497-L500 PolarHBondContact O-N 2.96Å; F498-L500 PolarHBondContact O-N 3Å; L500-H502 PolarHBondContact O-N 3.12Å; L500-H502 VanDerWaalsContact O-N 3.17Å; L500-M503 HydrophobicContact CB-CG 4.43Å; L500-M503 HydrophobicContact CD2-CG 4.17Å; L500-M503 VanDerWaalsContact O-CB 3.25Å; L500-M503 WeakPolarHBondContact O-CB 3.35Å; L500-M503 PolarHBondContact O-N 2.93Å; L500-L541 HydrophobicContact CB-CD1 3.97Å
501	T	94.9	Very high	93.7	Very high	44 Å²	44	44.9 Å²	44.9	27%	0.27	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-53	-35.6	171.3	-50.3	0	0	0	0	111.4	F498 S499 M503 C504 L538 L541	F498-T501 WeakPolarHBondContact O-CB 3.35Å; F498-T501 PolarHBondContact O-N 2.75Å; F498-T501 VanDerWaalsContact O-N 3.13Å; F498-T501 PolarHBondContact O-OG1 2.89Å; S499-T501 PolarHBondContact O-N 2.93Å; S499-T501 VanDerWaalsContact O-N 3.15Å; T501-M503 VanDerWaalsContact C-N 3.3Å; T501-M503 PolarHBondContact O-N 3.03Å; T501-C504 PolarHBondContact O-N 3.41Å; T501-L538 HydrophobicContact CG2-CD2 4.23Å; T501-L541 WeakPolarHBondContact OG1-CD2 3.5Å
502	H	93.3	Very high	94.4	Very high	130 Å²	130	45.1 Å²	45.1	60%	0.602	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-68.1	-26.2	176.7	-60.8	-53.5	0	0	0	113.4	S499 L500 C504 S505	S499-H502 PolarHBondContact O-CD2 2.91Å; S499-H502 PolarHBondContact O-N 2.79Å; L500-H502 PolarHBondContact O-N 3.12Å; L500-H502 VanDerWaalsContact O-N 3.17Å; H502-C504 PolarHBondContact O-N 2.92Å; H502-S505 PolarHBondContact O-N 2.84Å
503	M	94.2	Very high	95	Very high	19 Å²	19	37 Å²	37	9%	0.094	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-67.4	-28.1	175.6	-56	-66.3	-59.3	0	0	112	P452 R456 F477 F482 L500 T501 S505	P452-M503 HydrophobicContact CB-CE 4.25Å; P452-M503 HydrophobicContact CB-SD 3.65Å; P452-M503 WeakPolarHBondContact O-CE 3.22Å; R456-M503 HydrophobicContact CB-CE 4.36Å; F477-M503 WeakPolarHBondContact CE2-O 3.44Å; F482-M503 HydrophobicContact CD2-CB 4.05Å; F482-M503 HydrophobicContact CE2-CB 3.94Å; L500-M503 HydrophobicContact CB-CG 4.43Å; L500-M503 HydrophobicContact CD2-CG 4.17Å; L500-M503 VanDerWaalsContact O-CB 3.25Å; L500-M503 WeakPolarHBondContact O-CB 3.35Å; L500-M503 PolarHBondContact O-N 2.93Å; T501-M503 VanDerWaalsContact C-N 3.3Å; T501-M503 PolarHBondContact O-N 3.03Å; M503-S505 VanDerWaalsContact C-N 3.33Å
504	C	95.9	Very high	95.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-85	-3.6	-178.9	-50.6	0	0	0	0	113.8	F482 T501 H502 L534 P537 L538	F482-C504 VanDerWaalsContact CZ-SG 3.52Å; T501-C504 PolarHBondContact O-N 3.41Å; H502-C504 PolarHBondContact O-N 2.92Å; C504-L534 PolarHBondContact O-N 2.85Å; C504-P537 HydrophobicContact CB-CB 4.34Å; C504-L538 HydrophobicContact CB-CD2 3.63Å; C504-L538 HydrophobicContact CB-CG 3.71Å
505	S	96.6	Very high	95.8	Very high	19 Å²	19	33.8 Å²	33.8	13%	0.133	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	115.5	-177.5	-58.8	0	0	0	0	110.5	H502 M503 H533	H502-S505 PolarHBondContact O-N 2.84Å; M503-S505 VanDerWaalsContact C-N 3.33Å; S505-H533 PolarHBondContact OG-CD2 2.79Å
506	I	98.4	Very high	96	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135.6	-178.8	-60.1	155.9	0	0	0	108.9	V449 L476 F477 V508 V532 L534	V449-I506 HydrophobicContact CG1-CG2 4.39Å; L476-I506 HydrophobicContact CB-CD1 4.07Å; L476-I506 HydrophobicContact CD1-CD1 4.35Å; L476-I506 HydrophobicContact CD1-CG2 4.23Å; L476-I506 HydrophobicContact CD2-CG2 4.47Å; F477-I506 HydrophobicContact CB-CD1 4.27Å; I506-V508 HydrophobicContact CG2-CG2 4.36Å; I506-V532 HydrophobicContact CB-CB 4.4Å; I506-V532 PolarHBondContact N-O 3.05Å; I506-V532 PolarHBondContact O-N 2.84Å; I506-L534 HydrophobicContact CD1-CD1 3.82Å; I506-L534 HydrophobicContact CD1-CD2 4.39Å; I506-L534 HydrophobicContact CD1-CG 4.13Å
507	R	98.6	Very high	96	Very high	86 Å²	86	37.8 Å²	37.8	33%	0.325	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.1	-177.7	-71.6	174.3	172.8	153.9	0.8	111.3	V449 Q450 W514 I523 W529 I530 E531	V449-R507 WeakPolarHBondContact CA-O 3.44Å; Q450-R507 HydrophobicContact CB-CB 4.39Å; Q450-R507 PolarHBondContact N-O 3.5Å; Q450-R507 PolarHBondContact O-N 2.9Å; R507-W514 HydrophobicContact CB-CZ2 4.5Å; R507-I523 HydrophobicContact CB-CD1 3.63Å; R507-I523 HydrophobicContact CG-CD1 4.24Å; R507-W529 HydrophobicContact CG-CZ3 4.45Å; R507-I530 WeakPolarHBondContact CA-O 3.42Å; R507-E531 HydrophobicContact CG-CB 4.5Å; R507-E531 HydrophobicContact CG-CG 3.95Å; R507-E531 IonicContact CZ-OE2 3.45Å; R507-E531 IonicContact NE-OE2 2.85Å; R507-E531 PolarHBondContact NE-OE2 3.16Å; R507-E531 IonicContact NH2-OE1 3.96Å; R507-E531 IonicContact NH2-OE2 3.12Å; R507-E531 PolarHBondContact NH2-OE2 3.18Å; R507-E531 VanDerWaalsContact NH2-OE2 3.12Å
508	V	98.7	Very high	96.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	121.3	-178.7	-171.8	0	0	0	0	111	I428 L439 V447 F448 V449 I506 W529 I530	I428-V508 HydrophobicContact CD1-CG1 4.33Å; L439-V508 HydrophobicContact CD1-CG1 4.19Å; L439-V508 HydrophobicContact CD1-CG2 3.96Å; V447-V508 HydrophobicContact CB-CG1 4.07Å; V447-V508 HydrophobicContact CG2-CG1 4.3Å; F448-V508 CarbonylContact O-C 3.58Å; F448-V508 VanDerWaalsContact O-CA 3.28Å; F448-V508 WeakPolarHBondContact O-CA 3.45Å; V449-V508 HydrophobicContact CG2-CG1 4.15Å; V449-V508 HydrophobicContact CG2-CG2 4.23Å; I506-V508 HydrophobicContact CG2-CG2 4.36Å; V508-W529 CarbonylContact O-C 3.56Å; V508-W529 WeakPolarHBondContact O-CA 3.24Å; V508-W529 VanDerWaalsContact O-CB 3.31Å; V508-W529 WeakPolarHBondContact O-CB 3.48Å; V508-I530 HydrophobicContact CB-CD1 4.23Å; V508-I530 HydrophobicContact CB-CG1 3.84Å; V508-I530 HydrophobicContact CG2-CG1 4.49Å; V508-I530 PolarHBondContact N-O 2.92Å; V508-I530 PolarHBondContact O-N 2.8Å
509	S	98.7	Very high	96.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	137.1	172.6	-177.1	0	0	0	0	111	V447 F448 K512 T526 C528	V447-S509 WeakPolarHBondContact CA-O 3.27Å; F448-S509 PolarHBondContact N-O 2.91Å; F448-S509 PolarHBondContact O-N 2.72Å; S509-K512 WeakPolarHBondContact CB-O 3.45Å; S509-K512 PolarHBondContact OG-O 2.81Å; S509-T526 WeakPolarHBondContact OG-CB 3.33Å; S509-T526 WeakPolarHBondContact OG-CG2 3.48Å; S509-T526 PolarHBondContact OG-OG1 3.36Å; S509-C528 PolarHBondContact OG-O 3.12Å
510	F	98.7	Very high	96.6	Very high	1 Å²	1	46.9 Å²	46.9	0%	0.004	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	136.9	176.4	-59.7	-88.1	0	0	0	110.8	I390 L405 I424 I428 V447 K512 C528 I530	I390-F510 HydrophobicContact CG2-CZ 4.18Å; L405-F510 HydrophobicContact CD1-CE2 3.7Å; L405-F510 HydrophobicContact CD1-CZ 3.9Å; I424-F510 HydrophobicContact CD1-CB 4.46Å; I424-F510 HydrophobicContact CD1-CD2 4.32Å; I424-F510 HydrophobicContact CD1-CG 4.3Å; I424-F510 HydrophobicContact CG1-CB 3.95Å; I424-F510 HydrophobicContact CG1-CD1 4.36Å; I424-F510 HydrophobicContact CG1-CG 4.07Å; I424-F510 HydrophobicContact CG2-CD1 3.89Å; I424-F510 HydrophobicContact CG2-CE1 4.02Å; I424-F510 HydrophobicContact CG2-CG 4.39Å; I428-F510 HydrophobicContact CG1-CE1 4.22Å; I428-F510 HydrophobicContact CG1-CZ 4.42Å; I428-F510 HydrophobicContact CG2-CE1 4.12Å; V447-F510 HydrophobicContact CG1-CD1 3.87Å; V447-F510 HydrophobicContact CG1-CE1 4.47Å; F510-K512 PolarHBondContact O-N 3.1Å; F510-C528 HydrophobicContact CB-CB 4.43Å; F510-C528 HydrophobicContact CD2-CB 4.34Å; F510-C528 PolarHBondContact N-O 3.21Å; F510-I530 HydrophobicContact CE2-CG1 4.26Å; F510-I530 HydrophobicContact CE2-CG2 4.12Å; F510-I530 HydrophobicContact CZ-CD1 4.37Å
511	V	98.4	Very high	96.8	Very high	26 Å²	26	52.6 Å²	52.6	16%	0.158	26%	0.255	C	S	.	.	S	Bend	trans	66.8	-30.8	170	-163.8	0	0	0	0	115.7	T420 H423 A445 A446	T420-V511 HydrophobicContact CG2-CB 4Å; T420-V511 HydrophobicContact CG2-CG2 4.01Å; H423-V511 HydrophobicContact CB-CG1 4.08Å; H423-V511 HydrophobicContact CB-CG2 3.71Å; A445-V511 HydrophobicContact CB-CB 4.34Å; A445-V511 HydrophobicContact CB-CG1 4.12Å; A445-V511 HydrophobicContact CB-CG2 3.96Å; A446-V511 WeakPolarHBondContact O-CA 3.39Å; A446-V511 PolarHBondContact O-N 3.23Å
512	K	98.2	Very high	96.9	Very high	84 Å²	84	53.4 Å²	53.4	37%	0.365	26%	0.26	S	S	.	.			trans	-126.8	122.6	-174.9	-53.1	-60	171.8	-165.8	0	111.2	F448 S509 F510 P527	F448-K512 VanDerWaalsContact CD2-C 3.46Å; S509-K512 WeakPolarHBondContact CB-O 3.45Å; S509-K512 PolarHBondContact OG-O 2.81Å; F510-K512 PolarHBondContact O-N 3.1Å; K512-P527 HydrophobicContact CG-CG 4.16Å
513	G	97.7	Very high	97.2	Very high	5 Å²	5	47.9 Å²	47.9	5%	0.052	23%	0.234	C	C	.	.			trans	-76.7	165.4	174.5	0	0	0	0	0	114.2
514	W	98.5	Very high	97.4	Very high	6 Å²	6	49.7 Å²	49.7	2%	0.023	25%	0.247	C	C	.	.			trans	-146.2	172.4	172.9	82.4	97.8	0	0	0	110	F448 Q450 V465 R507 Y518 R520 I523 T526	F448-W514 HydrophobicContact CB-CE3 4.12Å; F448-W514 HydrophobicContact CB-CZ3 3.74Å; F448-W514 VanDerWaalsContact O-CZ3 3.31Å; F448-W514 WeakPolarHBondContact O-CZ3 3.36Å; Q450-W514 HydrophobicContact CB-CH2 4Å; Q450-W514 HydrophobicContact CB-CZ2 3.54Å; V465-W514 WeakPolarHBondContact CB-O 3.46Å; V465-W514 HydrophobicContact CG1-CD2 3.97Å; V465-W514 HydrophobicContact CG1-CE3 3.75Å; V465-W514 HydrophobicContact CG1-CH2 3.82Å; V465-W514 HydrophobicContact CG1-CZ2 4.04Å; V465-W514 HydrophobicContact CG1-CZ3 3.65Å; V465-W514 WeakPolarHBondContact CG1-O 3.4Å; V465-W514 HydrophobicContact CG2-CD2 3.97Å; V465-W514 VanDerWaalsContact CG2-CE2 3.5Å; V465-W514 HydrophobicContact CG2-CG 4.33Å; V465-W514 HydrophobicContact CG2-CH2 4.4Å; V465-W514 HydrophobicContact CG2-CZ2 3.77Å; V465-W514 WeakPolarHBondContact CG2-O 3.35Å; R507-W514 HydrophobicContact CB-CZ2 4.5Å; W514-Y518 WeakPolarHBondContact O-CD2 3.38Å; W514-R520 CarbonylContact C-O 3.36Å; W514-R520 WeakPolarHBondContact CA-O 3.35Å; W514-R520 HydrophobicContact CB-CB 3.85Å; W514-R520 VanDerWaalsContact CB-O 3.29Å; W514-R520 WeakPolarHBondContact CB-O 3.3Å; W514-I523 HydrophobicContact CD2-CB 4.04Å; W514-I523 HydrophobicContact CD2-CD1 4.47Å; W514-I523 HydrophobicContact CD2-CG1 4Å; W514-I523 HydrophobicContact CE3-CD1 4.47Å; W514-I523 HydrophobicContact CE3-CG1 4.18Å; W514-I523 HydrophobicContact CG-CB 4.26Å; W514-I523 HydrophobicContact CH2-CD1 3.65Å; W514-I523 HydrophobicContact CH2-CG1 4.22Å; W514-I523 HydrophobicContact CZ2-CB 4.15Å; W514-I523 HydrophobicContact CZ2-CD1 3.61Å; W514-I523 HydrophobicContact CZ2-CG1 4.02Å; W514-I523 HydrophobicContact CZ3-CD1 4.1Å; W514-I523 HydrophobicContact CZ3-CG1 4.3Å; W514-T526 HydrophobicContact CB-CG2 3.82Å; W514-T526 HydrophobicContact CD2-CG2 4.37Å; W514-T526 HydrophobicContact CE3-CG2 4.11Å; W514-T526 HydrophobicContact CG-CG2 4.29Å
515	G	96.7	Very high	97.5	Very high	14 Å²	14	52 Å²	52	14%	0.144	26%	0.263	C	S	.	.	S	Bend	trans	93.1	-171.8	-174	0	0	0	0	0	112.4	E517 Y518 R520	G515-E517 VanDerWaalsContact C-N 3.3Å; G515-E517 PolarHBondContact O-N 3.4Å; G515-E517 VanDerWaalsContact O-N 3.1Å; G515-Y518 PolarHBondContact O-N 3.04Å; G515-R520 PolarHBondContact N-O 3.04Å
516	A	94.1	Very high	97.5	Very high	99 Å²	99	51.1 Å²	51.1	82%	0.818	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-35.3	-165.2	0	0	0	0	0	115.7	Y518	A516-Y518 VanDerWaalsContact C-N 3.27Å; A516-Y518 PolarHBondContact O-N 3.07Å
517	E	93.1	Very high	97.5	Very high	93 Å²	93	51.1 Å²	51.1	44%	0.435	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-2.6	178.5	-58.4	-173.2	137.2	0	0	114.3	I105 G515	I105-E517 WeakPolarHBondContact CG1-OE1 3.49Å; I105-E517 PolarHBondContact N-OE1 3.38Å; G515-E517 VanDerWaalsContact C-N 3.3Å; G515-E517 PolarHBondContact O-N 3.4Å; G515-E517 VanDerWaalsContact O-N 3.1Å
518	Y	96.6	Very high	97.5	Very high	56 Å²	56	47 Å²	47	22%	0.22	24%	0.241	C	C	.	.	S	Bend	trans	-129.6	151.4	-167.4	-58.1	-84.7	0	0	0	112.8	F448 W514 G515 A516 R520 Q521	F448-Y518 HydrophobicContact CD1-CE1 4.44Å; F448-Y518 AromaticContact CE1-CE1 3.78Å; F448-Y518 HydrophobicContact CE1-CE1 3.78Å; F448-Y518 AromaticContact CE1-CZ 3.72Å; W514-Y518 WeakPolarHBondContact O-CD2 3.38Å; G515-Y518 PolarHBondContact O-N 3.04Å; A516-Y518 VanDerWaalsContact C-N 3.27Å; A516-Y518 PolarHBondContact O-N 3.07Å; Y518-R520 PolarHBondContact O-N 3.43Å; Y518-Q521 PolarHBondContact O-NE2 2.69Å; Y518-Q521 VanDerWaalsContact O-NE2 3.09Å
519	R	97	Very high	97.5	Very high	249 Å²	249	47.5 Å²	47.5	94%	0.94	24%	0.243	S	C	*	.	S	Bend	trans	-59.4	-12.9	174.6	-152.8	-168.7	92.9	168	8.1	114.2
520	R	97.7	Very high	97.5	Very high	51 Å²	51	47.5 Å²	47.5	19%	0.192	24%	0.243	C	C	.	.			trans	-104	112	178.6	-70.4	177.9	173.8	78.8	6.1	107.7	W514 G515 Y518 S525	W514-R520 CarbonylContact C-O 3.36Å; W514-R520 WeakPolarHBondContact CA-O 3.35Å; W514-R520 HydrophobicContact CB-CB 3.85Å; W514-R520 VanDerWaalsContact CB-O 3.29Å; W514-R520 WeakPolarHBondContact CB-O 3.3Å; G515-R520 PolarHBondContact N-O 3.04Å; Y518-R520 PolarHBondContact O-N 3.43Å; R520-S525 WeakPolarHBondContact CD-O 3.17Å; R520-S525 PolarHBondContact NE-O 2.8Å
521	Q	97.2	Very high	97.5	Very high	123 Å²	123	48.4 Å²	48.4	58%	0.575	25%	0.247	S	C	*	.			trans	-81	-37	177.7	-61.2	-53.4	-33.3	0	0	112.1	Y518	Y518-Q521 PolarHBondContact O-NE2 2.69Å; Y518-Q521 VanDerWaalsContact O-NE2 3.09Å
522	T	97.6	Very high	97.5	Very high	61 Å²	61	47.3 Å²	47.3	37%	0.374	24%	0.24	S	C	.	.	S	Bend	trans	-99.3	153.1	177.9	68.8	0	0	0	0	112.7	T524 S525	T522-T524 VanDerWaalsContact C-N 3.28Å; T522-T524 WeakPolarHBondContact CB-OG1 3.3Å; T522-T524 PolarHBondContact O-N 3.16Å; T522-T524 PolarHBondContact OG1-OG1 2.9Å; T522-S525 WeakPolarHBondContact O-CB 3.34Å; T522-S525 PolarHBondContact O-N 2.74Å; T522-S525 PolarHBondContact OG1-N 3.4Å; T522-S525 PolarHBondContact OG1-OG 3.41Å
523	I	98.2	Very high	97.5	Very high	13 Å²	13	45.5 Å²	45.5	7%	0.067	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-67.4	-30.8	170.9	-164	171.5	0	0	0	112.2	R507 W514 S525 T526 W529	R507-I523 HydrophobicContact CB-CD1 3.63Å; R507-I523 HydrophobicContact CG-CD1 4.24Å; W514-I523 HydrophobicContact CD2-CB 4.04Å; W514-I523 HydrophobicContact CD2-CD1 4.47Å; W514-I523 HydrophobicContact CD2-CG1 4Å; W514-I523 HydrophobicContact CE3-CD1 4.47Å; W514-I523 HydrophobicContact CE3-CG1 4.18Å; W514-I523 HydrophobicContact CG-CB 4.26Å; W514-I523 HydrophobicContact CH2-CD1 3.65Å; W514-I523 HydrophobicContact CH2-CG1 4.22Å; W514-I523 HydrophobicContact CZ2-CB 4.15Å; W514-I523 HydrophobicContact CZ2-CD1 3.61Å; W514-I523 HydrophobicContact CZ2-CG1 4.02Å; W514-I523 HydrophobicContact CZ3-CD1 4.1Å; W514-I523 HydrophobicContact CZ3-CG1 4.3Å; I523-S525 PolarHBondContact O-N 3.14Å; I523-T526 HydrophobicContact CG1-CG2 4.42Å; I523-T526 PolarHBondContact O-N 2.96Å; I523-T526 PolarHBondContact O-OG1 3.18Å; I523-W529 HydrophobicContact CD1-CB 3.94Å; I523-W529 HydrophobicContact CD1-CD2 3.64Å; I523-W529 HydrophobicContact CD1-CE3 3.45Å; I523-W529 VanDerWaalsContact CD1-CE3 3.45Å; I523-W529 HydrophobicContact CD1-CG 3.89Å; I523-W529 HydrophobicContact CD1-CZ3 4.14Å; I523-W529 HydrophobicContact CG1-CB 4.05Å; I523-W529 HydrophobicContact CG1-CD2 3.69Å; I523-W529 HydrophobicContact CG1-CE3 4.01Å; I523-W529 HydrophobicContact CG1-CG 3.73Å; I523-W529 HydrophobicContact CG2-CD2 4.4Å; I523-W529 HydrophobicContact CG2-CE3 4.41Å; I523-W529 HydrophobicContact CG2-CH2 4.14Å; I523-W529 HydrophobicContact CG2-CZ2 4.12Å; I523-W529 HydrophobicContact CG2-CZ3 4.27Å; I523-W529 PolarHBondContact O-NE1 3.39Å
524	T	98.1	Very high	97.5	Very high	58 Å²	58	45.4 Å²	45.4	36%	0.356	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-61.3	-13.2	173.8	49.3	0	0	0	0	113.6	L373 N374 T522 W529	L373-T524 CarbonylContact C-O 3.18Å; L373-T524 VanDerWaalsContact CA-O 3.26Å; L373-T524 WeakPolarHBondContact CA-O 3.41Å; N374-T524 HydrophobicContact CB-CG2 4.2Å; T522-T524 VanDerWaalsContact C-N 3.28Å; T522-T524 WeakPolarHBondContact CB-OG1 3.3Å; T522-T524 PolarHBondContact O-N 3.16Å; T522-T524 PolarHBondContact OG1-OG1 2.9Å; T524-W529 HydrophobicContact CG2-CZ2 4.23Å
525	S	97.8	Very high	97.3	Very high	48 Å²	48	46.7 Å²	46.7	34%	0.336	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-85.5	-8.7	170.9	-57.5	0	0	0	0	113.9	R520 T522 I523	R520-S525 WeakPolarHBondContact CD-O 3.17Å; R520-S525 PolarHBondContact NE-O 2.8Å; T522-S525 WeakPolarHBondContact O-CB 3.34Å; T522-S525 PolarHBondContact O-N 2.74Å; T522-S525 PolarHBondContact OG1-N 3.4Å; T522-S525 PolarHBondContact OG1-OG 3.41Å; I523-S525 PolarHBondContact O-N 3.14Å
526	T	98.3	Very high	97.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.233	C	C	.	.	S	Bend	trans	-87.3	145.6	179.5	84	0	0	0	0	111.3	L373 S509 W514 I523 C528	L373-T526 WeakPolarHBondContact CA-O 3.29Å; L373-T526 PolarHBondContact N-O 3.38Å; S509-T526 WeakPolarHBondContact OG-CB 3.33Å; S509-T526 WeakPolarHBondContact OG-CG2 3.48Å; S509-T526 PolarHBondContact OG-OG1 3.36Å; W514-T526 HydrophobicContact CB-CG2 3.82Å; W514-T526 HydrophobicContact CD2-CG2 4.37Å; W514-T526 HydrophobicContact CE3-CG2 4.11Å; W514-T526 HydrophobicContact CG-CG2 4.29Å; I523-T526 HydrophobicContact CG1-CG2 4.42Å; I523-T526 PolarHBondContact O-N 2.96Å; I523-T526 PolarHBondContact O-OG1 3.18Å; T526-C528 PolarHBondContact O-N 2.79Å
527	P	98.4	Very high	97.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	-75.4	-26.1	-170.2	-15.8	32.2	0	0	0	113.4	E372 Q416 V417 T420 K512	E372-P527 WeakPolarHBondContact CA-O 3.39Å; Q416-P527 HydrophobicContact CG-CB 4.42Å; Q416-P527 HydrophobicContact CG-CG 3.94Å; V417-P527 HydrophobicContact CB-CB 4.3Å; V417-P527 WeakPolarHBondContact CG1-O 3.46Å; V417-P527 HydrophobicContact CG2-CB 3.78Å; V417-P527 WeakPolarHBondContact CG2-O 3.06Å; T420-P527 HydrophobicContact CG2-CB 4.06Å; T420-P527 HydrophobicContact CG2-CG 4.33Å; T420-P527 WeakPolarHBondContact OG1-CB 3.37Å; T420-P527 WeakPolarHBondContact OG1-CG 3.25Å; K512-P527 HydrophobicContact CG-CG 4.16Å
528	C	98.6	Very high	97.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	-146.6	117.9	-179.2	-61.7	0	0	0	0	109.7	Y370 T420 R421 I424 S509 F510 T526	Y370-C528 HydrophobicContact CE2-CB 4.19Å; Y370-C528 PolarHBondContact OH-SG 3.02Å; Y370-C528 VanDerWaalsContact OH-SG 3.4Å; T420-C528 HydrophobicContact CG2-CB 4.04Å; R421-C528 VanDerWaalsContact CG-SG 3.55Å; I424-C528 HydrophobicContact CD1-CB 4.23Å; S509-C528 PolarHBondContact OG-O 3.12Å; F510-C528 HydrophobicContact CB-CB 4.43Å; F510-C528 HydrophobicContact CD2-CB 4.34Å; F510-C528 PolarHBondContact N-O 3.21Å; T526-C528 PolarHBondContact O-N 2.79Å
529	W	98.8	Very high	97	Very high	10 Å²	10	40.6 Å²	40.6	4%	0.038	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	164.6	175	61	-81.5	0	0	0	111.9	Y370 Y371 L373 R507 V508 I523 T524 E531	Y370-W529 VanDerWaalsContact CD2-O 3.22Å; Y370-W529 WeakPolarHBondContact CD2-O 3.41Å; Y371-W529 HydrophobicContact CD1-CH2 4.05Å; Y371-W529 AromaticContact CD1-CZ2 3.83Å; Y371-W529 HydrophobicContact CD1-CZ2 3.83Å; Y371-W529 HydrophobicContact CD2-CD2 4.11Å; Y371-W529 AromaticContact CD2-CE3 3.82Å; Y371-W529 HydrophobicContact CD2-CE3 3.82Å; Y371-W529 AromaticContact CD2-CH2 3.59Å; Y371-W529 HydrophobicContact CD2-CH2 3.59Å; Y371-W529 AromaticContact CD2-CZ2 3.88Å; Y371-W529 HydrophobicContact CD2-CZ2 3.88Å; Y371-W529 AromaticContact CD2-CZ3 3.57Å; Y371-W529 HydrophobicContact CD2-CZ3 3.57Å; Y371-W529 HydrophobicContact CE1-CH2 4.28Å; Y371-W529 HydrophobicContact CE1-CZ2 4.44Å; Y371-W529 HydrophobicContact CE2-CE3 4.5Å; Y371-W529 AromaticContact CE2-CH2 3.82Å; Y371-W529 HydrophobicContact CE2-CH2 3.82Å; Y371-W529 HydrophobicContact CE2-CZ2 4.47Å; Y371-W529 AromaticContact CE2-CZ3 3.85Å; Y371-W529 HydrophobicContact CE2-CZ3 3.85Å; Y371-W529 HydrophobicContact CG-CD2 4.15Å; Y371-W529 AromaticContact CG-CE2 3.75Å; Y371-W529 HydrophobicContact CG-CE3 4.3Å; Y371-W529 AromaticContact CG-CH2 3.72Å; Y371-W529 HydrophobicContact CG-CH2 3.72Å; Y371-W529 AromaticContact CG-CZ2 3.52Å; Y371-W529 HydrophobicContact CG-CZ2 3.52Å; Y371-W529 HydrophobicContact CG-CZ3 4.12Å; Y371-W529 PolarHBondContact N-O 3.5Å; Y371-W529 PolarHBondContact O-N 3.46Å; L373-W529 PolarHBondContact O-NE1 3.32Å; R507-W529 HydrophobicContact CG-CZ3 4.45Å; V508-W529 CarbonylContact O-C 3.56Å; V508-W529 WeakPolarHBondContact O-CA 3.24Å; V508-W529 VanDerWaalsContact O-CB 3.31Å; V508-W529 WeakPolarHBondContact O-CB 3.48Å; I523-W529 HydrophobicContact CD1-CB 3.94Å; I523-W529 HydrophobicContact CD1-CD2 3.64Å; I523-W529 HydrophobicContact CD1-CE3 3.45Å; I523-W529 VanDerWaalsContact CD1-CE3 3.45Å; I523-W529 HydrophobicContact CD1-CG 3.89Å; I523-W529 HydrophobicContact CD1-CZ3 4.14Å; I523-W529 HydrophobicContact CG1-CB 4.05Å; I523-W529 HydrophobicContact CG1-CD2 3.69Å; I523-W529 HydrophobicContact CG1-CE3 4.01Å; I523-W529 HydrophobicContact CG1-CG 3.73Å; I523-W529 HydrophobicContact CG2-CD2 4.4Å; I523-W529 HydrophobicContact CG2-CE3 4.41Å; I523-W529 HydrophobicContact CG2-CH2 4.14Å; I523-W529 HydrophobicContact CG2-CZ2 4.12Å; I523-W529 HydrophobicContact CG2-CZ3 4.27Å; I523-W529 PolarHBondContact O-NE1 3.39Å; T524-W529 HydrophobicContact CG2-CZ2 4.23Å; W529-E531 HydrophobicContact CZ3-CB 4.09Å
530	I	98.8	Very high	96.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	151.2	172.6	53.4	169.7	0	0	0	110.8	V368 F369 Y370 I390 I428 R507 V508 F510 V532	V368-I530 HydrophobicContact CG1-CB 3.98Å; V368-I530 HydrophobicContact CG1-CD1 4.15Å; V368-I530 HydrophobicContact CG1-CG2 4.03Å; F369-I530 CarbonylContact O-C 3.6Å; F369-I530 WeakPolarHBondContact O-CA 3.46Å; F369-I530 WeakPolarHBondContact O-CB 3.17Å; Y370-I530 HydrophobicContact CD2-CG2 3.93Å; I390-I530 HydrophobicContact CD1-CD1 3.57Å; I428-I530 HydrophobicContact CD1-CD1 3.86Å; R507-I530 WeakPolarHBondContact CA-O 3.42Å; V508-I530 HydrophobicContact CB-CD1 4.23Å; V508-I530 HydrophobicContact CB-CG1 3.84Å; V508-I530 HydrophobicContact CG2-CG1 4.49Å; V508-I530 PolarHBondContact N-O 2.92Å; V508-I530 PolarHBondContact O-N 2.8Å; F510-I530 HydrophobicContact CE2-CG1 4.26Å; F510-I530 HydrophobicContact CE2-CG2 4.12Å; F510-I530 HydrophobicContact CZ-CD1 4.37Å; I530-V532 HydrophobicContact CD1-CG2 3.96Å; I530-V532 HydrophobicContact CG1-CG2 4.49Å
531	E	98.6	Very high	96.4	Very high	20 Å²	20	27.4 Å²	27.4	9%	0.093	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132.8	162.3	-161.4	162.6	133.5	0	0	108.9	V368 F369 Y371 R507 W529 H533	V368-E531 WeakPolarHBondContact CA-O 3.33Å; F369-E531 PolarHBondContact N-O 3.15Å; F369-E531 PolarHBondContact O-N 3.1Å; Y371-E531 HydrophobicContact CE2-CB 4.06Å; R507-E531 HydrophobicContact CG-CB 4.5Å; R507-E531 HydrophobicContact CG-CG 3.95Å; R507-E531 IonicContact CZ-OE2 3.45Å; R507-E531 IonicContact NE-OE2 2.85Å; R507-E531 PolarHBondContact NE-OE2 3.16Å; R507-E531 IonicContact NH2-OE1 3.96Å; R507-E531 IonicContact NH2-OE2 3.12Å; R507-E531 PolarHBondContact NH2-OE2 3.18Å; R507-E531 VanDerWaalsContact NH2-OE2 3.12Å; W529-E531 HydrophobicContact CZ3-CB 4.09Å; E531-H533 IonicContact OE1-CD2 3.76Å; E531-H533 IonicContact OE1-CE1 2.77Å; E531-H533 IonicContact OE1-NE2 2.64Å; E531-H533 PolarHBondContact OE1-NE2 2.75Å
532	V	98.4	Very high	96.2	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.018	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	119.3	-179.5	-177.9	0	0	0	0	107.8	C366 S367 V368 L430 I506 I530 L534	C366-V532 HydrophobicContact CB-CG1 3.9Å; S367-V532 WeakPolarHBondContact O-CA 3.47Å; V368-V532 HydrophobicContact CG1-CG2 4.23Å; V368-V532 HydrophobicContact CG2-CG1 4.35Å; V368-V532 HydrophobicContact CG2-CG2 4.19Å; L430-V532 HydrophobicContact CD1-CG1 4.3Å; L430-V532 HydrophobicContact CD1-CG2 4.1Å; I506-V532 HydrophobicContact CB-CB 4.4Å; I506-V532 PolarHBondContact N-O 3.05Å; I506-V532 PolarHBondContact O-N 2.84Å; I530-V532 HydrophobicContact CD1-CG2 3.96Å; I530-V532 HydrophobicContact CG1-CG2 4.49Å; V532-L534 HydrophobicContact CG1-CD2 4.28Å
533	H	97.7	Very high	95.7	Very high	46 Å²	46	26 Å²	26	21%	0.213	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	127.2	175.8	-70.3	179.4	0	0	0	109.7	C366 S367 F369 S505 E531 L538	C366-H533 CarbonylContact C-O 3.58Å; C366-H533 WeakPolarHBondContact CA-O 3.49Å; C366-H533 WeakPolarHBondContact CB-O 3.4Å; S367-H533 PolarHBondContact N-O 2.85Å; S367-H533 PolarHBondContact O-N 2.85Å; F369-H533 HydrophobicContact CE2-CB 4.4Å; F369-H533 AromaticContact CE2-CE1 3.82Å; F369-H533 AromaticContact CE2-CG 3.86Å; F369-H533 AromaticContact CE2-ND1 3.45Å; F369-H533 WeakPolarHBondContact CE2-ND1 3.42Å; S505-H533 PolarHBondContact OG-CD2 2.79Å; E531-H533 IonicContact OE1-CD2 3.76Å; E531-H533 IonicContact OE1-CE1 2.77Å; E531-H533 IonicContact OE1-NE2 2.64Å; E531-H533 PolarHBondContact OE1-NE2 2.75Å; H533-L538 HydrophobicContact CB-CD1 3.96Å
534	L	96.8	Very high	95.3	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.016	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	105.1	-179.8	-59.8	-176.1	0	0	0	110.6	W365 C366 V437 F477 C504 I506 V532 G536 P537 L538	W365-L534 HydrophobicContact CE3-CD2 4.25Å; W365-L534 HydrophobicContact CZ3-CD2 3.93Å; C366-L534 HydrophobicContact CB-CD2 3.96Å; V437-L534 HydrophobicContact CG2-CD1 4.21Å; V437-L534 HydrophobicContact CG2-CD2 4.13Å; F477-L534 HydrophobicContact CB-CD1 3.7Å; F477-L534 HydrophobicContact CD1-CD1 3.54Å; F477-L534 HydrophobicContact CD2-CD1 3.51Å; F477-L534 HydrophobicContact CE1-CD1 3.98Å; F477-L534 HydrophobicContact CE2-CD1 3.95Å; F477-L534 HydrophobicContact CG-CD1 3.29Å; F477-L534 HydrophobicContact CZ-CD1 4.17Å; C504-L534 PolarHBondContact O-N 2.85Å; I506-L534 HydrophobicContact CD1-CD1 3.82Å; I506-L534 HydrophobicContact CD1-CD2 4.39Å; I506-L534 HydrophobicContact CD1-CG 4.13Å; V532-L534 HydrophobicContact CG1-CD2 4.28Å; L534-G536 PolarHBondContact O-N 3.26Å; L534-P537 HydrophobicContact CB-CB 4.38Å; L534-P537 HydrophobicContact CB-CG 3.89Å; L534-P537 WeakPolarHBondContact O-CD 3.27Å; L534-L538 WeakPolarHBondContact O-CG 3.48Å; L534-L538 PolarHBondContact O-N 3.3Å; L534-L538 VanDerWaalsContact O-N 3.08Å
535	N	95.1	Very high	95	Very high	34 Å²	34	24.2 Å²	24.2	18%	0.182	12%	0.119	C	C	.	.	H	α-helix	trans	-71.8	-30.8	-166.3	-64	-26.8	0	0	0	113.1	V362 Y364 W365 C366 S367 K539	V362-N535 HydrophobicContact CG1-CB 3.74Å; Y364-N535 WeakPolarHBondContact O-CB 3.39Å; Y364-N535 PolarHBondContact O-ND2 3.27Å; W365-N535 PolarHBondContact O-N 3.26Å; C366-N535 VanDerWaalsContact C-ND2 3.31Å; S367-N535 PolarHBondContact N-ND2 2.99Å; S367-N535 PolarHBondContact OG-ND2 3.41Å; S367-N535 PolarHBondContact OG-OD1 2.71Å; N535-K539 WeakPolarHBondContact O-CB 3.31Å; N535-K539 PolarHBondContact O-N 2.69Å
536	G	92.5	Very high	94.6	Very high	2 Å²	2	30.7 Å²	30.7	2%	0.021	14%	0.136	C	C	.	.	H	α-helix	trans	-62.8	-59.7	173.4	0	0	0	0	0	112.6	L534 L538 K539 W540	L534-G536 PolarHBondContact O-N 3.26Å; G536-L538 VanDerWaalsContact C-N 3.29Å; G536-L538 PolarHBondContact O-N 2.86Å; G536-K539 WeakPolarHBondContact O-CB 3.28Å; G536-K539 PolarHBondContact O-N 2.68Å; G536-W540 PolarHBondContact O-N 2.89Å
537	P	93.7	Very high	94	Very high	4 Å²	4	34.2 Å²	34.2	3%	0.026	15%	0.153	C	C	.	.	H	α-helix	trans	-51.9	-41.1	172.1	-31.8	37.8	0	0	0	114.3	F477 F482 C504 L534 W540 L541	F477-P537 HydrophobicContact CD1-CG 4.47Å; F477-P537 HydrophobicContact CE1-CB 4.28Å; F477-P537 HydrophobicContact CE1-CG 3.44Å; F477-P537 VanDerWaalsContact CE1-CG 3.44Å; F477-P537 HydrophobicContact CZ-CB 3.82Å; F477-P537 HydrophobicContact CZ-CG 3.5Å; F477-P537 VanDerWaalsContact CZ-CG 3.5Å; F482-P537 HydrophobicContact CD1-CB 3.97Å; F482-P537 HydrophobicContact CE1-CB 3.73Å; F482-P537 HydrophobicContact CZ-CB 4.2Å; C504-P537 HydrophobicContact CB-CB 4.34Å; L534-P537 HydrophobicContact CB-CB 4.38Å; L534-P537 HydrophobicContact CB-CG 3.89Å; L534-P537 WeakPolarHBondContact O-CD 3.27Å; P537-W540 PolarHBondContact O-N 2.96Å; P537-L541 WeakPolarHBondContact O-CB 3.41Å; P537-L541 PolarHBondContact O-N 3.29Å
538	L	94.8	Very high	93.4	Very high	44 Å²	44	36.1 Å²	36.1	23%	0.23	16%	0.162	C	C	.	.	H	α-helix	trans	-64.5	-39.5	175.2	-73.3	170.9	0	0	0	112.8	T501 C504 H533 L534 G536 L541 D542	T501-L538 HydrophobicContact CG2-CD2 4.23Å; C504-L538 HydrophobicContact CB-CD2 3.63Å; C504-L538 HydrophobicContact CB-CG 3.71Å; H533-L538 HydrophobicContact CB-CD1 3.96Å; L534-L538 WeakPolarHBondContact O-CG 3.48Å; L534-L538 PolarHBondContact O-N 3.3Å; L534-L538 VanDerWaalsContact O-N 3.08Å; G536-L538 VanDerWaalsContact C-N 3.29Å; G536-L538 PolarHBondContact O-N 2.86Å; L538-L541 PolarHBondContact O-N 2.69Å; L538-D542 WeakPolarHBondContact O-CB 3.49Å; L538-D542 PolarHBondContact O-N 2.72Å
539	K	92.5	Very high	92.6	Very high	84 Å²	84	38.8 Å²	38.8	37%	0.365	19%	0.189	S	C	.	.	H	α-helix	trans	-65.3	-36.8	175.1	-178.8	178.3	174.6	-173.5	0	112.2	D361 V362 N535 G536 R543	D361-K539 VanDerWaalsContact CG-NZ 3.32Å; D361-K539 IonicContact OD2-NZ 3.69Å; D361-K539 PolarHBondContact OD2-NZ 3.28Å; V362-K539 HydrophobicContact CG2-CD 3.93Å; N535-K539 WeakPolarHBondContact O-CB 3.31Å; N535-K539 PolarHBondContact O-N 2.69Å; G536-K539 WeakPolarHBondContact O-CB 3.28Å; G536-K539 PolarHBondContact O-N 2.68Å; K539-R543 PolarHBondContact O-N 3.31Å; K539-R543 VanDerWaalsContact O-N 3.16Å
540	W	89.7	Confident	92	Very high	20 Å²	20	42.8 Å²	42.8	8%	0.076	22%	0.219	C	C	.	.	H	α-helix	trans	-65	-42.4	172.7	-64.5	-7.1	0	0	0	111.5	A253 A257 L357 F359 F482 A483 L486 G536 P537 R543 V544	A253-W540 HydrophobicContact CB-CD2 4.31Å; A253-W540 HydrophobicContact CB-CE3 4.2Å; A253-W540 HydrophobicContact CB-CZ3 4.41Å; A257-W540 HydrophobicContact CB-CH2 4.12Å; L357-W540 HydrophobicContact CD2-CG 4.46Å; F359-W540 HydrophobicContact CD2-CZ2 4.46Å; F359-W540 AromaticContact CE2-CH2 3.98Å; F359-W540 HydrophobicContact CE2-CH2 3.98Å; F359-W540 AromaticContact CE2-CZ2 3.66Å; F359-W540 HydrophobicContact CE2-CZ2 3.66Å; F359-W540 HydrophobicContact CZ-CH2 4.14Å; F359-W540 HydrophobicContact CZ-CZ2 4.02Å; F482-W540 HydrophobicContact CD1-CE3 4.13Å; F482-W540 HydrophobicContact CE1-CE3 4.39Å; A483-W540 HydrophobicContact CB-CZ3 4.02Å; L486-W540 HydrophobicContact CD2-CB 4.17Å; G536-W540 PolarHBondContact O-N 2.89Å; P537-W540 PolarHBondContact O-N 2.96Å; W540-R543 PolarHBondContact O-N 2.79Å; W540-V544 PolarHBondContact O-N 3.43Å
541	L	92.9	Very high	91.5	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-65.6	-45.3	179.6	-169.8	66.2	0	0	0	112.6	L486 V497 L500 T501 P537 L538 R543 V544 L545	L486-L541 HydrophobicContact CD1-CD1 3.73Å; V497-L541 HydrophobicContact CG1-CD1 3.42Å; V497-L541 VanDerWaalsContact CG1-CD1 3.42Å; L500-L541 HydrophobicContact CB-CD1 3.97Å; T501-L541 WeakPolarHBondContact OG1-CD2 3.5Å; P537-L541 WeakPolarHBondContact O-CB 3.41Å; P537-L541 PolarHBondContact O-N 3.29Å; L538-L541 PolarHBondContact O-N 2.69Å; L541-R543 PolarHBondContact O-N 2.68Å; L541-V544 PolarHBondContact O-N 2.84Å; L541-L545 HydrophobicContact CG-CD1 3.98Å; L541-L545 WeakPolarHBondContact O-CG 3Å; L541-L545 PolarHBondContact O-N 2.7Å
542	D	92.2	Very high	90.8	Very high	68 Å²	68	50 Å²	50	36%	0.364	27%	0.265	S	S	.	.	H	α-helix	trans	-57.7	-44.9	173.8	171.3	46.9	0	0	0	111.7	L538 V544 L545 R546	L538-D542 WeakPolarHBondContact O-CB 3.49Å; L538-D542 PolarHBondContact O-N 2.72Å; D542-V544 VanDerWaalsContact C-N 3.29Å; D542-V544 PolarHBondContact O-N 3.46Å; D542-L545 PolarHBondContact O-N 2.78Å; D542-R546 VanDerWaalsContact CG-NE 3.28Å; D542-R546 VanDerWaalsContact O-CG 3.28Å; D542-R546 WeakPolarHBondContact O-CG 3.32Å; D542-R546 PolarHBondContact O-N 2.85Å; D542-R546 IonicContact OD1-CZ 3.48Å; D542-R546 IonicContact OD1-NE 2.79Å; D542-R546 PolarHBondContact OD1-NE 3.2Å; D542-R546 IonicContact OD1-NH2 3.3Å; D542-R546 PolarHBondContact OD1-NH2 2.88Å; D542-R546 IonicContact OD2-CZ 3.28Å; D542-R546 VanDerWaalsContact OD2-CZ 3.28Å; D542-R546 IonicContact OD2-NE 3.16Å; D542-R546 PolarHBondContact OD2-NE 2.89Å; D542-R546 VanDerWaalsContact OD2-NE 3.16Å; D542-R546 IonicContact OD2-NH2 2.7Å; D542-R546 PolarHBondContact OD2-NH2 2.78Å
543	R	88.6	Confident	90.3	Very high	86 Å²	86	56.6 Å²	56.6	33%	0.325	30%	0.3	S	S	.	.	H	α-helix	trans	-57.1	-42.4	176.5	-169.2	179.1	-158.3	138.9	20.3	112.3	L357 K539 W540 L541	L357-R543 VanDerWaalsContact CD1-NH1 3.32Å; K539-R543 PolarHBondContact O-N 3.31Å; K539-R543 VanDerWaalsContact O-N 3.16Å; W540-R543 PolarHBondContact O-N 2.79Å; L541-R543 PolarHBondContact O-N 2.68Å
544	V	89.8	Confident	89.7	Confident	7 Å²	7	60.1 Å²	60.1	4%	0.042	33%	0.327	C	S	.	.	H	α-helix	trans	-69.2	-49.6	177.4	162.4	0	0	0	0	111.5	L486 M490 V497 W540 L541 D542 R546 Q547 M548	L486-V544 HydrophobicContact CD1-CB 4.27Å; L486-V544 HydrophobicContact CD1-CG1 4.09Å; L486-V544 HydrophobicContact CD1-CG2 4.17Å; L486-V544 HydrophobicContact CD2-CG2 3.96Å; L486-V544 HydrophobicContact CG-CG2 4.12Å; M490-V544 HydrophobicContact CE-CB 4.23Å; M490-V544 HydrophobicContact CE-CG1 3.73Å; M490-V544 HydrophobicContact CE-CG2 4.11Å; M490-V544 HydrophobicContact CG-CG1 3.82Å; M490-V544 HydrophobicContact SD-CB 4.12Å; M490-V544 HydrophobicContact SD-CG1 3.47Å; M490-V544 WeakPolarHBondContact SD-CG1 3.07Å; M490-V544 HydrophobicContact SD-CG2 3.65Å; V497-V544 HydrophobicContact CG1-CG1 3.79Å; V497-V544 HydrophobicContact CG2-CG1 4.5Å; W540-V544 PolarHBondContact O-N 3.43Å; L541-V544 PolarHBondContact O-N 2.84Å; D542-V544 VanDerWaalsContact C-N 3.29Å; D542-V544 PolarHBondContact O-N 3.46Å; V544-R546 VanDerWaalsContact C-N 3.26Å; V544-R546 PolarHBondContact O-N 2.73Å; V544-Q547 WeakPolarHBondContact O-CB 3.39Å; V544-Q547 PolarHBondContact O-N 3.17Å; V544-M548 HydrophobicContact CG1-CE 4.26Å; V544-M548 HydrophobicContact CG1-CG 4.45Å; V544-M548 HydrophobicContact CG1-SD 4.28Å; V544-M548 PolarHBondContact O-N 3.08Å
545	L	91	Very high	89.3	Confident	26 Å²	26	65.8 Å²	65.8	14%	0.136	37%	0.366	C	S	.	.	H	α-helix	trans	-60.2	-35.4	-177	-73.7	169.2	0	0	0	112.3	Y494 V497 F498 L541 D542 Q547 M548	Y494-L545 HydrophobicContact CD2-CD2 4.31Å; Y494-L545 HydrophobicContact CE2-CD2 3.91Å; V497-L545 HydrophobicContact CB-CD2 4.28Å; V497-L545 HydrophobicContact CG1-CD2 4Å; V497-L545 HydrophobicContact CG1-CG 4.28Å; F498-L545 HydrophobicContact CB-CD2 4.22Å; F498-L545 HydrophobicContact CD2-CD1 4.22Å; F498-L545 HydrophobicContact CD2-CD2 4.49Å; L541-L545 HydrophobicContact CG-CD1 3.98Å; L541-L545 WeakPolarHBondContact O-CG 3Å; L541-L545 PolarHBondContact O-N 2.7Å; D542-L545 PolarHBondContact O-N 2.78Å; L545-Q547 PolarHBondContact O-N 3.22Å; L545-M548 HydrophobicContact CD2-CE 4.02Å; L545-M548 PolarHBondContact O-N 2.89Å
546	R	88.9	Confident	89.2	Confident	185 Å²	185	68 Å²	68	70%	0.698	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-22.9	173.5	-71.1	173.8	-167.5	-143	12	114.4	D542 V544	D542-R546 VanDerWaalsContact CG-NE 3.28Å; D542-R546 VanDerWaalsContact O-CG 3.28Å; D542-R546 WeakPolarHBondContact O-CG 3.32Å; D542-R546 PolarHBondContact O-N 2.85Å; D542-R546 IonicContact OD1-CZ 3.48Å; D542-R546 IonicContact OD1-NE 2.79Å; D542-R546 PolarHBondContact OD1-NE 3.2Å; D542-R546 IonicContact OD1-NH2 3.3Å; D542-R546 PolarHBondContact OD1-NH2 2.88Å; D542-R546 IonicContact OD2-CZ 3.28Å; D542-R546 VanDerWaalsContact OD2-CZ 3.28Å; D542-R546 IonicContact OD2-NE 3.16Å; D542-R546 PolarHBondContact OD2-NE 2.89Å; D542-R546 VanDerWaalsContact OD2-NE 3.16Å; D542-R546 IonicContact OD2-NH2 2.7Å; D542-R546 PolarHBondContact OD2-NH2 2.78Å; V544-R546 VanDerWaalsContact C-N 3.26Å; V544-R546 PolarHBondContact O-N 2.73Å
547	Q	87.4	Confident	89.2	Confident	74 Å²	74	73.8 Å²	73.8	35%	0.346	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-17.2	-179.4	-67.4	-179.5	-32.5	0	0	113.5	M490 V544 L545	M490-Q547 HydrophobicContact CE-CB 4.32Å; V544-Q547 WeakPolarHBondContact O-CB 3.39Å; V544-Q547 PolarHBondContact O-N 3.17Å; L545-Q547 PolarHBondContact O-N 3.22Å
548	M	84.1	Confident	89	Confident	39 Å²	39	79.9 Å²	79.9	19%	0.192	46%	0.457	C	S	.	.	S	Bend	trans	-94.8	1.9	-172.3	-62.8	-156.2	-56	0	0	115.1	M490 Y494 V497 V544 L545	M490-M548 HydrophobicContact CE-CG 4.24Å; M490-M548 HydrophobicContact CG-CG 4.43Å; M490-M548 HydrophobicContact CG-SD 3.72Å; Y494-M548 HydrophobicContact CD2-CB 4.36Å; V497-M548 HydrophobicContact CB-CE 3.42Å; V497-M548 VanDerWaalsContact CB-CE 3.42Å; V497-M548 HydrophobicContact CG1-CE 3.97Å; V497-M548 HydrophobicContact CG2-CE 3.42Å; V497-M548 VanDerWaalsContact CG2-CE 3.42Å; V497-M548 HydrophobicContact CG2-SD 4.02Å; V544-M548 HydrophobicContact CG1-CE 4.26Å; V544-M548 HydrophobicContact CG1-CG 4.45Å; V544-M548 HydrophobicContact CG1-SD 4.28Å; V544-M548 PolarHBondContact O-N 3.08Å; L545-M548 HydrophobicContact CD2-CE 4.02Å; L545-M548 PolarHBondContact O-N 2.89Å
549	G	83.5	Confident	88.2	Confident	56 Å²	56	84.6 Å²	84.6	58%	0.577	49%	0.494	S	S	*	.			trans	76	-142.7	-178.7	0	0	0	0	0	113.3	Y494	Y494-G549 WeakPolarHBondContact CD2-O 3.49Å; Y494-G549 VanDerWaalsContact CE2-O 3.26Å; Y494-G549 WeakPolarHBondContact CE2-O 3.18Å
550	S	85.4	Confident	88	Confident	94 Å²	94	84.6 Å²	84.6	66%	0.657	50%	0.5	S	S	*	.	S	Bend	trans	-104.7	163.9	-177.7	63.7	0	0	0	0	112.5
551	P	87.1	Confident	87.9	Confident	60 Å²	60	88 Å²	88	39%	0.39	52%	0.523	S	S	.	.			trans	-49.1	152.6	163.8	-26.6	33.7	0	0	0	113.2	Y494	Y494-P551 HydrophobicContact CD1-CB 4.34Å; Y494-P551 HydrophobicContact CD1-CG 3.72Å; Y494-P551 HydrophobicContact CE1-CG 3.69Å; Y494-P551 HydrophobicContact CG-CG 4.44Å
552	T	85	Confident	87.6	Confident	111 Å²	111	92.7 Å²	92.7	68%	0.681	55%	0.551	S	S	*	*	S	Bend	trans	-72.4	-28.3	-178.5	52.4	0	0	0	0	113.6	E495	E495-T552 PolarHBondContact OE1-N 3.38Å; E495-T552 PolarHBondContact OE1-OG1 3.37Å
553	L	87.5	Confident	87.3	Confident	142 Å²	142	94.2 Å²	94.2	74%	0.743	56%	0.562	S	S	*	*	S	Bend	trans	-98.3	121.3	178.1	-66.3	173	0	0	0	110.5
554	P	86.2	Confident	87.3	Confident	121 Å²	121	94.7 Å²	94.7	79%	0.786	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-70.8	134.7	175	29.2	-33.7	0	0	0	110.8
555	C	88.6	Confident	87.1	Confident	122 Å²	122	100.5 Å²	100.5	82%	0.824	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-77.9	144.2	173.1	-166.9	0	0	0	0	110.8
556	T	91.3	Very high	86.8	Confident	79 Å²	79	105.9 Å²	105.9	49%	0.485	65%	0.646	S	S	.	*	P	Polyproline II helix	trans	-83.3	150.4	174.8	97.5	0	0	0	0	110.8	V558 S559	T556-V558 VanDerWaalsContact C-N 3.31Å; T556-V558 PolarHBondContact OG1-N 3.12Å; T556-S559 VanDerWaalsContact OG1-CB 3.24Å; T556-S559 WeakPolarHBondContact OG1-CB 3.5Å; T556-S559 PolarHBondContact OG1-N 2.99Å; T556-S559 VanDerWaalsContact OG1-N 3.16Å; T556-S559 PolarHBondContact OG1-OG 3.21Å
557	S	92.7	Very high	86.7	Confident	125 Å²	125	99.8 Å²	99.8	87%	0.874	64%	0.642	S	S	*	*	S	Bend	trans	-86.7	4.7	175.1	51.6	0	0	0	0	114.3
558	V	90.4	Very high	86.6	Confident	132 Å²	132	101.9 Å²	101.9	80%	0.8	67%	0.667	S	S	*	*			trans	-135.4	8.4	-166.7	-63	0	0	0	0	114.6	T556	T556-V558 VanDerWaalsContact C-N 3.31Å; T556-V558 PolarHBondContact OG1-N 3.12Å
559	S	77.4	Confident	86.8	Confident	142 Å²	142	107.6 Å²	107.6	99%	0.993	71%	0.71	S	S	*	*			trans	-95.2	0	177.7	57.1	0	0	0	0	113.2	T556	T556-S559 VanDerWaalsContact OG1-CB 3.24Å; T556-S559 WeakPolarHBondContact OG1-CB 3.5Å; T556-S559 PolarHBondContact OG1-N 2.99Å; T556-S559 VanDerWaalsContact OG1-N 3.16Å; T556-S559 PolarHBondContact OG1-OG 3.21Å

Retrieved 559 of 559 residues in 480.4 ms (Link to these results)

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