A0A096MKC1_RAT Loading...

Tyrosine-protein kinase

AlphaFold DB , UniProt , Accession A0A096MKC1, Species RAT (Rattus norvegicus, Rat), Gene Fyn, Length 534 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.7	Very low	29.9	Very low	252 Å²	252	158.5 Å²	158.5	100%	1.241	88%	0.875	S	S	*	*				0	132.3	0	-74.7	-179	-145.7	0	0	107.8
2	G	28.7	Very low	29.8	Very low	74 Å²	74	153.9 Å²	153.9	76%	0.763	87%	0.873	S	S	*	*			trans	-81.9	155.6	-157.6	0	0	0	0	0	117.2
3	C	26.5	Very low	29.7	Very low	115 Å²	115	157.4 Å²	157.4	78%	0.777	87%	0.873	S	S	*	*				45.5	123.3	127.8	-148.3	0	0	0	0	119
4	V	32.3	Very low	29.7	Very low	144 Å²	144	158.8 Å²	158.8	87%	0.873	88%	0.877	S	S	*	*				-147.8	134.7	124.4	-176.2	0	0	0	0	111.7
5	Q	30.4	Very low	29.6	Very low	170 Å²	170	156.8 Å²	156.8	79%	0.794	87%	0.871	S	S	*	*			trans	-53.2	157.2	178.7	-73.4	159.4	-32.1	0	0	119.8
6	C	28	Very low	29.6	Very low	119 Å²	119	159.4 Å²	159.4	80%	0.804	88%	0.875	S	S	*	*			trans	-50.4	149.9	156.6	-53.4	0	0	0	0	114.4
7	K	30.1	Very low	29.6	Very low	212 Å²	212	159.8 Å²	159.8	92%	0.922	87%	0.869	S	S	*	*			trans	-138.8	116.2	153.4	-96.7	-175.2	176	175.9	0	110.2
8	D	28.9	Very low	29.6	Very low	156 Å²	156	162.1 Å²	162.1	83%	0.834	86%	0.863	S	S	*	*			trans	-63.1	148.4	160.7	-65.8	-54	0	0	0	111.3
9	K	32.4	Very low	29.5	Very low	212 Å²	212	161.2 Å²	161.2	92%	0.922	86%	0.858	S	S	*	*			trans	-144.9	115.1	151.1	-94.6	-169.2	176.3	-176.9	0	110
10	E	27.7	Very low	29.4	Very low	194 Å²	194	156.4 Å²	156.4	91%	0.907	85%	0.849	S	S	*	*			trans	-73.9	160.4	167.5	-92.6	-175.1	129.7	0	0	113.4
11	A	30.1	Very low	29.3	Very low	96 Å²	96	154.1 Å²	154.1	79%	0.793	84%	0.844	S	S	*	*			trans	-22.2	144.5	171.5	0	0	0	0	0	120.7
12	A	28.9	Very low	29.1	Very low	103 Å²	103	149.8 Å²	149.8	85%	0.851	83%	0.826	S	S	*	*			trans	-132.5	118.6	143.6	0	0	0	0	0	109.3
13	K	28.9	Very low	29	Very low	199 Å²	199	153 Å²	153	87%	0.865	83%	0.825	S	S	*	*			trans	-72.8	133.7	164.7	-83.3	176.2	172.1	177.4	0	108.9
14	L	28.6	Very low	29.1	Very low	177 Å²	177	155.2 Å²	155.2	93%	0.927	82%	0.824	S	S	*	*			trans	-135.2	117.4	151.1	-83.3	169.3	0	0	0	108.6
15	T	28.7	Very low	28.7	Very low	129 Å²	129	153.1 Å²	153.1	79%	0.791	82%	0.816	S	S	*	*			trans	-80.7	135.2	165.9	38.5	0	0	0	0	109.4
16	E	29	Very low	28.7	Very low	199 Å²	199	151 Å²	151	93%	0.93	82%	0.82	S	S	*	*			trans	-152	126.8	147.4	-117	176.7	-171.4	0	0	109.6
17	E	29.5	Very low	28.5	Very low	166 Å²	166	148.1 Å²	148.1	78%	0.776	81%	0.81	S	S	*	*			trans	-90	163.1	172.9	-63.4	-166.1	145.7	0	0	111.2
18	R	30.6	Very low	28.4	Very low	200 Å²	200	147.7 Å²	147.7	76%	0.755	80%	0.804	S	S	*	*			trans	99.6	119.9	141.9	-84.4	179.1	-168.8	-142.2	-1.1	121.6
19	D	27.6	Very low	28.4	Very low	146 Å²	146	150.7 Å²	150.7	78%	0.781	80%	0.804	S	S	*	*				79.4	138.2	127.3	-73.8	-22.8	0	0	0	122.6
20	G	27.5	Very low	28.1	Very low	65 Å²	65	152.1 Å²	152.1	67%	0.67	81%	0.805	S	S	*	*			trans	126.6	74.2	160.2	0	0	0	0	0	114
21	S	27.9	Very low	28.1	Very low	108 Å²	108	145.8 Å²	145.8	76%	0.755	79%	0.792	S	S	*	*				72.3	114.4	89.7	-52	0	0	0	0	116.6
22	L	27.7	Very low	28	Very low	162 Å²	162	147.9 Å²	147.9	85%	0.848	80%	0.795	S	S	*	*			trans	60.2	119.6	135.5	-61.8	164.4	0	0	0	120.2
23	N	26.8	Very low	28	Very low	141 Å²	141	150.6 Å²	150.6	75%	0.754	80%	0.796	S	S	*	*				-160.6	127.4	118	-111.4	-16.7	0	0	0	114.8
24	Q	28.6	Very low	28.1	Very low	161 Å²	161	147 Å²	147	75%	0.752	79%	0.792	S	S	*	*			trans	38.4	112.9	135.9	-70.8	175.8	12	0	0	119.8
25	S	25	Very low	28.4	Very low	100 Å²	100	145.1 Å²	145.1	70%	0.699	79%	0.789	S	S	*	*				79.9	117.8	71.8	78.1	0	0	0	0	115.1
26	S	29.8	Very low	28.5	Very low	126 Å²	126	144.5 Å²	144.5	88%	0.881	79%	0.787	S	S	*	*			trans	169.7	118.8	145.9	-69.3	0	0	0	0	106.4
27	G	24.6	Very low	28.4	Very low	58 Å²	58	144 Å²	144	60%	0.598	79%	0.785	S	S	*	*			cis	113.2	122.7	24	0	0	0	0	0	109.6
28	Y	27.9	Very low	28.2	Very low	203 Å²	203	145 Å²	145	80%	0.796	79%	0.789	S	S	*	*			trans	84.4	142.9	165.9	-49.7	-68.7	0	0	0	118
29	R	27.8	Very low	28.1	Very low	220 Å²	220	145.5 Å²	145.5	83%	0.83	79%	0.792	S	S	*	*			cis	-169.5	159.5	-12.6	-119.8	168.6	-168.9	178.5	6.1	107.7
30	Y	27.6	Very low	28	Very low	241 Å²	241	143.7 Å²	143.7	95%	0.945	79%	0.788	S	S	*	*			trans	-49.8	155.1	173.4	-91.9	-101	0	0	0	117.4
31	G	27	Very low	27.8	Very low	62 Å²	62	146.1 Å²	146.1	64%	0.639	80%	0.795	S	S	*	*			trans	175.2	90.1	155.7	0	0	0	0	0	112.1
32	T	28.9	Very low	27.8	Very low	140 Å²	140	150.1 Å²	150.1	86%	0.859	80%	0.799	S	S	*	*				79.6	108.8	107.9	50.7	0	0	0	0	116.6
33	D	27.8	Very low	27.6	Very low	160 Å²	160	145.8 Å²	145.8	86%	0.856	79%	0.793	S	S	*	*			trans	-56.8	155.3	157.9	-80.4	-42.5	0	0	0	112.9
34	P	32.2	Very low	27.5	Very low	123 Å²	123	145.5 Å²	145.5	80%	0.799	80%	0.797	S	S	*	*			trans	-118.6	142	139.1	28.5	-13.8	0	0	0	112.7
35	T	33	Very low	27.4	Very low	138 Å²	138	143.9 Å²	143.9	85%	0.847	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-64.4	172	-175.4	18.8	0	0	0	0	116
36	P	31.2	Very low	27.4	Very low	116 Å²	116	144.8 Å²	144.8	75%	0.753	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-97	157.1	-145.8	38.7	-37	0	0	0	114.8
37	Q	26.9	Very low	27.2	Very low	189 Å²	189	146.1 Å²	146.1	88%	0.883	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-95.6	128.8	168.8	-77.7	-174.7	-17.9	0	0	112
38	H	25	Very low	27.2	Very low	186 Å²	186	147.8 Å²	147.8	86%	0.861	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-56.1	134.8	174.2	-95.4	-63.7	0	0	0	113.9
39	Y	28.3	Very low	27	Very low	211 Å²	211	144.8 Å²	144.8	83%	0.827	80%	0.798	S	S	*	*			trans	-122.7	148.3	151.2	-86.2	-85.8	0	0	0	109.5
40	P	26.7	Very low	27	Very low	107 Å²	107	144.3 Å²	144.3	70%	0.695	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-78.1	142.1	-167.8	30.4	-32.3	0	0	0	112.9
41	S	23.4	Very low	26.8	Very low	117 Å²	117	139.6 Å²	139.6	82%	0.818	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-71.2	122.6	176	-177.1	0	0	0	0	111
42	F	26.6	Very low	26.6	Very low	191 Å²	191	143.1 Å²	143.1	84%	0.838	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-96.9	123.9	158.1	-82.6	-83.8	0	0	0	108.2	V44	F42-V44 PolarHBondContact O-N 3.1Å
43	G	24.3	Very low	26.5	Very low	71 Å²	71	146.9 Å²	146.9	73%	0.732	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-63.5	127.9	-174.6	0	0	0	0	0	112.8	T45	G43-T45 PolarHBondContact O-N 3.11Å
44	V	25	Very low	26.3	Very low	136 Å²	136	147.7 Å²	147.7	82%	0.824	80%	0.796	S	S	*	*			trans	-84.4	108.1	167.7	179.1	0	0	0	0	107.5	F42	F42-V44 PolarHBondContact O-N 3.1Å
45	T	25.5	Very low	25.8	Very low	127 Å²	127	146.7 Å²	146.7	78%	0.779	80%	0.798	S	S	*	*			trans	-71.6	133.3	165.9	45	0	0	0	0	109.9	G43	G43-T45 PolarHBondContact O-N 3.11Å
46	S	25.9	Very low	25.4	Very low	118 Å²	118	145 Å²	145	83%	0.825	80%	0.798	S	S	*	*			trans	-40.7	127.2	179.4	-22.9	0	0	0	0	114.7
47	I	25.7	Very low	25	Very low	155 Å²	155	143.3 Å²	143.3	80%	0.795	80%	0.802	S	S	*	*			trans	-84.8	123.8	169.1	-59.2	173.8	0	0	0	108.3
48	P	24.8	Very low	25.1	Very low	93 Å²	93	138.3 Å²	138.3	60%	0.604	80%	0.801	S	S	*	*			trans	-71.7	131.2	174.8	-14	28.5	0	0	0	112	Y50	P48-Y50 HydrophobicContact CB-CD2 4.32Å; P48-Y50 HydrophobicContact CB-CE2 3.93Å
49	N	24.6	Very low	25.2	Very low	139 Å²	139	138.6 Å²	138.6	74%	0.743	80%	0.802	S	S	*	*			trans	-78.2	115.4	175.8	-170.8	0.6	0	0	0	110.1
50	Y	26.8	Very low	25	Very low	211 Å²	211	132 Å²	132	83%	0.827	80%	0.799	S	S	*	*			trans	-111.2	58.6	176.4	-80	-81.8	0	0	0	111.4	P48	P48-Y50 HydrophobicContact CB-CD2 4.32Å; P48-Y50 HydrophobicContact CB-CE2 3.93Å
51	N	23.6	Very low	24.9	Very low	141 Å²	141	135.4 Å²	135.4	75%	0.754	81%	0.81	S	S	*	*			trans	-98.9	86.5	161.9	-89	-12.8	0	0	0	109.4
52	N	23	Very low	25.2	Very low	136 Å²	136	135.6 Å²	135.6	73%	0.727	81%	0.807	S	S	*	*			trans	-174.6	108.8	152.6	-112.9	-11.4	0	0	0	110.7
53	F	25.6	Very low	25.7	Very low	219 Å²	219	132.2 Å²	132.2	96%	0.961	80%	0.801	S	S	*	*			trans	-151.5	126.8	138.2	-100.4	-73.3	0	0	0	110.6
54	H	23.5	Very low	26.3	Very low	177 Å²	177	133.7 Å²	133.7	82%	0.819	79%	0.788	S	S	*	*			trans	-62.5	147.7	173.4	-85.2	-89.9	0	0	0	112.4
55	A	23.5	Very low	26.5	Very low	103 Å²	103	130.7 Å²	130.7	85%	0.851	78%	0.784	S	S	*	*			trans	-62.8	139	174.2	0	0	0	0	0	113.5
56	A	23.1	Very low	26.5	Very low	102 Å²	102	128.4 Å²	128.4	84%	0.843	79%	0.786	S	S	*	*			trans	-155.1	123.7	151.8	0	0	0	0	0	110.9
57	G	24.3	Very low	26.8	Very low	80 Å²	80	129 Å²	129	83%	0.825	78%	0.784	S	S	*	*			trans	79.4	100.7	149.4	0	0	0	0	0	118
58	G	28.5	Very low	26.8	Very low	84 Å²	84	129.1 Å²	129.1	87%	0.866	79%	0.786	S	S	*	*			trans	-71.1	135.2	170.6	0	0	0	0	0	113.4
59	Q	25.8	Very low	27	Very low	192 Å²	192	130.3 Å²	130.3	90%	0.897	80%	0.797	S	S	*	*			trans	-134.5	131.9	157.9	-74.6	-168.6	-22.6	0	0	108.1
60	G	26.1	Very low	27.2	Very low	73 Å²	73	128.6 Å²	128.6	75%	0.753	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-62	142.4	-175.8	0	0	0	0	0	112.7	T62	G60-T62 PolarHBondContact O-N 3.48Å
61	L	23.7	Very low	27.2	Very low	179 Å²	179	124.4 Å²	124.4	94%	0.937	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-65.1	120.3	172	-83.5	94.8	0	0	0	110.1
62	T	30.3	Very low	27.6	Very low	120 Å²	120	126.5 Å²	126.5	74%	0.736	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-92	143.3	162	50.1	0	0	0	0	109.9	G60 F64	G60-T62 PolarHBondContact O-N 3.48Å; T62-F64 PolarHBondContact O-N 3.16Å
63	V	35.5	Very low	28	Very low	120 Å²	120	127.1 Å²	127.1	73%	0.727	81%	0.811	S	S	*	*	S	Bend	trans	-68	-16.3	-173	167.5	0	0	0	0	113.7
64	F	37.8	Very low	28.2	Very low	103 Å²	103	120.4 Å²	120.4	45%	0.452	80%	0.804	S	S	.	*	S	Bend	trans	-115.3	119	176.3	-73.7	-87.1	0	0	0	110.8	T62 W120	T62-F64 PolarHBondContact O-N 3.16Å; F64-W120 HydrophobicContact CE2-CH2 4.27Å
65	G	28.7	Very low	28.7	Very low	72 Å²	72	117.4 Å²	117.4	74%	0.742	80%	0.798	S	S	*	*			trans	-58.8	136.5	169.6	0	0	0	0	0	110.5	V67	G65-V67 PolarHBondContact O-N 2.99Å
66	G	25.6	Very low	29.1	Very low	79 Å²	79	121 Å²	121	81%	0.814	80%	0.802	S	S	*	*			trans	-47	130.5	-169.7	0	0	0	0	0	115.1	N68	G66-N68 PolarHBondContact O-N 2.74Å
67	V	32.1	Very low	29.3	Very low	130 Å²	130	127.3 Å²	127.3	79%	0.788	80%	0.804	S	S	*	*			trans	-81.2	112.6	173.2	-177.7	0	0	0	0	108.4	G65 S69	G65-V67 PolarHBondContact O-N 2.99Å; V67-S69 PolarHBondContact O-N 3.5Å
68	N	25.6	Very low	29.6	Very low	158 Å²	158	129.8 Å²	129.8	85%	0.845	80%	0.803	S	S	*	*			trans	-74.7	108.1	163.3	-99.1	-2	0	0	0	108.3	G66 S70	G66-N68 PolarHBondContact O-N 2.74Å; N68-S70 PolarHBondContact O-N 3.41Å
69	S	29.7	Very low	29.8	Very low	118 Å²	118	138.2 Å²	138.2	83%	0.825	81%	0.809	S	S	*	*			trans	-79.8	90.4	175.4	34.7	0	0	0	0	110.6	V67	V67-S69 PolarHBondContact O-N 3.5Å
70	S	28	Very low	30.2	Very low	103 Å²	103	132.9 Å²	132.9	72%	0.72	81%	0.806	S	S	*	*			trans	-153.9	83.4	162.8	67.3	0	0	0	0	112.8	N68	N68-S70 PolarHBondContact O-N 3.41Å
71	S	27.9	Very low	30.6	Very low	123 Å²	123	132.7 Å²	132.7	86%	0.86	80%	0.804	S	S	*	*			trans	-174.2	123.5	142.3	47.1	0	0	0	0	109.7
72	H	32.4	Very low	31.4	Very low	186 Å²	186	130.6 Å²	130.6	86%	0.861	80%	0.799	S	S	*	*			trans	-58.4	134.9	173.9	-81.2	-71.8	0	0	0	112.3
73	T	30.7	Very low	32.6	Very low	148 Å²	148	128 Å²	128	91%	0.908	80%	0.796	S	S	*	*				178.3	136.4	113.7	35.7	0	0	0	0	111
74	G	29.5	Very low	34.4	Very low	79 Å²	79	126.2 Å²	126.2	81%	0.814	79%	0.785	S	S	*	*			trans	117.5	19.4	154	0	0	0	0	0	120.6	L76	G74-L76 PolarHBondContact O-N 2.75Å
75	T	33.4	Very low	36.5	Very low	114 Å²	114	125.5 Å²	125.5	70%	0.699	79%	0.789	S	S	*	*			trans	-77.1	119	178.4	-9.1	0	0	0	0	112.1	R77	T75-R77 PolarHBondContact O-N 3.16Å; T75-R77 VanDerWaalsContact O-N 3.08Å
76	L	32.2	Very low	39.6	Very low	179 Å²	179	125.2 Å²	125.2	94%	0.937	77%	0.77	S	S	*	*			trans	-64.1	106	162.9	-104.9	143.2	0	0	0	108.5	G74 T78	G74-L76 PolarHBondContact O-N 2.75Å; L76-T78 PolarHBondContact O-N 2.8Å
77	R	28.7	Very low	42.9	Very low	234 Å²	234	122.7 Å²	122.7	88%	0.883	74%	0.737	S	S	*	*			trans	-82.9	106.8	-179.2	-73.2	-177.7	170.3	-171	-3.1	110.4	T75	T75-R77 PolarHBondContact O-N 3.16Å; T75-R77 VanDerWaalsContact O-N 3.08Å
78	T	30.2	Very low	45.9	Very low	131 Å²	131	117.5 Å²	117.5	80%	0.804	71%	0.705	S	S	*	*			trans	-86	147.6	150.6	39.8	0	0	0	0	109.6	L76 G80	L76-T78 PolarHBondContact O-N 2.8Å; T78-G80 PolarHBondContact O-N 3.21Å
79	R	32.4	Very low	49.2	Very low	261 Å²	261	110.1 Å²	110.1	99%	0.985	67%	0.666	S	S	*	*	S	Bend	trans	-69.9	100.7	-165.3	-148.9	178	-172	-176.3	1.2	110.4
80	G	34.8	Very low	52.1	Low	81 Å²	81	106.3 Å²	106.3	84%	0.835	64%	0.636	S	S	*	*	S	Bend	trans	90.9	94.8	168.8	0	0	0	0	0	114.5	T78	T78-G80 PolarHBondContact O-N 3.21Å
81	G	32.7	Very low	55.2	Low	68 Å²	68	103.8 Å²	103.8	70%	0.701	61%	0.611	S	S	*	*	S	Bend	trans	163.8	134	171.8	0	0	0	0	0	111	G83	G81-G83 PolarHBondContact O-N 3.16Å
82	T	42.3	Very low	58.3	Low	136 Å²	136	102.5 Å²	102.5	83%	0.834	60%	0.595	S	S	*	*			trans	-43.1	128.7	165.5	42.2	0	0	0	0	110	V84	T82-V84 PolarHBondContact O-N 2.84Å; T82-V84 VanDerWaalsContact O-N 3.11Å
83	G	54.2	Low	61.2	Low	65 Å²	65	94.2 Å²	94.2	67%	0.67	56%	0.556	S	S	*	*			trans	-53.1	120.7	-178.6	0	0	0	0	0	110.4	G81 T85	G81-G83 PolarHBondContact O-N 3.16Å; G83-T85 PolarHBondContact O-N 3.02Å
84	V	73.4	Confident	64.2	Low	82 Å²	82	93.8 Å²	93.8	50%	0.497	54%	0.544	S	S	.	.			trans	-80.2	115.4	176.7	179.4	0	0	0	0	107.1	T82 L86 Q110	T82-V84 PolarHBondContact O-N 2.84Å; T82-V84 VanDerWaalsContact O-N 3.11Å; V84-L86 HydrophobicContact CG1-CD2 4.38Å; V84-L86 PolarHBondContact O-N 2.74Å; V84-Q110 HydrophobicContact CG1-CG 3.76Å
85	T	82.4	Confident	67.2	Low	89 Å²	89	91.1 Å²	91.1	55%	0.546	51%	0.514	S	S	.	.			trans	-64.2	119.8	172.5	-54.7	0	0	0	0	109	G83 F87 P140	G83-T85 PolarHBondContact O-N 3.02Å; T85-F87 HydrophobicContact CG2-CD2 4.33Å; T85-F87 HydrophobicContact CG2-CE2 3.78Å; T85-F87 HydrophobicContact CG2-CZ 4.4Å; T85-P140 HydrophobicContact CG2-CB 4.07Å
86	L	93.6	Very high	69.9	Low	65 Å²	65	87.6 Å²	87.6	34%	0.34	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	148.1	175	-62	-176.8	0	0	0	110.4	V84 L125 P140 V141	V84-L86 HydrophobicContact CG1-CD2 4.38Å; V84-L86 PolarHBondContact O-N 2.74Å; L86-L125 HydrophobicContact CD1-CD1 4.07Å; L86-L125 HydrophobicContact CD2-CD1 3.87Å; L86-P140 WeakPolarHBondContact O-CA 3.37Å; L86-V141 HydrophobicContact CB-CG2 3.81Å; L86-V141 WeakPolarHBondContact O-CG2 3.05Å; L86-V141 PolarHBondContact O-N 3.21Å
87	F	95.1	Very high	72.7	Confident	27 Å²	27	80.9 Å²	80.9	12%	0.118	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	155.2	177.4	-75.9	-107.9	0	0	0	110.6	T85 K108 F109 I111 W120 V138 A139 P140	T85-F87 HydrophobicContact CG2-CD2 4.33Å; T85-F87 HydrophobicContact CG2-CE2 3.78Å; T85-F87 HydrophobicContact CG2-CZ 4.4Å; F87-K108 CarbonylContact O-C 3.56Å; F87-K108 WeakPolarHBondContact O-CA 3.43Å; F87-F109 HydrophobicContact CB-CB 4.5Å; F87-F109 PolarHBondContact N-O 2.79Å; F87-F109 PolarHBondContact O-N 2.86Å; F87-I111 HydrophobicContact CB-CD1 4.36Å; F87-I111 HydrophobicContact CB-CG1 4.37Å; F87-I111 HydrophobicContact CD1-CG1 4.45Å; F87-I111 HydrophobicContact CD2-CB 4.47Å; F87-I111 HydrophobicContact CD2-CD1 4.22Å; F87-I111 HydrophobicContact CD2-CG1 3.35Å; F87-I111 HydrophobicContact CE2-CB 4.47Å; F87-I111 HydrophobicContact CE2-CG1 3.61Å; F87-I111 HydrophobicContact CG-CD1 4.2Å; F87-I111 HydrophobicContact CG-CG1 3.82Å; F87-I111 HydrophobicContact CZ-CG1 4.27Å; F87-W120 HydrophobicContact CD1-CZ3 4.26Å; F87-W120 HydrophobicContact CE1-CH2 4.39Å; F87-W120 AromaticContact CE1-CZ3 3.7Å; F87-W120 HydrophobicContact CE1-CZ3 3.7Å; F87-W120 HydrophobicContact CZ-CZ3 4.18Å; F87-V138 HydrophobicContact CB-CB 4.26Å; F87-V138 HydrophobicContact CD1-CB 4.21Å; F87-V138 HydrophobicContact CD1-CG2 3.98Å; F87-A139 CarbonylContact C-O 3.57Å; F87-A139 WeakPolarHBondContact CA-O 3.46Å; F87-P140 HydrophobicContact CD1-CG 4.27Å; F87-P140 HydrophobicContact CE1-CB 4.44Å; F87-P140 HydrophobicContact CE1-CG 3.69Å; F87-P140 HydrophobicContact CZ-CG 3.93Å
88	V	95.2	Very high	75.6	Confident	20 Å²	20	79.2 Å²	79.2	12%	0.121	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	140.2	176.1	62.9	0	0	0	0	110.4	E107 V138 A139 V141 A146	V88-E107 CarbonylContact C-O 3.55Å; V88-E107 VanDerWaalsContact CA-O 3.29Å; V88-E107 WeakPolarHBondContact CA-O 3.33Å; V88-V138 VanDerWaalsContact O-CA 3.26Å; V88-V138 WeakPolarHBondContact O-CA 3.35Å; V88-A139 PolarHBondContact N-O 3.43Å; V88-A139 PolarHBondContact O-N 2.89Å; V88-V141 HydrophobicContact CB-CG2 4.12Å; V88-A146 HydrophobicContact CG1-CB 3.66Å
89	A	94.6	Very high	78.5	Confident	3 Å²	3	78.3 Å²	78.3	3%	0.025	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	125.6	172.2	0	0	0	0	0	111.3	F103 H104 G106 E107 F109	A89-F103 HydrophobicContact CB-CD2 3.52Å; A89-F103 HydrophobicContact CB-CE2 3.76Å; A89-H104 WeakPolarHBondContact CB-O 3.49Å; A89-G106 PolarHBondContact O-N 3.46Å; A89-E107 HydrophobicContact CB-CB 4.43Å; A89-E107 PolarHBondContact N-O 3.3Å; A89-F109 HydrophobicContact CB-CE2 3.8Å; A89-F109 HydrophobicContact CB-CZ 4.38Å
90	L	91.3	Very high	81.3	Confident	39 Å²	39	66.6 Å²	66.6	20%	0.204	40%	0.404	C	S	.	.	S	Bend	trans	-85	-24.9	174.9	-56.5	180	0	0	0	112.2	K105 Y137 A139 Q145	L90-K105 WeakPolarHBondContact O-CD 3.35Å; L90-K105 WeakPolarHBondContact O-CE 3.44Å; L90-K105 WeakPolarHBondContact O-CG 3.46Å; L90-Y137 WeakPolarHBondContact CB-O 3.4Å; L90-Y137 PolarHBondContact N-O 3.21Å; L90-A139 HydrophobicContact CD1-CB 4.14Å; L90-A139 HydrophobicContact CD2-CB 3.92Å; L90-A139 HydrophobicContact CG-CB 4.27Å; L90-Q145 WeakPolarHBondContact CD2-O 3.21Å
91	Y	91.9	Very high	84.2	Confident	49 Å²	49	63 Å²	63	19%	0.192	37%	0.365	C	S	.	.	S	Bend	trans	-140.8	162.3	-176.5	-46.6	-80.3	0	0	0	110.5	F103 Y137 T250 P251	Y91-F103 WeakPolarHBondContact O-CE2 3.31Å; Y91-Y137 HydrophobicContact CD2-CD1 4.12Å; Y91-Y137 HydrophobicContact CD2-CG 4.08Å; Y91-Y137 HydrophobicContact CG-CD1 4.4Å; Y91-T250 HydrophobicContact CD1-CG2 4.39Å; Y91-T250 HydrophobicContact CG-CG2 4.19Å; Y91-P251 HydrophobicContact CD2-CG 3.94Å; Y91-P251 HydrophobicContact CE2-CG 3.55Å; Y91-P251 VanDerWaalsContact CZ-CD 3.41Å
92	D	93.3	Very high	87.2	Confident	97 Å²	97	62.6 Å²	62.6	52%	0.519	35%	0.352	S	S	.	.			trans	-71.1	143.4	166.2	-60	-38.6	0	0	0	110.2	H104 K105 Y137	D92-H104 VanDerWaalsContact OD1-CA 3.29Å; D92-H104 WeakPolarHBondContact OD1-CA 3.39Å; D92-H104 IonicContact OD1-ND1 2.8Å; D92-K105 PolarHBondContact OD1-N 3.03Å; D92-Y137 WeakPolarHBondContact O-CE1 3.48Å
93	Y	94.3	Very high	89.7	Confident	11 Å²	11	56.3 Å²	56.3	4%	0.043	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-137.5	130.9	173.7	179.5	-102.2	0	0	0	110.3	D100 L101 S102 F103 W119 P134 Y137 T253	Y93-D100 HydrophobicContact CE1-CB 4.2Å; Y93-D100 PolarHBondContact OH-OD2 3.4Å; Y93-L101 VanDerWaalsContact CD1-O 3.29Å; Y93-L101 WeakPolarHBondContact CD1-O 3.16Å; Y93-S102 WeakPolarHBondContact O-CA 3.18Å; Y93-F103 VanDerWaalsContact CB-CE1 3.48Å; Y93-F103 VanDerWaalsContact CB-CE2 3.49Å; Y93-F103 HydrophobicContact CD1-CD1 4.09Å; Y93-F103 AromaticContact CD1-CE1 3.59Å; Y93-F103 HydrophobicContact CD1-CE1 3.59Å; Y93-F103 HydrophobicContact CD1-CZ 4.15Å; Y93-F103 HydrophobicContact CG-CD1 4.46Å; Y93-F103 AromaticContact CG-CE1 3.78Å; Y93-F103 HydrophobicContact CG-CE1 3.78Å; Y93-F103 AromaticContact CG-CZ 3.86Å; Y93-F103 HydrophobicContact CG-CZ 3.86Å; Y93-F103 PolarHBondContact N-O 3.4Å; Y93-F103 PolarHBondContact O-N 3.24Å; Y93-F103 VanDerWaalsContact O-O 3.13Å; Y93-W119 HydrophobicContact CE2-CH2 4.18Å; Y93-W119 HydrophobicContact CE2-CZ3 4.44Å; Y93-W119 AromaticContact CZ-CH2 3.91Å; Y93-W119 AromaticContact CZ-CZ3 3.87Å; Y93-W119 WeakPolarHBondContact OH-CH2 3.47Å; Y93-W119 WeakPolarHBondContact OH-CZ3 3.29Å; Y93-P134 HydrophobicContact CD2-CG 3.77Å; Y93-P134 HydrophobicContact CE2-CG 3.91Å; Y93-P134 HydrophobicContact CG-CG 4.18Å; Y93-Y137 HydrophobicContact CD2-CD1 4.36Å; Y93-Y137 HydrophobicContact CD2-CE1 4Å; Y93-T253 HydrophobicContact CE2-CG2 4.18Å
94	E	93.4	Very high	91.7	Very high	139 Å²	139	59.6 Å²	59.6	65%	0.65	31%	0.311	S	S	*	.			trans	-104.6	125.1	173.5	-170.5	176.9	-175.7	0	0	108.5	R96	E94-R96 PolarHBondContact O-N 3.19Å
95	A	92	Very high	92.7	Very high	23 Å²	23	60.6 Å²	60.6	19%	0.19	31%	0.308	C	S	.	.			trans	-53.5	135.8	177.3	0	0	0	0	0	111.2	D100 S102 N290	A95-D100 HydrophobicContact CB-CB 3.66Å; A95-S102 WeakPolarHBondContact CB-OG 3.27Å; A95-S102 PolarHBondContact N-OG 3.11Å; A95-N290 PolarHBondContact O-ND2 2.91Å; A95-N290 VanDerWaalsContact O-ND2 3.15Å
96	R	91.1	Very high	93.2	Very high	40 Å²	40	58.5 Å²	58.5	15%	0.151	30%	0.304	C	S	.	.	S	Bend	trans	-110.2	-12.3	-179.9	-54.9	171.5	-178.4	165.5	1.1	112.8	E94 D100 T253 L256 W287 N288 T291	E94-R96 PolarHBondContact O-N 3.19Å; R96-D100 PolarHBondContact N-OD2 3.45Å; R96-T253 PolarHBondContact NH1-OG1 3.44Å; R96-T253 PolarHBondContact NH2-OG1 3.19Å; R96-L256 WeakPolarHBondContact CD-O 2.89Å; R96-L256 PolarHBondContact NH1-O 3.42Å; R96-W287 HydrophobicContact CB-CE3 4.37Å; R96-W287 HydrophobicContact CB-CH2 4.17Å; R96-W287 HydrophobicContact CB-CZ3 3.52Å; R96-W287 HydrophobicContact CG-CZ3 4.33Å; R96-N288 PolarHBondContact O-ND2 3.5Å; R96-T291 VanDerWaalsContact CD-OG1 3.3Å; R96-T291 WeakPolarHBondContact CD-OG1 3.18Å
97	T	89.3	Confident	93.3	Very high	38 Å²	38	56.3 Å²	56.3	23%	0.233	29%	0.293	C	S	.	.	S	Bend	trans	-133.3	167.9	174.2	79.2	0	0	0	0	109.2	D99 D100 A257 W287	T97-D99 PolarHBondContact O-N 3.08Å; T97-D99 PolarHBondContact OG1-N 3.36Å; T97-D100 PolarHBondContact N-OD2 3.36Å; T97-D100 PolarHBondContact O-N 3.42Å; T97-D100 PolarHBondContact OG1-N 3.04Å; T97-D100 PolarHBondContact OG1-OD1 3.12Å; T97-A257 HydrophobicContact CG2-CB 3.54Å; T97-W287 HydrophobicContact CG2-CH2 3.68Å; T97-W287 HydrophobicContact CG2-CZ2 4.27Å
98	E	89.4	Confident	93.3	Very high	200 Å²	200	59.7 Å²	59.7	94%	0.935	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-20.4	174.7	-62.1	-177.8	176.8	0	0	112.6
99	D	91.3	Very high	93.3	Very high	112 Å²	112	58.7 Å²	58.7	60%	0.599	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-12.1	179.7	-61.4	-44.8	0	0	0	112.7	T97 G131 Y132	T97-D99 PolarHBondContact O-N 3.08Å; T97-D99 PolarHBondContact OG1-N 3.36Å; D99-G131 CarbonylContact O-C 3.55Å; D99-G131 VanDerWaalsContact O-CA 3.29Å; D99-G131 WeakPolarHBondContact O-CA 3.4Å; D99-Y132 HydrophobicContact CB-CD2 4.01Å; D99-Y132 HydrophobicContact CB-CE2 4.36Å; D99-Y132 PolarHBondContact O-N 2.84Å
100	D	92.5	Very high	93.4	Very high	14 Å²	14	61.5 Å²	61.5	8%	0.075	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-80.4	149.9	178.1	-69	6	0	0	0	110.9	Y93 A95 R96 T97 Y132	Y93-D100 HydrophobicContact CE1-CB 4.2Å; Y93-D100 PolarHBondContact OH-OD2 3.4Å; A95-D100 HydrophobicContact CB-CB 3.66Å; R96-D100 PolarHBondContact N-OD2 3.45Å; T97-D100 PolarHBondContact N-OD2 3.36Å; T97-D100 PolarHBondContact O-N 3.42Å; T97-D100 PolarHBondContact OG1-N 3.04Å; T97-D100 PolarHBondContact OG1-OD1 3.12Å; D100-Y132 WeakPolarHBondContact CA-O 3.3Å
101	L	94.8	Very high	93.5	Very high	5 Å²	5	61.1 Å²	61.1	3%	0.026	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-103.9	118.9	173.7	-178.3	64.5	0	0	0	110.3	Y93 F103 F109 E129 Y132 I133	Y93-L101 VanDerWaalsContact CD1-O 3.29Å; Y93-L101 WeakPolarHBondContact CD1-O 3.16Å; L101-F103 WeakPolarHBondContact O-CD1 3.47Å; L101-F109 HydrophobicContact CD2-CD1 4.15Å; L101-F109 HydrophobicContact CD2-CE1 3.92Å; L101-E129 HydrophobicContact CD1-CB 3.83Å; L101-Y132 PolarHBondContact N-O 3.17Å; L101-I133 HydrophobicContact CB-CG2 3.88Å; L101-I133 HydrophobicContact CD2-CG2 4.2Å; L101-I133 HydrophobicContact CG-CG2 4.44Å
102	S	95.8	Very high	93.5	Very high	61 Å²	61	62.7 Å²	62.7	43%	0.427	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-71.1	144.2	169.5	-68.5	0	0	0	0	110.9	Y93 A95	Y93-S102 WeakPolarHBondContact O-CA 3.18Å; A95-S102 WeakPolarHBondContact CB-OG 3.27Å; A95-S102 PolarHBondContact N-OG 3.11Å
103	F	95.9	Very high	93.3	Very high	3 Å²	3	61.2 Å²	61.2	1%	0.013	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-157	160.8	176.6	54	-95.8	0	0	0	113.9	A89 Y91 Y93 L101 E107 F109 I133 P134 Y137	A89-F103 HydrophobicContact CB-CD2 3.52Å; A89-F103 HydrophobicContact CB-CE2 3.76Å; Y91-F103 WeakPolarHBondContact O-CE2 3.31Å; Y93-F103 VanDerWaalsContact CB-CE1 3.48Å; Y93-F103 VanDerWaalsContact CB-CE2 3.49Å; Y93-F103 HydrophobicContact CD1-CD1 4.09Å; Y93-F103 AromaticContact CD1-CE1 3.59Å; Y93-F103 HydrophobicContact CD1-CE1 3.59Å; Y93-F103 HydrophobicContact CD1-CZ 4.15Å; Y93-F103 HydrophobicContact CG-CD1 4.46Å; Y93-F103 AromaticContact CG-CE1 3.78Å; Y93-F103 HydrophobicContact CG-CE1 3.78Å; Y93-F103 AromaticContact CG-CZ 3.86Å; Y93-F103 HydrophobicContact CG-CZ 3.86Å; Y93-F103 PolarHBondContact N-O 3.4Å; Y93-F103 PolarHBondContact O-N 3.24Å; Y93-F103 VanDerWaalsContact O-O 3.13Å; L101-F103 WeakPolarHBondContact O-CD1 3.47Å; F103-E107 WeakPolarHBondContact CA-OE2 3.44Å; F103-E107 HydrophobicContact CB-CB 4.46Å; F103-E107 VanDerWaalsContact CB-OE2 3.31Å; F103-E107 WeakPolarHBondContact CB-OE2 3.4Å; F103-F109 HydrophobicContact CB-CE1 4.05Å; F103-F109 HydrophobicContact CB-CZ 3.49Å; F103-F109 VanDerWaalsContact CB-CZ 3.49Å; F103-F109 HydrophobicContact CD1-CE1 4.24Å; F103-F109 AromaticContact CD1-CZ 3.89Å; F103-F109 HydrophobicContact CD1-CZ 3.89Å; F103-F109 HydrophobicContact CD2-CE2 4.47Å; F103-F109 HydrophobicContact CD2-CZ 4.02Å; F103-F109 HydrophobicContact CG-CE1 4.24Å; F103-F109 HydrophobicContact CG-CE2 4.4Å; F103-F109 AromaticContact CG-CZ 3.54Å; F103-F109 HydrophobicContact CG-CZ 3.54Å; F103-I133 HydrophobicContact CD1-CG2 3.83Å; F103-I133 HydrophobicContact CE1-CB 3.74Å; F103-I133 HydrophobicContact CE1-CG2 3.47Å; F103-I133 VanDerWaalsContact CE1-CG2 3.47Å; F103-I133 HydrophobicContact CZ-CB 4.4Å; F103-P134 HydrophobicContact CZ-CG 4.43Å; F103-Y137 HydrophobicContact CE2-CD1 4.23Å; F103-Y137 HydrophobicContact CZ-CD1 4.18Å; F103-Y137 HydrophobicContact CZ-CG 4.45Å
104	H	95.7	Very high	92.9	Very high	135 Å²	135	64.1 Å²	64.1	63%	0.625	34%	0.337	S	S	*	.			trans	-103.7	152.8	174.2	-65.8	-62.9	0	0	0	112.3	A89 D92 G106 E107	A89-H104 WeakPolarHBondContact CB-O 3.49Å; D92-H104 VanDerWaalsContact OD1-CA 3.29Å; D92-H104 WeakPolarHBondContact OD1-CA 3.39Å; D92-H104 IonicContact OD1-ND1 2.8Å; H104-G106 PolarHBondContact O-N 2.81Å; H104-E107 PolarHBondContact N-OE2 3.44Å; H104-E107 VanDerWaalsContact N-OE2 3.15Å; H104-E107 WeakPolarHBondContact O-CB 3.39Å; H104-E107 PolarHBondContact O-N 3.48Å
105	K	93.3	Very high	92.2	Very high	102 Å²	102	61.7 Å²	61.7	44%	0.443	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	133.2	173.3	-178.8	177.8	176.8	-164.7	0	110.5	L90 D92 E107 E148	L90-K105 WeakPolarHBondContact O-CD 3.35Å; L90-K105 WeakPolarHBondContact O-CE 3.44Å; L90-K105 WeakPolarHBondContact O-CG 3.46Å; D92-K105 PolarHBondContact OD1-N 3.03Å; K105-E107 VanDerWaalsContact C-N 3.33Å; K105-E148 WeakPolarHBondContact CE-OE1 3.32Å; K105-E148 IonicContact NZ-OE1 2.71Å; K105-E148 PolarHBondContact NZ-OE1 3.18Å; K105-E148 IonicContact NZ-OE2 3.69Å
106	G	92.6	Very high	90.9	Very high	45 Å²	45	66.6 Å²	66.6	46%	0.464	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.2	-8.7	-177.6	0	0	0	0	0	114.8	A89 H104	A89-G106 PolarHBondContact O-N 3.46Å; H104-G106 PolarHBondContact O-N 2.81Å
107	E	96	Very high	90	Very high	20 Å²	20	67.6 Å²	67.6	9%	0.093	38%	0.378	C	S	.	.			trans	-64.8	147.2	174.2	-171.3	164.6	177	0	0	111.7	V88 A89 F103 H104 K105 F109 S124	V88-E107 CarbonylContact C-O 3.55Å; V88-E107 VanDerWaalsContact CA-O 3.29Å; V88-E107 WeakPolarHBondContact CA-O 3.33Å; A89-E107 HydrophobicContact CB-CB 4.43Å; A89-E107 PolarHBondContact N-O 3.3Å; F103-E107 WeakPolarHBondContact CA-OE2 3.44Å; F103-E107 HydrophobicContact CB-CB 4.46Å; F103-E107 VanDerWaalsContact CB-OE2 3.31Å; F103-E107 WeakPolarHBondContact CB-OE2 3.4Å; H104-E107 PolarHBondContact N-OE2 3.44Å; H104-E107 VanDerWaalsContact N-OE2 3.15Å; H104-E107 WeakPolarHBondContact O-CB 3.39Å; H104-E107 PolarHBondContact O-N 3.48Å; K105-E107 VanDerWaalsContact C-N 3.33Å; E107-F109 HydrophobicContact CB-CE2 4.23Å; E107-F109 HydrophobicContact CB-CZ 4Å; E107-F109 HydrophobicContact CG-CE1 4.29Å; E107-F109 HydrophobicContact CG-CE2 4.36Å; E107-F109 HydrophobicContact CG-CZ 3.84Å; E107-F109 VanDerWaalsContact O-CE2 3.31Å; E107-F109 WeakPolarHBondContact O-CE2 3.18Å; E107-S124 WeakPolarHBondContact OE1-CB 3.49Å; E107-S124 PolarHBondContact OE1-OG 3.47Å
108	K	96.4	Very high	90	Very high	97 Å²	97	68.4 Å²	68.4	42%	0.422	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	143.2	-174.7	-64.6	-177	-178.3	-178.3	0	112.3	F87 L125 V141	F87-K108 CarbonylContact O-C 3.56Å; F87-K108 WeakPolarHBondContact O-CA 3.43Å; K108-L125 HydrophobicContact CB-CD1 4.08Å; K108-L125 WeakPolarHBondContact O-CB 3.31Å; K108-L125 PolarHBondContact O-N 2.68Å; K108-V141 HydrophobicContact CD-CG2 4.39Å; K108-V141 HydrophobicContact CG-CG2 4.5Å
109	F	95.6	Very high	90	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	149.1	-175.6	-52.6	-86	0	0	0	112.7	F87 A89 L101 F103 E107 I111 A122 R123 I133 V138	F87-F109 HydrophobicContact CB-CB 4.5Å; F87-F109 PolarHBondContact N-O 2.79Å; F87-F109 PolarHBondContact O-N 2.86Å; A89-F109 HydrophobicContact CB-CE2 3.8Å; A89-F109 HydrophobicContact CB-CZ 4.38Å; L101-F109 HydrophobicContact CD2-CD1 4.15Å; L101-F109 HydrophobicContact CD2-CE1 3.92Å; F103-F109 HydrophobicContact CB-CE1 4.05Å; F103-F109 HydrophobicContact CB-CZ 3.49Å; F103-F109 VanDerWaalsContact CB-CZ 3.49Å; F103-F109 HydrophobicContact CD1-CE1 4.24Å; F103-F109 AromaticContact CD1-CZ 3.89Å; F103-F109 HydrophobicContact CD1-CZ 3.89Å; F103-F109 HydrophobicContact CD2-CE2 4.47Å; F103-F109 HydrophobicContact CD2-CZ 4.02Å; F103-F109 HydrophobicContact CG-CE1 4.24Å; F103-F109 HydrophobicContact CG-CE2 4.4Å; F103-F109 AromaticContact CG-CZ 3.54Å; F103-F109 HydrophobicContact CG-CZ 3.54Å; E107-F109 HydrophobicContact CB-CE2 4.23Å; E107-F109 HydrophobicContact CB-CZ 4Å; E107-F109 HydrophobicContact CG-CE1 4.29Å; E107-F109 HydrophobicContact CG-CE2 4.36Å; E107-F109 HydrophobicContact CG-CZ 3.84Å; E107-F109 VanDerWaalsContact O-CE2 3.31Å; E107-F109 WeakPolarHBondContact O-CE2 3.18Å; F109-I111 HydrophobicContact CB-CD1 4.49Å; F109-A122 HydrophobicContact CB-CB 4.22Å; F109-A122 HydrophobicContact CD1-CB 4.24Å; F109-A122 HydrophobicContact CG-CB 4.46Å; F109-R123 VanDerWaalsContact CA-O 3.3Å; F109-R123 WeakPolarHBondContact CA-O 3.26Å; F109-I133 HydrophobicContact CG-CD1 4.33Å; F109-V138 HydrophobicContact CD2-CG1 4.05Å; F109-V138 HydrophobicContact CE2-CG1 4.14Å
110	Q	95.5	Very high	90.2	Very high	62 Å²	62	55.7 Å²	55.7	29%	0.29	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	121.9	155.7	176.3	175	20	0	0	108.4	V84 L112 A122 R123 L125	V84-Q110 HydrophobicContact CG1-CG 3.76Å; Q110-L112 HydrophobicContact CG-CD2 4.24Å; Q110-L112 PolarHBondContact O-N 2.82Å; Q110-A122 WeakPolarHBondContact O-CA 3.31Å; Q110-R123 PolarHBondContact N-O 3.45Å; Q110-R123 PolarHBondContact O-N 3.2Å; Q110-L125 HydrophobicContact CB-CD2 4.3Å
111	I	94.1	Very high	90.3	Very high	30 Å²	30	58.1 Å²	58.1	15%	0.154	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	119.5	173.4	-54.7	-57.3	0	0	0	108.5	F87 F109 W120 A122 I133	F87-I111 HydrophobicContact CB-CD1 4.36Å; F87-I111 HydrophobicContact CB-CG1 4.37Å; F87-I111 HydrophobicContact CD1-CG1 4.45Å; F87-I111 HydrophobicContact CD2-CB 4.47Å; F87-I111 HydrophobicContact CD2-CD1 4.22Å; F87-I111 HydrophobicContact CD2-CG1 3.35Å; F87-I111 HydrophobicContact CE2-CB 4.47Å; F87-I111 HydrophobicContact CE2-CG1 3.61Å; F87-I111 HydrophobicContact CG-CD1 4.2Å; F87-I111 HydrophobicContact CG-CG1 3.82Å; F87-I111 HydrophobicContact CZ-CG1 4.27Å; F109-I111 HydrophobicContact CB-CD1 4.49Å; I111-W120 HydrophobicContact CD1-CE3 4.08Å; I111-W120 HydrophobicContact CG1-CE3 4.34Å; I111-W120 HydrophobicContact CG2-CB 4.32Å; I111-W120 HydrophobicContact CG2-CE3 4.47Å; I111-A122 HydrophobicContact CD1-CB 3.9Å; I111-I133 HydrophobicContact CD1-CD1 3.96Å
112	L	91.8	Very high	90.3	Very high	82 Å²	82	57.9 Å²	57.9	43%	0.429	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-42.5	178.7	-58.7	-179.3	0	0	0	110.4	Q110 E121 R123 T130	Q110-L112 HydrophobicContact CG-CD2 4.24Å; Q110-L112 PolarHBondContact O-N 2.82Å; L112-E121 HydrophobicContact CB-CB 4.45Å; L112-E121 HydrophobicContact CB-CG 4.29Å; L112-E121 HydrophobicContact CD1-CG 4.35Å; L112-E121 PolarHBondContact N-O 3.25Å; L112-R123 HydrophobicContact CD1-CB 4.2Å; L112-R123 HydrophobicContact CD2-CB 4.36Å; L112-R123 HydrophobicContact CG-CB 4.29Å; L112-T130 HydrophobicContact CD1-CG2 3.85Å
113	N	88.4	Confident	90.3	Very high	66 Å²	66	60.5 Å²	60.5	35%	0.353	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	126.2	178.3	-166.7	-7.2	0	0	0	111.7	S115 W120 E121	N113-S115 WeakPolarHBondContact OD1-CB 3.25Å; N113-S115 PolarHBondContact OD1-N 3.46Å; N113-S115 PolarHBondContact OD1-OG 2.92Å; N113-W120 WeakPolarHBondContact O-CA 3.45Å; N113-W120 WeakPolarHBondContact O-CB 3.38Å; N113-E121 HydrophobicContact CB-CB 3.86Å; N113-E121 PolarHBondContact N-O 3.49Å; N113-E121 VanDerWaalsContact N-O 3.14Å; N113-E121 PolarHBondContact O-N 2.88Å
114	S	86	Confident	90.4	Very high	73 Å²	73	60.4 Å²	60.4	51%	0.51	33%	0.326	S	S	.	.			trans	-125.6	12.1	175.1	52.9	0	0	0	0	112.7	E116	S114-E116 VanDerWaalsContact C-N 3.25Å; S114-E116 PolarHBondContact O-N 3.48Å
115	S	79.3	Confident	90.3	Very high	88 Å²	88	58.1 Å²	58.1	62%	0.615	32%	0.317	S	S	*	.	S	Bend	trans	-69.6	-21.1	-172.7	63.8	0	0	0	0	113.7	N113	N113-S115 WeakPolarHBondContact OD1-CB 3.25Å; N113-S115 PolarHBondContact OD1-N 3.46Å; N113-S115 PolarHBondContact OD1-OG 2.92Å
116	E	64	Low	90.4	Very high	125 Å²	125	58.4 Å²	58.4	58%	0.584	33%	0.328	S	S	*	.	S	Bend	trans	-129.3	109.7	-171.9	-68	-176.7	178.1	0	0	112.6	S114	S114-E116 VanDerWaalsContact C-N 3.25Å; S114-E116 PolarHBondContact O-N 3.48Å
117	G	73.4	Confident	90.5	Very high	62 Å²	62	59.9 Å²	59.9	64%	0.639	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	-150.8	156.1	0	0	0	0	0	116.5	W120	G117-W120 PolarHBondContact O-NE1 3.34Å
118	D	87.4	Confident	90.4	Very high	55 Å²	55	60.5 Å²	60.5	29%	0.294	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-4.2	-170.7	-61.1	-63.7	0	0	0	113.6	S135 S254 K319	D118-S135 WeakPolarHBondContact CA-OG 3.33Å; D118-S135 WeakPolarHBondContact O-CB 3.38Å; D118-S135 PolarHBondContact O-N 3.1Å; D118-S135 PolarHBondContact O-OG 3.15Å; D118-S254 VanDerWaalsContact CG-OG 3.22Å; D118-S254 PolarHBondContact OD1-OG 2.82Å; D118-S254 WeakPolarHBondContact OD2-CB 3.34Å; D118-S254 PolarHBondContact OD2-OG 2.82Å; D118-K319 IonicContact OD2-NZ 2.64Å
119	W	91.4	Very high	90.4	Very high	16 Å²	16	61.6 Å²	61.6	6%	0.061	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.2	-178.4	-68.9	84.7	0	0	0	110.2	Y93 I133 P134 T253 S254 A257 K258	Y93-W119 HydrophobicContact CE2-CH2 4.18Å; Y93-W119 HydrophobicContact CE2-CZ3 4.44Å; Y93-W119 AromaticContact CZ-CH2 3.91Å; Y93-W119 AromaticContact CZ-CZ3 3.87Å; Y93-W119 WeakPolarHBondContact OH-CH2 3.47Å; Y93-W119 WeakPolarHBondContact OH-CZ3 3.29Å; W119-I133 CarbonylContact C-O 3.55Å; W119-I133 WeakPolarHBondContact CA-O 3.48Å; W119-P134 HydrophobicContact CE3-CB 4.4Å; W119-P134 HydrophobicContact CH2-CB 4.3Å; W119-P134 HydrophobicContact CZ3-CB 4.21Å; W119-P134 HydrophobicContact CZ3-CG 4.31Å; W119-T253 HydrophobicContact CH2-CG2 4.14Å; W119-T253 HydrophobicContact CZ2-CG2 4.17Å; W119-S254 PolarHBondContact NE1-O 3.49Å; W119-A257 VanDerWaalsContact CZ2-CA 3.49Å; W119-K258 HydrophobicContact CB-CB 4Å; W119-K258 HydrophobicContact CB-CG 4.38Å; W119-K258 HydrophobicContact CG-CB 4.16Å
120	W	94.2	Very high	90.4	Very high	29 Å²	29	65.5 Å²	65.5	11%	0.11	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	143.1	-175.7	-64	-13.4	0	0	0	111	F64 F87 I111 N113 G117 Y132 I133 V138	F64-W120 HydrophobicContact CE2-CH2 4.27Å; F87-W120 HydrophobicContact CD1-CZ3 4.26Å; F87-W120 HydrophobicContact CE1-CH2 4.39Å; F87-W120 AromaticContact CE1-CZ3 3.7Å; F87-W120 HydrophobicContact CE1-CZ3 3.7Å; F87-W120 HydrophobicContact CZ-CZ3 4.18Å; I111-W120 HydrophobicContact CD1-CE3 4.08Å; I111-W120 HydrophobicContact CG1-CE3 4.34Å; I111-W120 HydrophobicContact CG2-CB 4.32Å; I111-W120 HydrophobicContact CG2-CE3 4.47Å; N113-W120 WeakPolarHBondContact O-CA 3.45Å; N113-W120 WeakPolarHBondContact O-CB 3.38Å; G117-W120 PolarHBondContact O-NE1 3.34Å; W120-Y132 CarbonylContact O-C 3.51Å; W120-Y132 WeakPolarHBondContact O-CA 3.33Å; W120-I133 HydrophobicContact CB-CG1 4.43Å; W120-I133 PolarHBondContact N-O 3.05Å; W120-I133 WeakPolarHBondContact O-CG1 3.34Å; W120-I133 PolarHBondContact O-N 3.31Å; W120-V138 HydrophobicContact CE3-CG2 4.19Å; W120-V138 HydrophobicContact CZ3-CG2 4.11Å
121	E	94.4	Very high	90.4	Very high	65 Å²	65	62.9 Å²	62.9	30%	0.304	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	123.9	171.7	-168.3	-177.8	-173.8	0	0	108.6	L112 N113 Y132	L112-E121 HydrophobicContact CB-CB 4.45Å; L112-E121 HydrophobicContact CB-CG 4.29Å; L112-E121 HydrophobicContact CD1-CG 4.35Å; L112-E121 PolarHBondContact N-O 3.25Å; N113-E121 HydrophobicContact CB-CB 3.86Å; N113-E121 PolarHBondContact N-O 3.49Å; N113-E121 VanDerWaalsContact N-O 3.14Å; N113-E121 PolarHBondContact O-N 2.88Å; E121-Y132 HydrophobicContact CB-CD1 4.22Å; E121-Y132 HydrophobicContact CB-CE1 3.96Å; E121-Y132 HydrophobicContact CG-CE1 4.5Å
122	A	95.2	Very high	90.4	Very high	0 Å²	0	64 Å²	64	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	154.1	-174.5	0	0	0	0	0	111.5	F109 Q110 I111 T130 G131 I133	F109-A122 HydrophobicContact CB-CB 4.22Å; F109-A122 HydrophobicContact CD1-CB 4.24Å; F109-A122 HydrophobicContact CG-CB 4.46Å; Q110-A122 WeakPolarHBondContact O-CA 3.31Å; I111-A122 HydrophobicContact CD1-CB 3.9Å; A122-T130 VanDerWaalsContact O-CA 3.29Å; A122-T130 WeakPolarHBondContact O-CA 3.42Å; A122-G131 PolarHBondContact N-O 3.14Å; A122-G131 PolarHBondContact O-N 3.36Å; A122-I133 HydrophobicContact CB-CD1 3.45Å; A122-I133 VanDerWaalsContact CB-CD1 3.45Å; A122-I133 HydrophobicContact CB-CG1 3.69Å; A122-I133 HydrophobicContact CB-CG2 4.18Å
123	R	96.5	Very high	90.6	Very high	116 Å²	116	60.1 Å²	60.1	44%	0.438	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	122.6	169.9	-171.3	175.8	-175.8	-166.8	-0.6	109.7	F109 Q110 L112 L125 G128 E129 T130	F109-R123 VanDerWaalsContact CA-O 3.3Å; F109-R123 WeakPolarHBondContact CA-O 3.26Å; Q110-R123 PolarHBondContact N-O 3.45Å; Q110-R123 PolarHBondContact O-N 3.2Å; L112-R123 HydrophobicContact CD1-CB 4.2Å; L112-R123 HydrophobicContact CD2-CB 4.36Å; L112-R123 HydrophobicContact CG-CB 4.29Å; R123-L125 PolarHBondContact O-N 3.49Å; R123-G128 PolarHBondContact NE-O 3.11Å; R123-G128 VanDerWaalsContact NE-O 3.11Å; R123-E129 CarbonylContact C-O 3.59Å; R123-E129 VanDerWaalsContact CA-O 3.3Å; R123-E129 WeakPolarHBondContact CA-O 3.48Å; R123-E129 WeakPolarHBondContact CG-O 3.25Å; R123-T130 HydrophobicContact CB-CG2 3.85Å; R123-T130 HydrophobicContact CG-CG2 3.71Å
124	S	96.6	Very high	90.8	Very high	1 Å²	1	57 Å²	57	1%	0.007	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	132.4	170.4	168	0	0	0	0	109.8	E107 T126 T127 G128 E129	E107-S124 WeakPolarHBondContact OE1-CB 3.49Å; E107-S124 PolarHBondContact OE1-OG 3.47Å; S124-T126 VanDerWaalsContact C-N 3.29Å; S124-T126 PolarHBondContact OG-N 3.45Å; S124-T127 VanDerWaalsContact CB-OG1 3.29Å; S124-T127 WeakPolarHBondContact CB-OG1 3.36Å; S124-T127 PolarHBondContact OG-N 3.4Å; S124-T127 PolarHBondContact OG-OG1 3.46Å; S124-G128 WeakPolarHBondContact O-CA 3.3Å; S124-G128 PolarHBondContact O-N 3.45Å; S124-E129 PolarHBondContact N-O 3.27Å
125	L	95.1	Very high	91.2	Very high	86 Å²	86	54.2 Å²	54.2	45%	0.45	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-13.6	171.8	-59.7	-174.6	0	0	0	112.6	L86 K108 Q110 R123	L86-L125 HydrophobicContact CD1-CD1 4.07Å; L86-L125 HydrophobicContact CD2-CD1 3.87Å; K108-L125 HydrophobicContact CB-CD1 4.08Å; K108-L125 WeakPolarHBondContact O-CB 3.31Å; K108-L125 PolarHBondContact O-N 2.68Å; Q110-L125 HydrophobicContact CB-CD2 4.3Å; R123-L125 PolarHBondContact O-N 3.49Å
126	T	94.3	Very high	91.7	Very high	108 Å²	108	52.7 Å²	52.7	66%	0.663	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-51.1	179.9	-54.6	0	0	0	0	110.9	S124	S124-T126 VanDerWaalsContact C-N 3.29Å; S124-T126 PolarHBondContact OG-N 3.45Å
127	T	94.4	Very high	93.1	Very high	77 Å²	77	47.3 Å²	47.3	47%	0.472	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-24.2	-178.2	68.6	0	0	0	0	112.4	S124 E129	S124-T127 VanDerWaalsContact CB-OG1 3.29Å; S124-T127 WeakPolarHBondContact CB-OG1 3.36Å; S124-T127 PolarHBondContact OG-N 3.4Å; S124-T127 PolarHBondContact OG-OG1 3.46Å; T127-E129 PolarHBondContact O-N 2.93Å; T127-E129 WeakPolarHBondContact OG1-CB 3.32Å; T127-E129 PolarHBondContact OG1-N 3.19Å
128	G	94.2	Very high	94	Very high	32 Å²	32	44.7 Å²	44.7	33%	0.33	24%	0.237	S	C	.	.			trans	81.2	-6.1	-174.4	0	0	0	0	0	114.4	R123 S124	R123-G128 PolarHBondContact NE-O 3.11Å; R123-G128 VanDerWaalsContact NE-O 3.11Å; S124-G128 WeakPolarHBondContact O-CA 3.3Å; S124-G128 PolarHBondContact O-N 3.45Å
129	E	96.1	Very high	94.3	Very high	120 Å²	120	42.1 Å²	42.1	56%	0.561	22%	0.223	S	C	*	.			trans	-72.9	159.2	-179.9	-63	178.5	155.9	0	0	112.1	L101 R123 S124 T127	L101-E129 HydrophobicContact CD1-CB 3.83Å; R123-E129 CarbonylContact C-O 3.59Å; R123-E129 VanDerWaalsContact CA-O 3.3Å; R123-E129 WeakPolarHBondContact CA-O 3.48Å; R123-E129 WeakPolarHBondContact CG-O 3.25Å; S124-E129 PolarHBondContact N-O 3.27Å; T127-E129 PolarHBondContact O-N 2.93Å; T127-E129 WeakPolarHBondContact OG1-CB 3.32Å; T127-E129 PolarHBondContact OG1-N 3.19Å
130	T	96	Very high	94.4	Very high	83 Å²	83	43 Å²	43	51%	0.509	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	141.2	-179.2	52.1	0	0	0	0	110.4	L112 A122 R123	L112-T130 HydrophobicContact CD1-CG2 3.85Å; A122-T130 VanDerWaalsContact O-CA 3.29Å; A122-T130 WeakPolarHBondContact O-CA 3.42Å; R123-T130 HydrophobicContact CB-CG2 3.85Å; R123-T130 HydrophobicContact CG-CG2 3.71Å
131	G	95	Very high	94.2	Very high	7 Å²	7	43.5 Å²	43.5	7%	0.072	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.2	-176.4	174.4	0	0	0	0	0	111.3	D99 A122	D99-G131 CarbonylContact O-C 3.55Å; D99-G131 VanDerWaalsContact O-CA 3.29Å; D99-G131 WeakPolarHBondContact O-CA 3.4Å; A122-G131 PolarHBondContact N-O 3.14Å; A122-G131 PolarHBondContact O-N 3.36Å
132	Y	94.8	Very high	93.8	Very high	53 Å²	53	48.2 Å²	48.2	21%	0.208	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	138.4	177.5	-67.7	-73.9	0	0	0	111.9	D99 D100 L101 W120 E121 K258	D99-Y132 HydrophobicContact CB-CD2 4.01Å; D99-Y132 HydrophobicContact CB-CE2 4.36Å; D99-Y132 PolarHBondContact O-N 2.84Å; D100-Y132 WeakPolarHBondContact CA-O 3.3Å; L101-Y132 PolarHBondContact N-O 3.17Å; W120-Y132 CarbonylContact O-C 3.51Å; W120-Y132 WeakPolarHBondContact O-CA 3.33Å; E121-Y132 HydrophobicContact CB-CD1 4.22Å; E121-Y132 HydrophobicContact CB-CE1 3.96Å; E121-Y132 HydrophobicContact CG-CE1 4.5Å; Y132-K258 HydrophobicContact CD1-CD 3.63Å; Y132-K258 HydrophobicContact CD2-CD 4.19Å; Y132-K258 HydrophobicContact CE1-CD 3.24Å; Y132-K258 HydrophobicContact CE2-CD 3.85Å; Y132-K258 HydrophobicContact CG-CB 4.38Å; Y132-K258 HydrophobicContact CG-CD 4.09Å; Y132-K258 PolarHBondContact OH-NZ 2.64Å
133	I	95.4	Very high	93.6	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	147.5	174.9	63.4	168.7	0	0	0	110.4	L101 F103 F109 I111 W119 W120 A122 S135 V138	L101-I133 HydrophobicContact CB-CG2 3.88Å; L101-I133 HydrophobicContact CD2-CG2 4.2Å; L101-I133 HydrophobicContact CG-CG2 4.44Å; F103-I133 HydrophobicContact CD1-CG2 3.83Å; F103-I133 HydrophobicContact CE1-CB 3.74Å; F103-I133 HydrophobicContact CE1-CG2 3.47Å; F103-I133 VanDerWaalsContact CE1-CG2 3.47Å; F103-I133 HydrophobicContact CZ-CB 4.4Å; F109-I133 HydrophobicContact CG-CD1 4.33Å; I111-I133 HydrophobicContact CD1-CD1 3.96Å; W119-I133 CarbonylContact C-O 3.55Å; W119-I133 WeakPolarHBondContact CA-O 3.48Å; W120-I133 HydrophobicContact CB-CG1 4.43Å; W120-I133 PolarHBondContact N-O 3.05Å; W120-I133 WeakPolarHBondContact O-CG1 3.34Å; W120-I133 PolarHBondContact O-N 3.31Å; A122-I133 HydrophobicContact CB-CD1 3.45Å; A122-I133 VanDerWaalsContact CB-CD1 3.45Å; A122-I133 HydrophobicContact CB-CG1 3.69Å; A122-I133 HydrophobicContact CB-CG2 4.18Å; I133-S135 PolarHBondContact O-N 3.12Å; I133-V138 HydrophobicContact CD1-CG1 3.75Å; I133-V138 HydrophobicContact CD1-CG2 4.09Å
134	P	94.1	Very high	93.2	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	123.7	172.9	24.4	-28.7	0	0	0	110.5	Y93 F103 W119 N136 Y137 T253	Y93-P134 HydrophobicContact CD2-CG 3.77Å; Y93-P134 HydrophobicContact CE2-CG 3.91Å; Y93-P134 HydrophobicContact CG-CG 4.18Å; F103-P134 HydrophobicContact CZ-CG 4.43Å; W119-P134 HydrophobicContact CE3-CB 4.4Å; W119-P134 HydrophobicContact CH2-CB 4.3Å; W119-P134 HydrophobicContact CZ3-CB 4.21Å; W119-P134 HydrophobicContact CZ3-CG 4.31Å; P134-N136 PolarHBondContact O-N 2.81Å; P134-Y137 HydrophobicContact CB-CD2 3.82Å; P134-Y137 HydrophobicContact CB-CE2 4.3Å; P134-Y137 HydrophobicContact CB-CG 4.27Å; P134-Y137 HydrophobicContact CG-CD1 4.11Å; P134-Y137 HydrophobicContact CG-CD2 3.6Å; P134-Y137 HydrophobicContact CG-CE2 4.08Å; P134-Y137 HydrophobicContact CG-CG 3.61Å; P134-Y137 WeakPolarHBondContact O-CB 3.3Å; P134-Y137 PolarHBondContact O-N 3.2Å; P134-T253 HydrophobicContact CB-CG2 3.72Å; P134-T253 HydrophobicContact CG-CG2 3.94Å
135	S	92.6	Very high	92.8	Very high	16 Å²	16	48 Å²	48	11%	0.112	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-61.2	-30	-175.7	59.8	0	0	0	0	113.7	D118 I133 Y137 V138	D118-S135 WeakPolarHBondContact CA-OG 3.33Å; D118-S135 WeakPolarHBondContact O-CB 3.38Å; D118-S135 PolarHBondContact O-N 3.1Å; D118-S135 PolarHBondContact O-OG 3.15Å; I133-S135 PolarHBondContact O-N 3.12Å; S135-Y137 PolarHBondContact O-N 2.67Å; S135-V138 WeakPolarHBondContact O-CG2 3.42Å; S135-V138 PolarHBondContact O-N 2.92Å
136	N	90.6	Very high	92.5	Very high	56 Å²	56	45 Å²	45	30%	0.299	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-77.7	-1.2	178	67.3	-38.8	0	0	0	114.2	P134 Q252	P134-N136 PolarHBondContact O-N 2.81Å; N136-Q252 PolarHBondContact ND2-O 3.08Å
137	Y	93.3	Very high	92.4	Very high	12 Å²	12	42.4 Å²	42.4	5%	0.047	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-97.8	-4.8	175.6	-81.2	-129.9	0	0	0	113	L90 Y91 D92 Y93 F103 P134 S135 T250 P251 T253	L90-Y137 WeakPolarHBondContact CB-O 3.4Å; L90-Y137 PolarHBondContact N-O 3.21Å; Y91-Y137 HydrophobicContact CD2-CD1 4.12Å; Y91-Y137 HydrophobicContact CD2-CG 4.08Å; Y91-Y137 HydrophobicContact CG-CD1 4.4Å; D92-Y137 WeakPolarHBondContact O-CE1 3.48Å; Y93-Y137 HydrophobicContact CD2-CD1 4.36Å; Y93-Y137 HydrophobicContact CD2-CE1 4Å; F103-Y137 HydrophobicContact CE2-CD1 4.23Å; F103-Y137 HydrophobicContact CZ-CD1 4.18Å; F103-Y137 HydrophobicContact CZ-CG 4.45Å; P134-Y137 HydrophobicContact CB-CD2 3.82Å; P134-Y137 HydrophobicContact CB-CE2 4.3Å; P134-Y137 HydrophobicContact CB-CG 4.27Å; P134-Y137 HydrophobicContact CG-CD1 4.11Å; P134-Y137 HydrophobicContact CG-CD2 3.6Å; P134-Y137 HydrophobicContact CG-CE2 4.08Å; P134-Y137 HydrophobicContact CG-CG 3.61Å; P134-Y137 WeakPolarHBondContact O-CB 3.3Å; P134-Y137 PolarHBondContact O-N 3.2Å; S135-Y137 PolarHBondContact O-N 2.67Å; Y137-T250 HydrophobicContact CE1-CG2 3.78Å; Y137-T250 WeakPolarHBondContact OH-CG2 3.45Å; Y137-P251 HydrophobicContact CD2-CG 4.14Å; Y137-P251 HydrophobicContact CE2-CG 3.9Å; Y137-P251 WeakPolarHBondContact CE2-O 3.28Å; Y137-P251 PolarHBondContact OH-O 3.44Å; Y137-T253 HydrophobicContact CE2-CG2 3.74Å
138	V	93.3	Very high	92.2	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.042	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	151.1	-176.7	-66.8	0	0	0	0	112	F87 V88 F109 W120 I133 S135	F87-V138 HydrophobicContact CB-CB 4.26Å; F87-V138 HydrophobicContact CD1-CB 4.21Å; F87-V138 HydrophobicContact CD1-CG2 3.98Å; V88-V138 VanDerWaalsContact O-CA 3.26Å; V88-V138 WeakPolarHBondContact O-CA 3.35Å; F109-V138 HydrophobicContact CD2-CG1 4.05Å; F109-V138 HydrophobicContact CE2-CG1 4.14Å; W120-V138 HydrophobicContact CE3-CG2 4.19Å; W120-V138 HydrophobicContact CZ3-CG2 4.11Å; I133-V138 HydrophobicContact CD1-CG1 3.75Å; I133-V138 HydrophobicContact CD1-CG2 4.09Å; S135-V138 WeakPolarHBondContact O-CG2 3.42Å; S135-V138 PolarHBondContact O-N 2.92Å
139	A	93	Very high	92.1	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.008	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	153.1	171.7	0	0	0	0	0	110.5	F87 V88 L90 V141 Q145 A146	F87-A139 CarbonylContact C-O 3.57Å; F87-A139 WeakPolarHBondContact CA-O 3.46Å; V88-A139 PolarHBondContact N-O 3.43Å; V88-A139 PolarHBondContact O-N 2.89Å; L90-A139 HydrophobicContact CD1-CB 4.14Å; L90-A139 HydrophobicContact CD2-CB 3.92Å; L90-A139 HydrophobicContact CG-CB 4.27Å; A139-V141 PolarHBondContact O-N 2.97Å; A139-Q145 VanDerWaalsContact CB-C 3.41Å; A139-Q145 HydrophobicContact CB-CB 3.56Å; A139-Q145 WeakPolarHBondContact CB-O 3.39Å; A139-A146 HydrophobicContact CB-CB 4.23Å
140	P	93.4	Very high	92	Very high	33 Å²	33	38.2 Å²	38.2	21%	0.214	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	135.7	169.7	-18.6	28.4	0	0	0	110.7	T85 L86 F87 D142 S143	T85-P140 HydrophobicContact CG2-CB 4.07Å; L86-P140 WeakPolarHBondContact O-CA 3.37Å; F87-P140 HydrophobicContact CD1-CG 4.27Å; F87-P140 HydrophobicContact CE1-CB 4.44Å; F87-P140 HydrophobicContact CE1-CG 3.69Å; F87-P140 HydrophobicContact CZ-CG 3.93Å; P140-D142 VanDerWaalsContact C-N 3.26Å; P140-D142 PolarHBondContact O-N 2.84Å; P140-D142 VanDerWaalsContact O-N 3.17Å; P140-S143 WeakPolarHBondContact CD-OG 3.43Å; P140-S143 WeakPolarHBondContact O-CB 3.46Å; P140-S143 PolarHBondContact O-N 3.36Å; P140-S143 PolarHBondContact O-OG 3.42Å
141	V	90.3	Very high	91.7	Very high	40 Å²	40	35.9 Å²	35.9	24%	0.242	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-39.5	-171.7	171.7	0	0	0	0	113	L86 V88 K108 A139 S143	L86-V141 HydrophobicContact CB-CG2 3.81Å; L86-V141 WeakPolarHBondContact O-CG2 3.05Å; L86-V141 PolarHBondContact O-N 3.21Å; V88-V141 HydrophobicContact CB-CG2 4.12Å; K108-V141 HydrophobicContact CD-CG2 4.39Å; K108-V141 HydrophobicContact CG-CG2 4.5Å; A139-V141 PolarHBondContact O-N 2.97Å; V141-S143 VanDerWaalsContact C-N 3.33Å
142	D	86.1	Confident	91.5	Very high	165 Å²	165	36.4 Å²	36.4	88%	0.882	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.4	14.3	-175.7	-55.5	-43.3	0	0	0	113	P140	P140-D142 VanDerWaalsContact C-N 3.26Å; P140-D142 PolarHBondContact O-N 2.84Å; P140-D142 VanDerWaalsContact O-N 3.17Å
143	S	89.7	Confident	91.2	Very high	20 Å²	20	41.9 Å²	41.9	14%	0.14	22%	0.217	C	C	.	.	S	Bend	trans	-98.3	155.8	-177.5	75.7	0	0	0	0	112.1	P140 V141 Q145 A146	P140-S143 WeakPolarHBondContact CD-OG 3.43Å; P140-S143 WeakPolarHBondContact O-CB 3.46Å; P140-S143 PolarHBondContact O-N 3.36Å; P140-S143 PolarHBondContact O-OG 3.42Å; V141-S143 VanDerWaalsContact C-N 3.33Å; S143-Q145 PolarHBondContact O-N 2.92Å; S143-Q145 PolarHBondContact OG-N 3.33Å; S143-Q145 PolarHBondContact OG-OE1 3.41Å; S143-A146 WeakPolarHBondContact O-CB 3.38Å; S143-A146 PolarHBondContact O-N 3.29Å
144	I	88.2	Confident	90.9	Very high	28 Å²	28	43.7 Å²	43.7	14%	0.144	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-58.6	-27.3	171.5	-167.9	-174.8	0	0	0	111.9	A146 E147 W149 Y150 Y185 L224	I144-A146 PolarHBondContact O-N 2.79Å; I144-E147 VanDerWaalsContact O-CB 3.3Å; I144-E147 WeakPolarHBondContact O-CB 3.46Å; I144-E147 PolarHBondContact O-N 2.87Å; I144-E147 VanDerWaalsContact O-N 3.09Å; I144-W149 HydrophobicContact CG1-CH2 4.16Å; I144-W149 HydrophobicContact CG1-CZ3 4.39Å; I144-Y150 HydrophobicContact CD1-CD2 3.49Å; I144-Y150 VanDerWaalsContact CD1-CD2 3.49Å; I144-Y150 HydrophobicContact CD1-CE2 3.5Å; I144-Y150 HydrophobicContact CD1-CG 4.02Å; I144-Y150 HydrophobicContact CG1-CD1 4.21Å; I144-Y150 HydrophobicContact CG1-CD2 3.8Å; I144-Y150 HydrophobicContact CG1-CE2 4.18Å; I144-Y150 HydrophobicContact CG1-CG 3.79Å; I144-Y150 HydrophobicContact CG2-CD1 4.38Å; I144-Y150 HydrophobicContact CG2-CE1 4.07Å; I144-Y150 WeakPolarHBondContact O-CB 3.46Å; I144-Y150 WeakPolarHBondContact O-CD1 3.49Å; I144-Y185 HydrophobicContact CD1-CD1 4.35Å; I144-Y185 HydrophobicContact CD1-CE1 3.68Å; I144-L224 HydrophobicContact CD1-CD1 3.24Å; I144-L224 HydrophobicContact CG1-CD1 4.24Å
145	Q	88.8	Confident	90.7	Very high	64 Å²	64	44.3 Å²	44.3	30%	0.299	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-65.7	-19.8	177.5	-66.8	77.9	7.8	0	0	113.1	L90 A139 S143 E147 Y150	L90-Q145 WeakPolarHBondContact CD2-O 3.21Å; A139-Q145 VanDerWaalsContact CB-C 3.41Å; A139-Q145 HydrophobicContact CB-CB 3.56Å; A139-Q145 WeakPolarHBondContact CB-O 3.39Å; S143-Q145 PolarHBondContact O-N 2.92Å; S143-Q145 PolarHBondContact OG-N 3.33Å; S143-Q145 PolarHBondContact OG-OE1 3.41Å; Q145-E147 VanDerWaalsContact C-N 3.3Å; Q145-Y150 HydrophobicContact CG-CD1 4.45Å; Q145-Y150 HydrophobicContact CG-CE1 4.09Å
146	A	89.9	Confident	90.5	Very high	24 Å²	24	45 Å²	45	20%	0.198	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-79	-14.3	174.5	0	0	0	0	0	113.3	V88 A139 S143 I144	V88-A146 HydrophobicContact CG1-CB 3.66Å; A139-A146 HydrophobicContact CB-CB 4.23Å; S143-A146 WeakPolarHBondContact O-CB 3.38Å; S143-A146 PolarHBondContact O-N 3.29Å; I144-A146 PolarHBondContact O-N 2.79Å
147	E	91.3	Very high	90.2	Very high	53 Å²	53	43.9 Å²	43.9	25%	0.248	23%	0.225	C	C	.	.			trans	-76.3	126.6	-178.1	-62.7	-68.7	158.6	0	0	110.9	I144 Q145 W149 Y150 Q225	I144-E147 VanDerWaalsContact O-CB 3.3Å; I144-E147 WeakPolarHBondContact O-CB 3.46Å; I144-E147 PolarHBondContact O-N 2.87Å; I144-E147 VanDerWaalsContact O-N 3.09Å; Q145-E147 VanDerWaalsContact C-N 3.3Å; E147-W149 HydrophobicContact CB-CD2 3.99Å; E147-W149 HydrophobicContact CB-CE3 4.44Å; E147-W149 HydrophobicContact CB-CG 4.47Å; E147-W149 HydrophobicContact CB-CH2 4.13Å; E147-W149 HydrophobicContact CB-CZ2 3.66Å; E147-W149 HydrophobicContact CB-CZ3 4.49Å; E147-W149 HydrophobicContact CG-CH2 4.04Å; E147-W149 HydrophobicContact CG-CZ2 3.49Å; E147-W149 VanDerWaalsContact CG-CZ2 3.49Å; E147-W149 PolarHBondContact O-N 3.09Å; E147-W149 VanDerWaalsContact O-N 3.14Å; E147-W149 PolarHBondContact OE2-NE1 3.25Å; E147-Y150 WeakPolarHBondContact O-CB 3.43Å; E147-Y150 PolarHBondContact O-N 2.77Å; E147-Q225 HydrophobicContact CG-CG 4.5Å; E147-Q225 VanDerWaalsContact OE1-CG 3.25Å; E147-Q225 WeakPolarHBondContact OE1-CG 3.12Å; E147-Q225 PolarHBondContact OE1-NE2 3.35Å
148	E	89.6	Confident	90	Very high	105 Å²	105	45.4 Å²	45.4	49%	0.491	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-27.4	-176.5	-58.3	-165.8	153.5	0	0	113.5	K105 Y150 I245	K105-E148 WeakPolarHBondContact CE-OE1 3.32Å; K105-E148 IonicContact NZ-OE1 2.71Å; K105-E148 PolarHBondContact NZ-OE1 3.18Å; K105-E148 IonicContact NZ-OE2 3.69Å; E148-Y150 VanDerWaalsContact C-N 3.3Å; E148-I245 HydrophobicContact CB-CD1 3.94Å; E148-I245 WeakPolarHBondContact O-CG2 3.47Å
149	W	92.6	Very high	89.8	Confident	14 Å²	14	45.1 Å²	45.1	5%	0.053	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-3.4	178.5	50.4	-97.2	0	0	0	113.1	I144 E147 F151 F173 I175 L224 Q225 V228 I245	I144-W149 HydrophobicContact CG1-CH2 4.16Å; I144-W149 HydrophobicContact CG1-CZ3 4.39Å; E147-W149 HydrophobicContact CB-CD2 3.99Å; E147-W149 HydrophobicContact CB-CE3 4.44Å; E147-W149 HydrophobicContact CB-CG 4.47Å; E147-W149 HydrophobicContact CB-CH2 4.13Å; E147-W149 HydrophobicContact CB-CZ2 3.66Å; E147-W149 HydrophobicContact CB-CZ3 4.49Å; E147-W149 HydrophobicContact CG-CH2 4.04Å; E147-W149 HydrophobicContact CG-CZ2 3.49Å; E147-W149 VanDerWaalsContact CG-CZ2 3.49Å; E147-W149 PolarHBondContact O-N 3.09Å; E147-W149 VanDerWaalsContact O-N 3.14Å; E147-W149 PolarHBondContact OE2-NE1 3.25Å; W149-F151 WeakPolarHBondContact O-CD2 3.42Å; W149-F173 HydrophobicContact CB-CE2 3.68Å; W149-F173 HydrophobicContact CB-CZ 4.02Å; W149-F173 HydrophobicContact CG-CE2 4.21Å; W149-I175 HydrophobicContact CE3-CB 3.69Å; W149-I175 HydrophobicContact CE3-CD1 3.61Å; W149-I175 HydrophobicContact CE3-CG1 3.81Å; W149-I175 HydrophobicContact CH2-CD1 4.38Å; W149-I175 HydrophobicContact CZ3-CB 3.81Å; W149-I175 HydrophobicContact CZ3-CD1 3.52Å; W149-I175 HydrophobicContact CZ3-CG1 4.05Å; W149-I175 HydrophobicContact CZ3-CG2 4.16Å; W149-I175 PolarHBondContact O-N 2.96Å; W149-L224 HydrophobicContact CH2-CB 3.54Å; W149-L224 HydrophobicContact CH2-CD1 4.45Å; W149-L224 HydrophobicContact CZ2-CB 4.36Å; W149-L224 HydrophobicContact CZ3-CB 4.26Å; W149-Q225 HydrophobicContact CZ2-CG 4.15Å; W149-V228 HydrophobicContact CD2-CG2 3.88Å; W149-V228 HydrophobicContact CE3-CG2 4.11Å; W149-V228 HydrophobicContact CG-CG1 4.45Å; W149-V228 HydrophobicContact CG-CG2 4.42Å; W149-V228 HydrophobicContact CH2-CG2 4.36Å; W149-V228 HydrophobicContact CZ2-CG2 4.12Å; W149-V228 HydrophobicContact CZ3-CG2 4.36Å; W149-I245 HydrophobicContact CB-CD1 4.11Å; W149-I245 HydrophobicContact CB-CG1 4.16Å; W149-I245 HydrophobicContact CB-CG2 4.01Å
150	Y	93.2	Very high	89.8	Confident	22 Å²	22	46.5 Å²	46.5	9%	0.086	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-98.7	121.8	-179.6	-176	-106.6	0	0	0	112.4	I144 Q145 E147 E148 G152 I175 E177 Y185	I144-Y150 HydrophobicContact CD1-CD2 3.49Å; I144-Y150 VanDerWaalsContact CD1-CD2 3.49Å; I144-Y150 HydrophobicContact CD1-CE2 3.5Å; I144-Y150 HydrophobicContact CD1-CG 4.02Å; I144-Y150 HydrophobicContact CG1-CD1 4.21Å; I144-Y150 HydrophobicContact CG1-CD2 3.8Å; I144-Y150 HydrophobicContact CG1-CE2 4.18Å; I144-Y150 HydrophobicContact CG1-CG 3.79Å; I144-Y150 HydrophobicContact CG2-CD1 4.38Å; I144-Y150 HydrophobicContact CG2-CE1 4.07Å; I144-Y150 WeakPolarHBondContact O-CB 3.46Å; I144-Y150 WeakPolarHBondContact O-CD1 3.49Å; Q145-Y150 HydrophobicContact CG-CD1 4.45Å; Q145-Y150 HydrophobicContact CG-CE1 4.09Å; E147-Y150 WeakPolarHBondContact O-CB 3.43Å; E147-Y150 PolarHBondContact O-N 2.77Å; E148-Y150 VanDerWaalsContact C-N 3.3Å; Y150-G152 VanDerWaalsContact CE1-CA 3.44Å; Y150-I175 CarbonylContact C-O 3.57Å; Y150-I175 WeakPolarHBondContact CA-O 3.35Å; Y150-I175 HydrophobicContact CD2-CG2 4.2Å; Y150-E177 VanDerWaalsContact OH-CG 3.3Å; Y150-E177 WeakPolarHBondContact OH-CG 3.31Å; Y150-E177 PolarHBondContact OH-OE1 3.14Å; Y150-Y185 AromaticContact CE2-CD1 3.77Å; Y150-Y185 HydrophobicContact CE2-CD1 3.77Å; Y150-Y185 AromaticContact CE2-CE1 3.6Å; Y150-Y185 HydrophobicContact CE2-CE1 3.6Å
151	F	91.2	Very high	89.4	Confident	34 Å²	34	47 Å²	47	15%	0.149	24%	0.237	C	C	.	.			trans	-109.8	13.5	-172.6	-78.1	-100.9	0	0	0	113.1	W149 K153 L154 L174 I175 S246 S248	W149-F151 WeakPolarHBondContact O-CD2 3.42Å; F151-K153 PolarHBondContact O-N 3.24Å; F151-L154 HydrophobicContact CB-CB 3.88Å; F151-L154 HydrophobicContact CB-CD2 3.83Å; F151-L154 HydrophobicContact CB-CG 4.49Å; F151-L154 HydrophobicContact CD1-CD2 3.89Å; F151-L154 HydrophobicContact CG-CD2 4.09Å; F151-L154 WeakPolarHBondContact O-CB 3.41Å; F151-L154 PolarHBondContact O-N 2.67Å; F151-L174 HydrophobicContact CB-CD1 4.47Å; F151-L174 HydrophobicContact CD1-CD2 4.48Å; F151-L174 HydrophobicContact CD2-CB 3.39Å; F151-L174 HydrophobicContact CD2-CD2 4.34Å; F151-L174 HydrophobicContact CD2-CG 4.3Å; F151-L174 HydrophobicContact CE2-CB 3.58Å; F151-L174 HydrophobicContact CG-CB 4.09Å; F151-L174 HydrophobicContact CG-CD2 4.3Å; F151-L174 HydrophobicContact CZ-CB 4.44Å; F151-I175 PolarHBondContact N-O 2.89Å; F151-S246 WeakPolarHBondContact CZ-O 3.4Å; F151-S248 WeakPolarHBondContact CE1-OG 3.29Å; F151-S248 WeakPolarHBondContact CZ-OG 3.46Å
152	G	90.7	Very high	89.4	Confident	17 Å²	17	46.5 Å²	46.5	18%	0.175	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	-130.1	176.1	0	0	0	0	0	112.6	Y150 L154 R176 E177	Y150-G152 VanDerWaalsContact CE1-CA 3.44Å; G152-L154 PolarHBondContact O-N 3.04Å; G152-L154 VanDerWaalsContact O-N 3.17Å; G152-R176 CarbonylContact O-C 3.48Å; G152-R176 WeakPolarHBondContact O-CA 3.48Å; G152-E177 PolarHBondContact O-N 3.31Å
153	K	88.8	Confident	89.6	Confident	169 Å²	169	38.7 Å²	38.7	74%	0.735	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	21.1	-176.7	-66.3	179.1	-179.7	174.3	0	114.3	F151 G155 E177	F151-K153 PolarHBondContact O-N 3.24Å; K153-G155 PolarHBondContact O-N 3.02Å; K153-E177 HydrophobicContact CG-CG 4.45Å; K153-E177 WeakPolarHBondContact CG-OE2 3.27Å
154	L	88.6	Confident	89.6	Confident	38 Å²	38	41 Å²	41	20%	0.199	20%	0.2	C	C	.	.			trans	-55	126.6	176.2	-170.6	71.2	0	0	0	110.2	F151 G152 D158 A159 L174 R176	F151-L154 HydrophobicContact CB-CB 3.88Å; F151-L154 HydrophobicContact CB-CD2 3.83Å; F151-L154 HydrophobicContact CB-CG 4.49Å; F151-L154 HydrophobicContact CD1-CD2 3.89Å; F151-L154 HydrophobicContact CG-CD2 4.09Å; F151-L154 WeakPolarHBondContact O-CB 3.41Å; F151-L154 PolarHBondContact O-N 2.67Å; G152-L154 PolarHBondContact O-N 3.04Å; G152-L154 VanDerWaalsContact O-N 3.17Å; L154-D158 HydrophobicContact CD1-CB 3.51Å; L154-D158 HydrophobicContact CG-CB 3.98Å; L154-A159 HydrophobicContact CD2-CB 3.8Å; L154-A159 HydrophobicContact CG-CB 4.33Å; L154-L174 HydrophobicContact CD2-CD1 4.17Å; L154-L174 HydrophobicContact CD2-CD2 3.88Å; L154-R176 HydrophobicContact CB-CB 4.24Å; L154-R176 VanDerWaalsContact O-CD 3.32Å; L154-R176 WeakPolarHBondContact O-CD 3.16Å
155	G	88.8	Confident	89.4	Confident	12 Å²	12	42.1 Å²	42.1	12%	0.124	21%	0.21	C	C	.	.			trans	-69	158.6	178.8	0	0	0	0	0	112.2	K153 K157 D158 A159 E179	K153-G155 PolarHBondContact O-N 3.02Å; G155-K157 VanDerWaalsContact C-N 3.3Å; G155-K157 PolarHBondContact O-N 2.92Å; G155-D158 PolarHBondContact O-N 3.17Å; G155-A159 WeakPolarHBondContact O-CB 3.29Å; G155-A159 PolarHBondContact O-N 3.32Å; G155-E179 WeakPolarHBondContact CA-OE1 3.47Å
156	R	89.4	Confident	89	Confident	30 Å²	30	49.4 Å²	49.4	11%	0.113	24%	0.242	C	C	.	.	H	α-helix	trans	-53.8	-48	177.7	178.4	-172	-175.8	128.6	-0.7	111.9	A159 E160 R176 E179 H202 Q527	R156-A159 WeakPolarHBondContact O-CB 3.21Å; R156-A159 PolarHBondContact O-N 2.98Å; R156-E160 IonicContact CZ-OE1 3.95Å; R156-E160 IonicContact NE-OE1 3.45Å; R156-E160 PolarHBondContact NE-OE1 3.04Å; R156-E160 IonicContact NH2-OE1 2.73Å; R156-E160 WeakPolarHBondContact O-CG 3.41Å; R156-E160 PolarHBondContact O-N 2.69Å; R156-R176 VanDerWaalsContact CA-CZ 3.44Å; R156-E179 WeakPolarHBondContact CB-OE2 3.48Å; R156-E179 VanDerWaalsContact N-CD 3.28Å; R156-E179 PolarHBondContact N-OE1 2.84Å; R156-E179 PolarHBondContact N-OE2 3.28Å; R156-E179 VanDerWaalsContact N-OE2 3.13Å; R156-H202 VanDerWaalsContact CG-CE1 3.49Å; R156-H202 WeakPolarHBondContact CG-CE1 3.31Å; R156-H202 PolarHBondContact NH2-CD2 3.42Å; R156-Q527 PolarHBondContact NH1-O 3.3Å; R156-Q527 PolarHBondContact NH2-O 2.94Å
157	K	85.3	Confident	88.8	Confident	33 Å²	33	51.2 Å²	51.2	14%	0.143	26%	0.263	C	S	.	.	H	α-helix	trans	-70.9	-37	-176.1	-64.8	-69.8	170.2	175.7	0	111.9	G155 A159 E160 R161 E518 T522	G155-K157 VanDerWaalsContact C-N 3.3Å; G155-K157 PolarHBondContact O-N 2.92Å; K157-A159 VanDerWaalsContact C-N 3.34Å; K157-E160 WeakPolarHBondContact CD-OE2 3.3Å; K157-E160 IonicContact NZ-OE2 3.72Å; K157-E160 PolarHBondContact NZ-OE2 3.07Å; K157-E160 PolarHBondContact O-N 3.36Å; K157-R161 PolarHBondContact O-N 3.1Å; K157-E518 WeakPolarHBondContact CE-O 3.44Å; K157-E518 HydrophobicContact CG-CB 4.27Å; K157-E518 HydrophobicContact CG-CG 4.24Å; K157-E518 PolarHBondContact NZ-O 3.26Å; K157-T522 PolarHBondContact NZ-OG1 2.87Å
158	D	87.2	Confident	88.7	Confident	45 Å²	45	49.8 Å²	49.8	24%	0.241	26%	0.256	C	S	.	.	H	α-helix	trans	-62.7	-41.8	171.4	-70.1	-61.8	0	0	0	111.5	L154 G155 E160 R161 Q162 K322	L154-D158 HydrophobicContact CD1-CB 3.51Å; L154-D158 HydrophobicContact CG-CB 3.98Å; G155-D158 PolarHBondContact O-N 3.17Å; D158-E160 PolarHBondContact O-N 2.89Å; D158-R161 PolarHBondContact O-N 3.03Å; D158-R161 IonicContact OD1-CZ 3.78Å; D158-R161 IonicContact OD1-NE 3.28Å; D158-R161 IonicContact OD1-NH2 2.84Å; D158-R161 PolarHBondContact OD1-NH2 3Å; D158-R161 IonicContact OD2-NH2 3.91Å; D158-Q162 WeakPolarHBondContact O-CB 3.35Å; D158-Q162 PolarHBondContact O-N 2.73Å; D158-K322 IonicContact OD1-NZ 2.72Å; D158-K322 PolarHBondContact OD1-NZ 2.76Å
159	A	90.8	Very high	88.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.6	-42.2	173	0	0	0	0	0	112.5	L154 G155 R156 K157 Q162 L163 L174	L154-A159 HydrophobicContact CD2-CB 3.8Å; L154-A159 HydrophobicContact CG-CB 4.33Å; G155-A159 WeakPolarHBondContact O-CB 3.29Å; G155-A159 PolarHBondContact O-N 3.32Å; R156-A159 WeakPolarHBondContact O-CB 3.21Å; R156-A159 PolarHBondContact O-N 2.98Å; K157-A159 VanDerWaalsContact C-N 3.34Å; A159-Q162 PolarHBondContact O-N 3.34Å; A159-L163 WeakPolarHBondContact O-CB 3.28Å; A159-L163 VanDerWaalsContact O-CG 3.25Å; A159-L163 WeakPolarHBondContact O-CG 3.2Å; A159-L163 PolarHBondContact O-N 3.26Å; A159-L174 HydrophobicContact CB-CD1 3.87Å; A159-L174 HydrophobicContact CB-CD2 4.14Å
160	E	91.2	Very high	89	Confident	30 Å²	30	52.1 Å²	52.1	14%	0.14	27%	0.269	C	S	.	.	H	α-helix	trans	-60	-47.9	175.5	-72.6	174	-173.6	0	0	111.2	R156 K157 D158 Q162 L163 L164 V200 H202	R156-E160 IonicContact CZ-OE1 3.95Å; R156-E160 IonicContact NE-OE1 3.45Å; R156-E160 PolarHBondContact NE-OE1 3.04Å; R156-E160 IonicContact NH2-OE1 2.73Å; R156-E160 WeakPolarHBondContact O-CG 3.41Å; R156-E160 PolarHBondContact O-N 2.69Å; K157-E160 WeakPolarHBondContact CD-OE2 3.3Å; K157-E160 IonicContact NZ-OE2 3.72Å; K157-E160 PolarHBondContact NZ-OE2 3.07Å; K157-E160 PolarHBondContact O-N 3.36Å; D158-E160 PolarHBondContact O-N 2.89Å; E160-Q162 VanDerWaalsContact C-N 3.34Å; E160-Q162 PolarHBondContact O-N 2.88Å; E160-L163 PolarHBondContact O-N 3.4Å; E160-L164 VanDerWaalsContact O-CB 3.25Å; E160-L164 WeakPolarHBondContact O-CB 3.45Å; E160-L164 WeakPolarHBondContact O-CG 3.37Å; E160-L164 PolarHBondContact O-N 3.21Å; E160-V200 HydrophobicContact CG-CB 4Å; E160-V200 HydrophobicContact CG-CG1 4.22Å; E160-V200 HydrophobicContact CG-CG2 4.36Å; E160-H202 WeakPolarHBondContact CG-NE2 3.43Å; E160-H202 IonicContact OE1-CD2 4Å; E160-H202 IonicContact OE1-CE1 2.83Å; E160-H202 IonicContact OE1-NE2 3.31Å; E160-H202 PolarHBondContact OE1-NE2 3.17Å
161	R	86.9	Confident	89	Confident	45 Å²	45	51 Å²	51	17%	0.17	27%	0.265	C	S	.	.	H	α-helix	trans	-57.4	-46	175.8	-76.5	-169.6	-80.5	-108.7	2.4	112.4	K157 D158 S165 D366 Q370	K157-R161 PolarHBondContact O-N 3.1Å; D158-R161 PolarHBondContact O-N 3.03Å; D158-R161 IonicContact OD1-CZ 3.78Å; D158-R161 IonicContact OD1-NE 3.28Å; D158-R161 IonicContact OD1-NH2 2.84Å; D158-R161 PolarHBondContact OD1-NH2 3Å; D158-R161 IonicContact OD2-NH2 3.91Å; R161-S165 PolarHBondContact O-N 2.79Å; R161-S165 PolarHBondContact O-OG 2.87Å; R161-D366 WeakPolarHBondContact CD-OD2 3.26Å; R161-D366 IonicContact CZ-OD1 3.51Å; R161-D366 IonicContact CZ-OD2 3.76Å; R161-D366 IonicContact NH1-OD1 3.67Å; R161-D366 PolarHBondContact NH1-OD1 3.16Å; R161-D366 IonicContact NH1-OD2 2.76Å; R161-D366 PolarHBondContact NH1-OD2 3.34Å; R161-Q370 VanDerWaalsContact NH1-CD 3.33Å
162	Q	88.8	Confident	89.3	Confident	29 Å²	29	49.4 Å²	49.4	14%	0.136	26%	0.258	C	S	.	.	H	α-helix	trans	-66.8	-43.7	-177.1	-162.5	-174.3	-9.6	0	0	111.4	D158 A159 E160 S165 N168 S246 S247	D158-Q162 WeakPolarHBondContact O-CB 3.35Å; D158-Q162 PolarHBondContact O-N 2.73Å; A159-Q162 PolarHBondContact O-N 3.34Å; E160-Q162 VanDerWaalsContact C-N 3.34Å; E160-Q162 PolarHBondContact O-N 2.88Å; Q162-S165 VanDerWaalsContact O-CB 3.27Å; Q162-S165 WeakPolarHBondContact O-CB 3.37Å; Q162-S165 PolarHBondContact O-N 2.8Å; Q162-S165 PolarHBondContact O-OG 3.13Å; Q162-N168 PolarHBondContact O-ND2 3.17Å; Q162-S246 WeakPolarHBondContact CG-OG 3.42Å; Q162-S246 PolarHBondContact NE2-OG 2.99Å; Q162-S247 PolarHBondContact NE2-O 2.84Å
163	L	91.5	Very high	89.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-69.5	-38.4	179.1	-70.5	173.3	0	0	0	112.4	A159 E160 S165 N168 T172 L174 R190 V200	A159-L163 WeakPolarHBondContact O-CB 3.28Å; A159-L163 VanDerWaalsContact O-CG 3.25Å; A159-L163 WeakPolarHBondContact O-CG 3.2Å; A159-L163 PolarHBondContact O-N 3.26Å; E160-L163 PolarHBondContact O-N 3.4Å; L163-S165 PolarHBondContact O-N 3.47Å; L163-N168 WeakPolarHBondContact O-CB 3.49Å; L163-N168 PolarHBondContact O-ND2 2.78Å; L163-T172 HydrophobicContact CD2-CG2 3.77Å; L163-T172 WeakPolarHBondContact CD2-O 3.49Å; L163-L174 HydrophobicContact CD1-CD2 4.26Å; L163-L174 HydrophobicContact CD1-CG 4.22Å; L163-L174 HydrophobicContact CD2-CD2 4.13Å; L163-L174 HydrophobicContact CD2-CG 4.36Å; L163-L174 HydrophobicContact CG-CD2 3.96Å; L163-L174 HydrophobicContact CG-CG 4.37Å; L163-R190 HydrophobicContact CB-CB 4.39Å; L163-R190 WeakPolarHBondContact O-CD 3.03Å; L163-R190 PolarHBondContact O-NH1 3.18Å; L163-V200 HydrophobicContact CB-CG2 3.8Å; L163-V200 HydrophobicContact CD1-CG1 3.61Å; L163-V200 HydrophobicContact CD1-CG2 4.17Å
164	L	89.8	Confident	90	Very high	70 Å²	70	40.8 Å²	40.8	37%	0.366	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	0.3	178.3	-64.8	173.2	0	0	0	113.9	E160 D198 V200	E160-L164 VanDerWaalsContact O-CB 3.25Å; E160-L164 WeakPolarHBondContact O-CB 3.45Å; E160-L164 WeakPolarHBondContact O-CG 3.37Å; E160-L164 PolarHBondContact O-N 3.21Å; L164-D198 HydrophobicContact CD2-CB 3.97Å; L164-V200 HydrophobicContact CD1-CG2 4.28Å; L164-V200 HydrophobicContact CD2-CG2 3.95Å; L164-V200 HydrophobicContact CG-CG2 3.78Å
165	S	84.1	Confident	90.3	Very high	50 Å²	50	39 Å²	39	35%	0.35	21%	0.206	S	C	.	.	S	Bend	trans	-57.7	147.4	174.7	-70.4	0	0	0	0	111.8	R161 Q162 L163 G167 N168 R190	R161-S165 PolarHBondContact O-N 2.79Å; R161-S165 PolarHBondContact O-OG 2.87Å; Q162-S165 VanDerWaalsContact O-CB 3.27Å; Q162-S165 WeakPolarHBondContact O-CB 3.37Å; Q162-S165 PolarHBondContact O-N 2.8Å; Q162-S165 PolarHBondContact O-OG 3.13Å; L163-S165 PolarHBondContact O-N 3.47Å; S165-G167 PolarHBondContact O-N 2.95Å; S165-N168 PolarHBondContact O-N 3.14Å; S165-R190 PolarHBondContact O-NH1 3.33Å
166	F	80.6	Confident	90.6	Very high	218 Å²	218	38.4 Å²	38.4	96%	0.956	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	136	-178.1	-178.2	-94.9	0	0	0	110.8
167	G	83.9	Confident	90.8	Very high	62 Å²	62	40.4 Å²	40.4	64%	0.639	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.2	-15.5	179.1	0	0	0	0	0	115.3	S165 P169	S165-G167 PolarHBondContact O-N 2.95Å; G167-P169 WeakPolarHBondContact O-CD 3.3Å
168	N	89.8	Confident	91.1	Very high	22 Å²	22	39.3 Å²	39.3	12%	0.118	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-72.1	125.2	174.8	-71.4	-21.2	0	0	0	110.9	Q162 L163 S165 T172 R190	Q162-N168 PolarHBondContact O-ND2 3.17Å; L163-N168 WeakPolarHBondContact O-CB 3.49Å; L163-N168 PolarHBondContact O-ND2 2.78Å; S165-N168 PolarHBondContact O-N 3.14Å; N168-T172 HydrophobicContact CB-CG2 4.16Å; N168-R190 PolarHBondContact O-NE 2.99Å; N168-R190 PolarHBondContact O-NH1 3.3Å
169	P	93.2	Very high	91	Very high	63 Å²	63	42.6 Å²	42.6	41%	0.409	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-74.5	167.3	174.9	30.6	-36.1	0	0	0	112.8	G167 G171 T172 V244	G167-P169 WeakPolarHBondContact O-CD 3.3Å; P169-G171 PolarHBondContact O-N 2.98Å; P169-T172 VanDerWaalsContact CD-OG1 3.27Å; P169-T172 WeakPolarHBondContact CD-OG1 3.31Å; P169-T172 WeakPolarHBondContact O-CB 3.45Å; P169-T172 PolarHBondContact O-N 3.05Å; P169-T172 PolarHBondContact O-OG1 3.25Å; P169-V244 HydrophobicContact CG-CB 4.3Å; P169-V244 HydrophobicContact CG-CG2 3.83Å
170	R	94.7	Very high	90.7	Very high	105 Å²	105	45.7 Å²	45.7	40%	0.396	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	138.1	168	-171.3	-179.1	-176.2	-172.9	0.6	110.2	D191 F240 T243	R170-D191 IonicContact CZ-OD1 3.94Å; R170-D191 IonicContact NE-OD1 3.18Å; R170-D191 PolarHBondContact NE-OD1 2.79Å; R170-D191 IonicContact NH2-OD1 2.8Å; R170-D191 PolarHBondContact NH2-OD1 2.83Å; R170-D191 IonicContact NH2-OD2 2.89Å; R170-F240 HydrophobicContact CG-CB 4.49Å; R170-F240 HydrophobicContact CG-CD1 4.1Å; R170-F240 HydrophobicContact CG-CD2 4.14Å; R170-F240 HydrophobicContact CG-CE1 4.35Å; R170-F240 HydrophobicContact CG-CE2 4.4Å; R170-F240 HydrophobicContact CG-CG 3.98Å; R170-F240 HydrophobicContact CG-CZ 4.5Å; R170-T243 PolarHBondContact O-OG1 2.8Å; R170-T243 VanDerWaalsContact O-OG1 3.04Å
171	G	94.9	Very high	90.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.5	-1.4	-175.3	0	0	0	0	0	114.7	P169 F173 R190 N241 T243	P169-G171 PolarHBondContact O-N 2.98Å; G171-F173 PolarHBondContact O-N 3.35Å; G171-R190 PolarHBondContact N-O 3.04Å; G171-N241 WeakPolarHBondContact CA-O 3.33Å; G171-T243 WeakPolarHBondContact CA-OG1 3.41Å; G171-T243 PolarHBondContact O-N 2.84Å; G171-T243 PolarHBondContact O-OG1 3.41Å
172	T	96.8	Very high	90.1	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.285	C	S	.	.			trans	-59.2	134	169.1	-60.8	0	0	0	0	109.7	L163 N168 P169 I189 R190 V244	L163-T172 HydrophobicContact CD2-CG2 3.77Å; L163-T172 WeakPolarHBondContact CD2-O 3.49Å; N168-T172 HydrophobicContact CB-CG2 4.16Å; P169-T172 VanDerWaalsContact CD-OG1 3.27Å; P169-T172 WeakPolarHBondContact CD-OG1 3.31Å; P169-T172 WeakPolarHBondContact O-CB 3.45Å; P169-T172 PolarHBondContact O-N 3.05Å; P169-T172 PolarHBondContact O-OG1 3.25Å; T172-I189 WeakPolarHBondContact O-CA 3.41Å; T172-R190 PolarHBondContact O-N 3.22Å; T172-V244 CarbonylContact C-O 3.56Å; T172-V244 WeakPolarHBondContact CA-O 3.29Å; T172-V244 WeakPolarHBondContact CG2-O 3.42Å
173	F	97.2	Very high	89.8	Confident	5 Å²	5	56.2 Å²	56.2	2%	0.022	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	165.5	-171.4	78.4	-77.5	0	0	0	113.9	W149 G171 L187 S188 I189 V228 L242 V244 I245 S246	W149-F173 HydrophobicContact CB-CE2 3.68Å; W149-F173 HydrophobicContact CB-CZ 4.02Å; W149-F173 HydrophobicContact CG-CE2 4.21Å; G171-F173 PolarHBondContact O-N 3.35Å; F173-L187 HydrophobicContact CB-CD1 4.24Å; F173-L187 HydrophobicContact CD2-CD1 3.78Å; F173-L187 HydrophobicContact CG-CD1 4.43Å; F173-S188 WeakPolarHBondContact CA-O 3.45Å; F173-S188 WeakPolarHBondContact CB-O 3.35Å; F173-I189 HydrophobicContact CB-CG1 4.21Å; F173-V228 HydrophobicContact CE2-CG1 3.81Å; F173-V228 HydrophobicContact CE2-CG2 4.3Å; F173-V228 HydrophobicContact CZ-CG1 3.69Å; F173-L242 HydrophobicContact CB-CD2 3.74Å; F173-L242 HydrophobicContact CD1-CB 3.65Å; F173-L242 HydrophobicContact CD1-CD2 4.14Å; F173-L242 HydrophobicContact CD1-CG 4.31Å; F173-L242 HydrophobicContact CD2-CB 4.49Å; F173-L242 HydrophobicContact CD2-CD1 3.95Å; F173-L242 HydrophobicContact CD2-CD2 4.07Å; F173-L242 HydrophobicContact CD2-CG 4.38Å; F173-L242 HydrophobicContact CE1-CB 3.69Å; F173-L242 HydrophobicContact CE2-CD1 3.89Å; F173-L242 HydrophobicContact CG-CB 4.07Å; F173-L242 HydrophobicContact CG-CD1 4.29Å; F173-L242 HydrophobicContact CG-CD2 3.71Å; F173-L242 HydrophobicContact CG-CG 4.22Å; F173-L242 HydrophobicContact CZ-CB 4.14Å; F173-L242 HydrophobicContact CZ-CD1 4.2Å; F173-V244 VanDerWaalsContact CD1-O 3.31Å; F173-V244 WeakPolarHBondContact CD1-O 3.35Å; F173-V244 PolarHBondContact N-O 3.48Å; F173-I245 HydrophobicContact CE1-CG1 3.98Å; F173-I245 HydrophobicContact CZ-CG1 3.97Å; F173-S246 PolarHBondContact O-N 3.35Å
174	L	96.4	Very high	89.7	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	158.3	167.9	59.5	84.8	0	0	0	110.7	F151 L154 A159 L163 R176 S188	F151-L174 HydrophobicContact CB-CD1 4.47Å; F151-L174 HydrophobicContact CD1-CD2 4.48Å; F151-L174 HydrophobicContact CD2-CB 3.39Å; F151-L174 HydrophobicContact CD2-CD2 4.34Å; F151-L174 HydrophobicContact CD2-CG 4.3Å; F151-L174 HydrophobicContact CE2-CB 3.58Å; F151-L174 HydrophobicContact CG-CB 4.09Å; F151-L174 HydrophobicContact CG-CD2 4.3Å; F151-L174 HydrophobicContact CZ-CB 4.44Å; L154-L174 HydrophobicContact CD2-CD1 4.17Å; L154-L174 HydrophobicContact CD2-CD2 3.88Å; A159-L174 HydrophobicContact CB-CD1 3.87Å; A159-L174 HydrophobicContact CB-CD2 4.14Å; L163-L174 HydrophobicContact CD1-CD2 4.26Å; L163-L174 HydrophobicContact CD1-CG 4.22Å; L163-L174 HydrophobicContact CD2-CD2 4.13Å; L163-L174 HydrophobicContact CD2-CG 4.36Å; L163-L174 HydrophobicContact CG-CD2 3.96Å; L163-L174 HydrophobicContact CG-CG 4.37Å; L174-R176 HydrophobicContact CD1-CB 4.25Å; L174-R176 HydrophobicContact CD1-CG 4.27Å; L174-S188 PolarHBondContact N-O 2.89Å; L174-S188 PolarHBondContact O-N 3.04Å
175	I	95.9	Very high	89.9	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	137.5	169.2	-62.2	-177.5	0	0	0	109.1	W149 Y150 F151 Y185 S186 L187 I205 V228	W149-I175 HydrophobicContact CE3-CB 3.69Å; W149-I175 HydrophobicContact CE3-CD1 3.61Å; W149-I175 HydrophobicContact CE3-CG1 3.81Å; W149-I175 HydrophobicContact CH2-CD1 4.38Å; W149-I175 HydrophobicContact CZ3-CB 3.81Å; W149-I175 HydrophobicContact CZ3-CD1 3.52Å; W149-I175 HydrophobicContact CZ3-CG1 4.05Å; W149-I175 HydrophobicContact CZ3-CG2 4.16Å; W149-I175 PolarHBondContact O-N 2.96Å; Y150-I175 CarbonylContact C-O 3.57Å; Y150-I175 WeakPolarHBondContact CA-O 3.35Å; Y150-I175 HydrophobicContact CD2-CG2 4.2Å; F151-I175 PolarHBondContact N-O 2.89Å; I175-Y185 HydrophobicContact CG2-CD1 4.39Å; I175-Y185 HydrophobicContact CG2-CG 4.45Å; I175-S186 WeakPolarHBondContact CA-O 3.42Å; I175-L187 HydrophobicContact CD1-CD1 4.34Å; I175-L187 HydrophobicContact CG1-CB 4.4Å; I175-L187 HydrophobicContact CG1-CD1 3.79Å; I175-I205 HydrophobicContact CD1-CD1 3.72Å; I175-I205 HydrophobicContact CG1-CD1 4.18Å; I175-I205 HydrophobicContact CG2-CD1 4Å; I175-V228 HydrophobicContact CD1-CG2 3.54Å
176	R	94.9	Very high	90.5	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	164.9	-179.8	62.3	-167	179.9	81.6	-0.2	110.5	G152 L154 R156 L174 E179 Y185 S186 S188 H202	G152-R176 CarbonylContact O-C 3.48Å; G152-R176 WeakPolarHBondContact O-CA 3.48Å; L154-R176 HydrophobicContact CB-CB 4.24Å; L154-R176 VanDerWaalsContact O-CD 3.32Å; L154-R176 WeakPolarHBondContact O-CD 3.16Å; R156-R176 VanDerWaalsContact CA-CZ 3.44Å; L174-R176 HydrophobicContact CD1-CB 4.25Å; L174-R176 HydrophobicContact CD1-CG 4.27Å; R176-E179 IonicContact CZ-OE2 3.96Å; R176-E179 IonicContact NH1-OE2 3.68Å; R176-E179 PolarHBondContact NH1-OE2 2.64Å; R176-E179 IonicContact NH2-OE2 3.65Å; R176-Y185 CarbonylContact O-C 3.59Å; R176-Y185 WeakPolarHBondContact O-CA 3.25Å; R176-S186 PolarHBondContact N-O 3.48Å; R176-S186 PolarHBondContact O-N 2.92Å; R176-S188 PolarHBondContact NE-OG 3.19Å; R176-S188 VanDerWaalsContact NE-OG 3.1Å; R176-H202 PolarHBondContact NH2-ND1 3.07Å
177	E	94	Very high	91.2	Very high	71 Å²	71	42.3 Å²	42.3	33%	0.332	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	143.9	169.3	-67.4	-176.9	-154.7	0	0	110.3	Y150 G152 K153 E179	Y150-E177 VanDerWaalsContact OH-CG 3.3Å; Y150-E177 WeakPolarHBondContact OH-CG 3.31Å; Y150-E177 PolarHBondContact OH-OE1 3.14Å; G152-E177 PolarHBondContact O-N 3.31Å; K153-E177 HydrophobicContact CG-CG 4.45Å; K153-E177 WeakPolarHBondContact CG-OE2 3.27Å; E177-E179 PolarHBondContact O-N 2.82Å
178	S	89.9	Confident	91.9	Very high	11 Å²	11	39.4 Å²	39.4	8%	0.077	21%	0.207	C	C	.	.			trans	-78.3	120.7	175.3	-177.2	0	0	0	0	110.4	T180 T181 A184 Y528	S178-T180 VanDerWaalsContact C-N 3.26Å; S178-T180 PolarHBondContact O-N 3.08Å; S178-T180 PolarHBondContact OG-OG1 2.75Å; S178-T181 WeakPolarHBondContact CB-O 2.95Å; S178-T181 PolarHBondContact OG-N 3.32Å; S178-A184 VanDerWaalsContact CB-O 3.3Å; S178-A184 WeakPolarHBondContact CB-O 3.49Å; S178-A184 PolarHBondContact N-O 2.99Å; S178-Y528 PolarHBondContact OG-OH 2.79Å
179	E	86.1	Confident	92.2	Very high	114 Å²	114	38.3 Å²	38.3	53%	0.533	20%	0.202	S	C	.	.	S	Bend	trans	-67.6	-28.6	175.4	-66.8	151.9	131	0	0	112.3	G155 R156 R176 E177	G155-E179 WeakPolarHBondContact CA-OE1 3.47Å; R156-E179 WeakPolarHBondContact CB-OE2 3.48Å; R156-E179 VanDerWaalsContact N-CD 3.28Å; R156-E179 PolarHBondContact N-OE1 2.84Å; R156-E179 PolarHBondContact N-OE2 3.28Å; R156-E179 VanDerWaalsContact N-OE2 3.13Å; R176-E179 IonicContact CZ-OE2 3.96Å; R176-E179 IonicContact NH1-OE2 3.68Å; R176-E179 PolarHBondContact NH1-OE2 2.64Å; R176-E179 IonicContact NH2-OE2 3.65Å; E177-E179 PolarHBondContact O-N 2.82Å
180	T	83.5	Confident	92.3	Very high	65 Å²	65	36.5 Å²	36.5	40%	0.399	19%	0.187	S	C	.	.	S	Bend	trans	-91.1	-15.2	-175.9	59.4	0	0	0	0	113.2	S178 Y528	S178-T180 VanDerWaalsContact C-N 3.26Å; S178-T180 PolarHBondContact O-N 3.08Å; S178-T180 PolarHBondContact OG-OG1 2.75Å; T180-Y528 HydrophobicContact CG2-CE2 4.23Å; T180-Y528 WeakPolarHBondContact OG1-CE2 3.34Å; T180-Y528 PolarHBondContact OG1-OH 3.02Å
181	T	82.3	Confident	92.3	Very high	51 Å²	51	31.7 Å²	31.7	31%	0.313	17%	0.168	S	C	.	.	S	Bend	trans	-146.7	106.2	-175.9	-61.3	0	0	0	0	110.9	S178 G183 A184 K204	S178-T181 WeakPolarHBondContact CB-O 2.95Å; S178-T181 PolarHBondContact OG-N 3.32Å; T181-G183 PolarHBondContact O-N 2.71Å; T181-A184 HydrophobicContact CG2-CB 3.78Å; T181-A184 WeakPolarHBondContact O-CB 3.2Å; T181-A184 PolarHBondContact O-N 2.8Å; T181-K204 WeakPolarHBondContact OG1-CE 3.48Å; T181-K204 PolarHBondContact OG1-NZ 3.13Å
182	K	84.1	Confident	92.2	Very high	215 Å²	215	37 Å²	37	94%	0.935	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	127.2	179.3	-169.9	175.8	-178.2	178.8	0	111	A184	K182-A184 VanDerWaalsContact C-N 3.29Å; K182-A184 PolarHBondContact O-N 2.85Å
183	G	82.9	Confident	91.8	Very high	58 Å²	58	39.1 Å²	39.1	60%	0.598	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.1	-0.8	179.4	0	0	0	0	0	115.4	T181	T181-G183 PolarHBondContact O-N 2.71Å
184	A	89	Confident	91.4	Very high	8 Å²	8	46 Å²	46	7%	0.066	24%	0.237	C	C	.	.			trans	-95.6	166	168.7	0	0	0	0	0	111	S178 T181 K182	S178-A184 VanDerWaalsContact CB-O 3.3Å; S178-A184 WeakPolarHBondContact CB-O 3.49Å; S178-A184 PolarHBondContact N-O 2.99Å; T181-A184 HydrophobicContact CG2-CB 3.78Å; T181-A184 WeakPolarHBondContact O-CB 3.2Å; T181-A184 PolarHBondContact O-N 2.8Å; K182-A184 VanDerWaalsContact C-N 3.29Å; K182-A184 PolarHBondContact O-N 2.85Å
185	Y	94.3	Very high	90.8	Very high	39 Å²	39	54.4 Å²	54.4	15%	0.153	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	164.1	177.6	-57.2	-84.1	0	0	0	111	I144 Y150 I175 R176 I205 Y213 L224	I144-Y185 HydrophobicContact CD1-CD1 4.35Å; I144-Y185 HydrophobicContact CD1-CE1 3.68Å; Y150-Y185 AromaticContact CE2-CD1 3.77Å; Y150-Y185 HydrophobicContact CE2-CD1 3.77Å; Y150-Y185 AromaticContact CE2-CE1 3.6Å; Y150-Y185 HydrophobicContact CE2-CE1 3.6Å; I175-Y185 HydrophobicContact CG2-CD1 4.39Å; I175-Y185 HydrophobicContact CG2-CG 4.45Å; R176-Y185 CarbonylContact O-C 3.59Å; R176-Y185 WeakPolarHBondContact O-CA 3.25Å; Y185-I205 PolarHBondContact N-O 3.42Å; Y185-I205 VanDerWaalsContact N-O 3.14Å; Y185-I205 PolarHBondContact O-N 2.7Å; Y185-Y213 HydrophobicContact CD2-CD1 4.37Å; Y185-Y213 HydrophobicContact CD2-CE1 4.04Å; Y185-Y213 HydrophobicContact CE2-CD1 4.5Å; Y185-Y213 AromaticContact CE2-CE1 3.73Å; Y185-Y213 HydrophobicContact CE2-CE1 3.73Å; Y185-L224 HydrophobicContact CD2-CD1 3.83Å; Y185-L224 HydrophobicContact CD2-CD2 4.5Å; Y185-L224 HydrophobicContact CE1-CD1 4.48Å; Y185-L224 HydrophobicContact CE2-CD1 3.8Å; Y185-L224 HydrophobicContact CG-CD1 4.19Å
186	S	96	Very high	90.1	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	125.5	173.7	-56.3	0	0	0	0	109.7	I175 R176 Y203 Y528	I175-S186 WeakPolarHBondContact CA-O 3.42Å; R176-S186 PolarHBondContact N-O 3.48Å; R176-S186 PolarHBondContact O-N 2.92Å; S186-Y203 CarbonylContact C-O 3.41Å; S186-Y203 WeakPolarHBondContact CA-O 3.49Å; S186-Y528 WeakPolarHBondContact OG-CE1 3.42Å; S186-Y528 PolarHBondContact OG-OH 2.78Å
187	L	96.4	Very high	89.8	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	123	168.3	173.3	62.7	0	0	0	108.5	F173 I175 I189 H202 Y203 I205 I215 L238 L242	F173-L187 HydrophobicContact CB-CD1 4.24Å; F173-L187 HydrophobicContact CD2-CD1 3.78Å; F173-L187 HydrophobicContact CG-CD1 4.43Å; I175-L187 HydrophobicContact CD1-CD1 4.34Å; I175-L187 HydrophobicContact CG1-CB 4.4Å; I175-L187 HydrophobicContact CG1-CD1 3.79Å; L187-I189 HydrophobicContact CD1-CG1 4.19Å; L187-I189 HydrophobicContact CD2-CD1 3.92Å; L187-I189 HydrophobicContact CD2-CG1 4.34Å; L187-I189 HydrophobicContact CG-CD1 4.02Å; L187-I189 HydrophobicContact CG-CG1 3.89Å; L187-H202 CarbonylContact O-C 3.59Å; L187-H202 WeakPolarHBondContact O-CA 3.49Å; L187-Y203 PolarHBondContact N-O 3.31Å; L187-Y203 PolarHBondContact O-N 2.82Å; L187-I205 HydrophobicContact CB-CD1 4.03Å; L187-I205 HydrophobicContact CB-CG1 4.17Å; L187-I215 HydrophobicContact CB-CD1 4.39Å; L187-I215 HydrophobicContact CD2-CD1 3.64Å; L187-L238 HydrophobicContact CD2-CD1 3.88Å; L187-L242 HydrophobicContact CD1-CD1 4.38Å; L187-L242 HydrophobicContact CD1-CD2 4.07Å; L187-L242 HydrophobicContact CD2-CD2 4.21Å
188	S	97	Very high	89.5	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128.4	179.4	-46.1	0	0	0	0	108.8	F173 L174 R176 K201 H202	F173-S188 WeakPolarHBondContact CA-O 3.45Å; F173-S188 WeakPolarHBondContact CB-O 3.35Å; L174-S188 PolarHBondContact N-O 2.89Å; L174-S188 PolarHBondContact O-N 3.04Å; R176-S188 PolarHBondContact NE-OG 3.19Å; R176-S188 VanDerWaalsContact NE-OG 3.1Å; S188-K201 WeakPolarHBondContact CA-O 3.26Å; S188-H202 PolarHBondContact OG-ND1 3.48Å; S188-H202 VanDerWaalsContact OG-ND1 3.17Å
189	I	96.3	Very high	89.5	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	130.4	-173.3	-48.6	176	0	0	0	109.8	T172 F173 L187 V200 K201 Y203 L238 L242	T172-I189 WeakPolarHBondContact O-CA 3.41Å; F173-I189 HydrophobicContact CB-CG1 4.21Å; L187-I189 HydrophobicContact CD1-CG1 4.19Å; L187-I189 HydrophobicContact CD2-CD1 3.92Å; L187-I189 HydrophobicContact CD2-CG1 4.34Å; L187-I189 HydrophobicContact CG-CD1 4.02Å; L187-I189 HydrophobicContact CG-CG1 3.89Å; I189-V200 CarbonylContact O-C 3.54Å; I189-V200 VanDerWaalsContact O-CA 3.31Å; I189-V200 WeakPolarHBondContact O-CA 3.42Å; I189-K201 PolarHBondContact N-O 2.94Å; I189-K201 PolarHBondContact O-N 2.91Å; I189-Y203 HydrophobicContact CD1-CD2 3.98Å; I189-Y203 HydrophobicContact CD1-CE2 3.73Å; I189-Y203 HydrophobicContact CG1-CD2 4.41Å; I189-Y203 HydrophobicContact CG1-CE2 4.31Å; I189-L238 HydrophobicContact CD1-CB 4.39Å; I189-L238 HydrophobicContact CD1-CD1 3.86Å; I189-L242 HydrophobicContact CD1-CD2 3.56Å; I189-L242 HydrophobicContact CG1-CD2 3.9Å
190	R	95.4	Very high	89.9	Confident	25 Å²	25	57.3 Å²	57.3	9%	0.094	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	127.1	168.9	-176.2	-177.8	-179.7	149.5	-11.4	110.1	L163 S165 N168 G171 T172 D198	L163-R190 HydrophobicContact CB-CB 4.39Å; L163-R190 WeakPolarHBondContact O-CD 3.03Å; L163-R190 PolarHBondContact O-NH1 3.18Å; S165-R190 PolarHBondContact O-NH1 3.33Å; N168-R190 PolarHBondContact O-NE 2.99Å; N168-R190 PolarHBondContact O-NH1 3.3Å; G171-R190 PolarHBondContact N-O 3.04Å; T172-R190 PolarHBondContact O-N 3.22Å; R190-D198 IonicContact CZ-OD1 3.9Å; R190-D198 IonicContact NE-OD1 3.9Å; R190-D198 PolarHBondContact NE-OD1 3.28Å; R190-D198 VanDerWaalsContact NE-OD1 3.12Å; R190-D198 IonicContact NH2-OD1 3.76Å; R190-D198 PolarHBondContact NH2-OD1 2.94Å; R190-D198 IonicContact NH2-OD2 3.68Å; R190-D198 PolarHBondContact NH2-OD2 3.42Å
191	D	94.3	Very high	90.3	Very high	3 Å²	3	56.4 Å²	56.4	2%	0.016	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	168.6	177.5	-162	21.3	0	0	0	110.8	R170 H199 K201 C239	R170-D191 IonicContact CZ-OD1 3.94Å; R170-D191 IonicContact NE-OD1 3.18Å; R170-D191 PolarHBondContact NE-OD1 2.79Å; R170-D191 IonicContact NH2-OD1 2.8Å; R170-D191 PolarHBondContact NH2-OD1 2.83Å; R170-D191 IonicContact NH2-OD2 2.89Å; D191-H199 PolarHBondContact N-O 3.36Å; D191-H199 PolarHBondContact O-N 2.97Å; D191-H199 VanDerWaalsContact O-O 3.04Å; D191-H199 IonicContact OD2-CE1 3.84Å; D191-H199 IonicContact OD2-NE2 2.7Å; D191-K201 HydrophobicContact CB-CD 4.37Å; D191-K201 WeakPolarHBondContact OD2-CE 3.39Å; D191-K201 IonicContact OD2-NZ 3.16Å; D191-K201 PolarHBondContact OD2-NZ 3.41Å; D191-C239 VanDerWaalsContact OD2-CB 3.28Å; D191-C239 WeakPolarHBondContact OD2-CB 3.02Å
192	W	92.6	Very high	90.9	Very high	113 Å²	113	54.1 Å²	54.1	43%	0.428	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	138	176.8	-180	95.9	0	0	0	110.4	D194 G197	W192-D194 WeakPolarHBondContact CH2-OD1 3.4Å; W192-G197 WeakPolarHBondContact CA-O 3.13Å; W192-G197 VanDerWaalsContact CD1-C 3.43Å
193	D	89.9	Confident	91.3	Very high	44 Å²	44	44.2 Å²	44.2	24%	0.235	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	163.2	169.4	70.9	56.7	0	0	0	112	M195 K196 G197 H199	D193-M195 PolarHBondContact O-N 2.95Å; D193-M195 WeakPolarHBondContact OD1-CA 3.08Å; D193-M195 WeakPolarHBondContact OD1-CB 3.41Å; D193-M195 PolarHBondContact OD1-N 3.41Å; D193-K196 WeakPolarHBondContact OD1-CB 3.35Å; D193-K196 PolarHBondContact OD1-N 2.82Å; D193-G197 PolarHBondContact N-O 2.8Å; D193-G197 VanDerWaalsContact O-CA 3.24Å; D193-G197 WeakPolarHBondContact O-CA 3.33Å; D193-G197 PolarHBondContact O-N 3.33Å; D193-H199 IonicContact OD2-CE1 3.94Å; D193-H199 PolarHBondContact OD2-CE1 3.32Å; D193-H199 IonicContact OD2-ND1 2.69Å; D193-H199 IonicContact OD2-NE2 2.71Å
194	D	88.4	Confident	91.7	Very high	148 Å²	148	43.3 Å²	43.3	79%	0.791	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-23.8	-176.1	-67.4	-52.7	0	0	0	114	W192	W192-D194 WeakPolarHBondContact CH2-OD1 3.4Å
195	M	83.9	Confident	91.9	Very high	178 Å²	178	43 Å²	43	88%	0.877	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-42	-173.9	-69.2	-68	-63.2	0	0	111.9	D193	D193-M195 PolarHBondContact O-N 2.95Å; D193-M195 WeakPolarHBondContact OD1-CA 3.08Å; D193-M195 WeakPolarHBondContact OD1-CB 3.41Å; D193-M195 PolarHBondContact OD1-N 3.41Å
196	K	80.7	Confident	91.5	Very high	109 Å²	109	47.1 Å²	47.1	47%	0.474	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-18.9	-173.2	-61.1	-174.7	-177.7	-171.9	0	112.9	D193 E525	D193-K196 WeakPolarHBondContact OD1-CB 3.35Å; D193-K196 PolarHBondContact OD1-N 2.82Å; K196-E525 VanDerWaalsContact CE-OE1 3.28Å; K196-E525 WeakPolarHBondContact CE-OE1 3.41Å; K196-E525 IonicContact NZ-OE1 3.87Å; K196-E525 PolarHBondContact NZ-OE1 3.02Å; K196-E525 IonicContact NZ-OE2 2.76Å; K196-E525 PolarHBondContact NZ-OE2 3.47Å
197	G	87.9	Confident	91.1	Very high	23 Å²	23	52.5 Å²	52.5	24%	0.237	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	67.9	-147.1	-167.9	0	0	0	0	0	111.6	W192 D193 H199	W192-G197 WeakPolarHBondContact CA-O 3.13Å; W192-G197 VanDerWaalsContact CD1-C 3.43Å; D193-G197 PolarHBondContact N-O 2.8Å; D193-G197 VanDerWaalsContact O-CA 3.24Å; D193-G197 WeakPolarHBondContact O-CA 3.33Å; D193-G197 PolarHBondContact O-N 3.33Å; G197-H199 PolarHBondContact O-N 2.92Å; G197-H199 PolarHBondContact O-ND1 3.5Å
198	D	89.5	Confident	90.5	Very high	85 Å²	85	54.3 Å²	54.3	46%	0.455	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	126.7	176.3	-76.6	-68.7	0	0	0	111.2	L164 R190	L164-D198 HydrophobicContact CD2-CB 3.97Å; R190-D198 IonicContact CZ-OD1 3.9Å; R190-D198 IonicContact NE-OD1 3.9Å; R190-D198 PolarHBondContact NE-OD1 3.28Å; R190-D198 VanDerWaalsContact NE-OD1 3.12Å; R190-D198 IonicContact NH2-OD1 3.76Å; R190-D198 PolarHBondContact NH2-OD1 2.94Å; R190-D198 IonicContact NH2-OD2 3.68Å; R190-D198 PolarHBondContact NH2-OD2 3.42Å
199	H	90.1	Very high	89.9	Confident	23 Å²	23	63 Å²	63	11%	0.106	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	177.5	177.7	63.3	-80	0	0	0	110.8	D191 D193 G197 K201	D191-H199 PolarHBondContact N-O 3.36Å; D191-H199 PolarHBondContact O-N 2.97Å; D191-H199 VanDerWaalsContact O-O 3.04Å; D191-H199 IonicContact OD2-CE1 3.84Å; D191-H199 IonicContact OD2-NE2 2.7Å; D193-H199 IonicContact OD2-CE1 3.94Å; D193-H199 PolarHBondContact OD2-CE1 3.32Å; D193-H199 IonicContact OD2-ND1 2.69Å; D193-H199 IonicContact OD2-NE2 2.71Å; G197-H199 PolarHBondContact O-N 2.92Å; G197-H199 PolarHBondContact O-ND1 3.5Å; H199-K201 WeakPolarHBondContact NE2-CE 3.34Å
200	V	93.1	Very high	89.3	Confident	17 Å²	17	69.5 Å²	69.5	10%	0.103	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	132.3	179.3	176.3	0	0	0	0	109.7	E160 L163 L164 I189	E160-V200 HydrophobicContact CG-CB 4Å; E160-V200 HydrophobicContact CG-CG1 4.22Å; E160-V200 HydrophobicContact CG-CG2 4.36Å; L163-V200 HydrophobicContact CB-CG2 3.8Å; L163-V200 HydrophobicContact CD1-CG1 3.61Å; L163-V200 HydrophobicContact CD1-CG2 4.17Å; L164-V200 HydrophobicContact CD1-CG2 4.28Å; L164-V200 HydrophobicContact CD2-CG2 3.95Å; L164-V200 HydrophobicContact CG-CG2 3.78Å; I189-V200 CarbonylContact O-C 3.54Å; I189-V200 VanDerWaalsContact O-CA 3.31Å; I189-V200 WeakPolarHBondContact O-CA 3.42Å
201	K	92.6	Very high	88.6	Confident	46 Å²	46	69.9 Å²	69.9	20%	0.2	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	138.2	174	-76.6	173.2	176.3	159.5	0	110.4	S188 I189 D191 H199 Y203 C239 Q529	S188-K201 WeakPolarHBondContact CA-O 3.26Å; I189-K201 PolarHBondContact N-O 2.94Å; I189-K201 PolarHBondContact O-N 2.91Å; D191-K201 HydrophobicContact CB-CD 4.37Å; D191-K201 WeakPolarHBondContact OD2-CE 3.39Å; D191-K201 IonicContact OD2-NZ 3.16Å; D191-K201 PolarHBondContact OD2-NZ 3.41Å; H199-K201 WeakPolarHBondContact NE2-CE 3.34Å; K201-Y203 HydrophobicContact CB-CE2 3.82Å; K201-C239 HydrophobicContact CD-CB 3.37Å; K201-Q529 HydrophobicContact CB-CG 4.48Å
202	H	93.9	Very high	88.3	Confident	3 Å²	3	70 Å²	70	1%	0.014	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.9	-178.8	-58.2	-96.6	0	0	0	110.1	R156 E160 R176 L187 S188 Y528 Q529	R156-H202 VanDerWaalsContact CG-CE1 3.49Å; R156-H202 WeakPolarHBondContact CG-CE1 3.31Å; R156-H202 PolarHBondContact NH2-CD2 3.42Å; E160-H202 WeakPolarHBondContact CG-NE2 3.43Å; E160-H202 IonicContact OE1-CD2 4Å; E160-H202 IonicContact OE1-CE1 2.83Å; E160-H202 IonicContact OE1-NE2 3.31Å; E160-H202 PolarHBondContact OE1-NE2 3.17Å; R176-H202 PolarHBondContact NH2-ND1 3.07Å; L187-H202 CarbonylContact O-C 3.59Å; L187-H202 WeakPolarHBondContact O-CA 3.49Å; S188-H202 PolarHBondContact OG-ND1 3.48Å; S188-H202 VanDerWaalsContact OG-ND1 3.17Å; H202-Y528 HydrophobicContact CB-CD1 4.13Å; H202-Y528 HydrophobicContact CB-CE1 4.28Å; H202-Q529 PolarHBondContact O-N 2.75Å; H202-Q529 VanDerWaalsContact O-N 3.12Å
203	Y	92.8	Very high	88.3	Confident	6 Å²	6	66.1 Å²	66.1	2%	0.024	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.5	177.5	-58	-92.6	0	0	0	109.1	S186 L187 I189 K201 I205 I215 L238 C239 Q529 L534	S186-Y203 CarbonylContact C-O 3.41Å; S186-Y203 WeakPolarHBondContact CA-O 3.49Å; L187-Y203 PolarHBondContact N-O 3.31Å; L187-Y203 PolarHBondContact O-N 2.82Å; I189-Y203 HydrophobicContact CD1-CD2 3.98Å; I189-Y203 HydrophobicContact CD1-CE2 3.73Å; I189-Y203 HydrophobicContact CG1-CD2 4.41Å; I189-Y203 HydrophobicContact CG1-CE2 4.31Å; K201-Y203 HydrophobicContact CB-CE2 3.82Å; Y203-I205 PolarHBondContact O-N 3.21Å; Y203-I215 HydrophobicContact CD1-CG2 4.21Å; Y203-I215 HydrophobicContact CG-CG2 4.49Å; Y203-L238 HydrophobicContact CD1-CD2 3.55Å; Y203-L238 HydrophobicContact CD2-CD2 3.91Å; Y203-L238 HydrophobicContact CE1-CD2 3.61Å; Y203-L238 HydrophobicContact CE2-CD2 3.98Å; Y203-L238 HydrophobicContact CG-CD2 3.71Å; Y203-C239 WeakPolarHBondContact OH-CB 3.33Å; Y203-C239 PolarHBondContact OH-N 3.38Å; Y203-C239 PolarHBondContact OH-SG 3.23Å; Y203-Q529 HydrophobicContact CD1-CB 3.81Å; Y203-Q529 HydrophobicContact CD1-CG 4.42Å; Y203-Q529 HydrophobicContact CE1-CB 3.59Å; Y203-Q529 HydrophobicContact CE1-CG 3.9Å; Y203-L534 HydrophobicContact CE1-CD1 4.48Å
204	K	91.8	Very high	88.3	Confident	40 Å²	40	65.9 Å²	65.9	17%	0.174	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	121.9	178	-171.4	173.7	-173.6	171.5	0	109.3	T181 R206 Y528	T181-K204 WeakPolarHBondContact OG1-CE 3.48Å; T181-K204 PolarHBondContact OG1-NZ 3.13Å; K204-R206 HydrophobicContact CG-CG 4.36Å; K204-Y528 HydrophobicContact CB-CD1 3.77Å; K204-Y528 HydrophobicContact CB-CE1 3.99Å; K204-Y528 HydrophobicContact CB-CG 4.16Å
205	I	92.6	Very high	88.2	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	116.5	171.3	-48	173.9	0	0	0	107.6	I175 Y185 L187 Y203 Y213 Y214 I215 L224 L227	I175-I205 HydrophobicContact CD1-CD1 3.72Å; I175-I205 HydrophobicContact CG1-CD1 4.18Å; I175-I205 HydrophobicContact CG2-CD1 4Å; Y185-I205 PolarHBondContact N-O 3.42Å; Y185-I205 VanDerWaalsContact N-O 3.14Å; Y185-I205 PolarHBondContact O-N 2.7Å; L187-I205 HydrophobicContact CB-CD1 4.03Å; L187-I205 HydrophobicContact CB-CG1 4.17Å; Y203-I205 PolarHBondContact O-N 3.21Å; I205-Y213 HydrophobicContact CG2-CD1 4.29Å; I205-Y214 WeakPolarHBondContact CA-O 3.46Å; I205-I215 HydrophobicContact CG1-CD1 4.28Å; I205-I215 HydrophobicContact CG1-CG1 3.98Å; I205-L224 HydrophobicContact CD1-CD2 3.96Å; I205-L224 HydrophobicContact CG2-CD2 3.75Å; I205-L227 HydrophobicContact CD1-CD1 4.47Å; I205-L227 HydrophobicContact CD1-CD2 4.38Å; I205-L227 HydrophobicContact CG2-CD1 3.76Å
206	R	86.5	Confident	88.2	Confident	126 Å²	126	51.3 Å²	51.3	48%	0.475	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	147	179.4	-65.8	177.2	-178.9	-116.3	4.8	109.7	K204 Y213 Y214	K204-R206 HydrophobicContact CG-CG 4.36Å; R206-Y213 VanDerWaalsContact O-CA 3.31Å; R206-Y213 WeakPolarHBondContact O-CA 3.29Å; R206-Y214 HydrophobicContact CB-CD1 4.12Å; R206-Y214 HydrophobicContact CB-CE1 3.58Å; R206-Y214 HydrophobicContact CB-CE2 4.12Å; R206-Y214 WeakPolarHBondContact CD-OH 3.45Å; R206-Y214 PolarHBondContact N-O 2.8Å; R206-Y214 PolarHBondContact O-N 3.04Å
207	K	86.8	Confident	88.1	Confident	114 Å²	114	50.7 Å²	50.7	50%	0.496	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	135.3	171.5	-165.8	172.1	-177.9	172.4	0	109.2	G212 Y213	K207-G212 CarbonylContact C-O 3.53Å; K207-G212 WeakPolarHBondContact CA-O 3.36Å; K207-Y213 HydrophobicContact CB-CD1 4.42Å; K207-Y213 HydrophobicContact CB-CE1 4.26Å; K207-Y213 HydrophobicContact CD-CE1 4.11Å; K207-Y213 HydrophobicContact CG-CD1 4.4Å; K207-Y213 HydrophobicContact CG-CE1 3.95Å
208	L	84.4	Confident	87.8	Confident	38 Å²	38	58.6 Å²	58.6	20%	0.199	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-82.2	152.9	171.8	-66.2	164	0	0	0	109.8	N210 G211 G212 Y214 Q220	L208-N210 WeakPolarHBondContact CB-OD1 3.3Å; L208-N210 PolarHBondContact O-N 2.83Å; L208-N210 VanDerWaalsContact O-N 3.16Å; L208-G211 PolarHBondContact O-N 3.04Å; L208-G212 PolarHBondContact N-O 2.81Å; L208-Y214 HydrophobicContact CD1-CD1 4.25Å; L208-Y214 HydrophobicContact CD2-CD1 3.69Å; L208-Y214 HydrophobicContact CD2-CE1 3.39Å; L208-Y214 HydrophobicContact CG-CD1 3.67Å; L208-Y214 HydrophobicContact CG-CE1 3.77Å; L208-Q220 HydrophobicContact CD1-CB 4.25Å; L208-Q220 HydrophobicContact CD1-CG 4.21Å
209	D	84	Confident	87.6	Confident	182 Å²	182	55.1 Å²	55.1	97%	0.973	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-26.9	178.3	-61.3	-28.4	0	0	0	112.5	G211	D209-G211 VanDerWaalsContact C-N 3.33Å
210	N	83.7	Confident	87.7	Confident	136 Å²	136	59.4 Å²	59.4	73%	0.727	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	3.2	177.3	69	-5.3	0	0	0	114.3	L208 G212	L208-N210 WeakPolarHBondContact CB-OD1 3.3Å; L208-N210 PolarHBondContact O-N 2.83Å; L208-N210 VanDerWaalsContact O-N 3.16Å; N210-G212 PolarHBondContact OD1-N 3.36Å
211	G	80.4	Confident	87.8	Confident	33 Å²	33	59.6 Å²	59.6	34%	0.34	29%	0.29	S	S	.	.	S	Bend	trans	101.9	-4.2	173.5	0	0	0	0	0	116.8	L208 D209	L208-G211 PolarHBondContact O-N 3.04Å; D209-G211 VanDerWaalsContact C-N 3.33Å
212	G	88.7	Confident	87.8	Confident	7 Å²	7	64.4 Å²	64.4	7%	0.072	31%	0.314	C	S	.	.			trans	-85.6	178.4	177	0	0	0	0	0	115.2	K207 L208 N210 F221	K207-G212 CarbonylContact C-O 3.53Å; K207-G212 WeakPolarHBondContact CA-O 3.36Å; L208-G212 PolarHBondContact N-O 2.81Å; N210-G212 PolarHBondContact OD1-N 3.36Å; G212-F221 CarbonylContact C-O 3.56Å; G212-F221 WeakPolarHBondContact CA-O 3.17Å
213	Y	92.2	Very high	87.8	Confident	30 Å²	30	66.7 Å²	66.7	12%	0.118	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	147.4	-175.4	-58.9	-82.9	0	0	0	112	Y185 I205 R206 K207 F221 L224	Y185-Y213 HydrophobicContact CD2-CD1 4.37Å; Y185-Y213 HydrophobicContact CD2-CE1 4.04Å; Y185-Y213 HydrophobicContact CE2-CD1 4.5Å; Y185-Y213 AromaticContact CE2-CE1 3.73Å; Y185-Y213 HydrophobicContact CE2-CE1 3.73Å; I205-Y213 HydrophobicContact CG2-CD1 4.29Å; R206-Y213 VanDerWaalsContact O-CA 3.31Å; R206-Y213 WeakPolarHBondContact O-CA 3.29Å; K207-Y213 HydrophobicContact CB-CD1 4.42Å; K207-Y213 HydrophobicContact CB-CE1 4.26Å; K207-Y213 HydrophobicContact CD-CE1 4.11Å; K207-Y213 HydrophobicContact CG-CD1 4.4Å; K207-Y213 HydrophobicContact CG-CE1 3.95Å; Y213-F221 PolarHBondContact N-O 3.46Å; Y213-F221 PolarHBondContact O-N 3.32Å; Y213-L224 HydrophobicContact CD1-CD2 3.76Å; Y213-L224 HydrophobicContact CD1-CG 4.01Å; Y213-L224 HydrophobicContact CD2-CD2 4.3Å; Y213-L224 HydrophobicContact CD2-CG 4.01Å; Y213-L224 HydrophobicContact CE1-CD1 4.34Å; Y213-L224 HydrophobicContact CE1-CD2 4.37Å; Y213-L224 HydrophobicContact CE1-CG 4.19Å; Y213-L224 HydrophobicContact CE2-CG 4.18Å; Y213-L224 HydrophobicContact CG-CD2 3.72Å; Y213-L224 HydrophobicContact CG-CG 3.92Å
214	Y	89.8	Confident	87.8	Confident	40 Å²	40	66.6 Å²	66.6	16%	0.157	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	156.3	174.7	69.2	-79.5	0	0	0	112.5	I205 R206 L208 T217 A219	I205-Y214 WeakPolarHBondContact CA-O 3.46Å; R206-Y214 HydrophobicContact CB-CD1 4.12Å; R206-Y214 HydrophobicContact CB-CE1 3.58Å; R206-Y214 HydrophobicContact CB-CE2 4.12Å; R206-Y214 WeakPolarHBondContact CD-OH 3.45Å; R206-Y214 PolarHBondContact N-O 2.8Å; R206-Y214 PolarHBondContact O-N 3.04Å; L208-Y214 HydrophobicContact CD1-CD1 4.25Å; L208-Y214 HydrophobicContact CD2-CD1 3.69Å; L208-Y214 HydrophobicContact CD2-CE1 3.39Å; L208-Y214 HydrophobicContact CG-CD1 3.67Å; L208-Y214 HydrophobicContact CG-CE1 3.77Å; Y214-T217 HydrophobicContact CD2-CG2 4.26Å; Y214-T217 HydrophobicContact CE2-CG2 3.8Å; Y214-A219 WeakPolarHBondContact CB-O 3.29Å
215	I	87.9	Confident	87.9	Confident	13 Å²	13	68.1 Å²	68.1	7%	0.067	34%	0.335	C	S	.	.	S	Bend	trans	-103	-48.7	166.3	-66.1	173.4	0	0	0	109.4	L187 Y203 I205 L227 Y231 L238 L534	L187-I215 HydrophobicContact CB-CD1 4.39Å; L187-I215 HydrophobicContact CD2-CD1 3.64Å; Y203-I215 HydrophobicContact CD1-CG2 4.21Å; Y203-I215 HydrophobicContact CG-CG2 4.49Å; I205-I215 HydrophobicContact CG1-CD1 4.28Å; I205-I215 HydrophobicContact CG1-CG1 3.98Å; I215-L227 HydrophobicContact CD1-CD2 4.36Å; I215-L227 HydrophobicContact CG1-CD1 4.35Å; I215-Y231 HydrophobicContact CD1-CD2 4.36Å; I215-Y231 HydrophobicContact CD1-CE2 3.81Å; I215-Y231 HydrophobicContact CG1-CE2 4.46Å; I215-L238 HydrophobicContact CD1-CD2 4.14Å; I215-L238 HydrophobicContact CG2-CD2 4.48Å; I215-L534 HydrophobicContact CG2-CD1 4.41Å
216	T	82.3	Confident	88.1	Confident	7 Å²	7	72 Å²	72	4%	0.043	35%	0.354	C	S	.	.	S	Bend	trans	-110.5	144.6	170.5	174.7	0	0	0	0	109.8	R218 A219	T216-R218 HydrophobicContact CG2-CB 4.33Å; T216-R218 PolarHBondContact O-N 3.36Å; T216-R218 VanDerWaalsContact O-N 3.11Å; T216-R218 PolarHBondContact OG1-N 3.21Å; T216-A219 HydrophobicContact CG2-CB 4.07Å; T216-A219 PolarHBondContact O-N 3Å; T216-A219 VanDerWaalsContact O-N 3.16Å
217	T	79.5	Confident	88.5	Confident	96 Å²	96	66 Å²	66	59%	0.589	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.8	-179.8	51	0	0	0	0	113.2	Y214 Q220	Y214-T217 HydrophobicContact CD2-CG2 4.26Å; Y214-T217 HydrophobicContact CE2-CG2 3.8Å; T217-Q220 PolarHBondContact O-NE2 2.9Å; T217-Q220 VanDerWaalsContact O-NE2 3.1Å
218	R	81.8	Confident	88.9	Confident	189 Å²	189	61.1 Å²	61.1	71%	0.713	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-23.7	177.2	-61.4	176.4	-179	172.1	-2.9	113.6	T216 L534	T216-R218 HydrophobicContact CG2-CB 4.33Å; T216-R218 PolarHBondContact O-N 3.36Å; T216-R218 VanDerWaalsContact O-N 3.11Å; T216-R218 PolarHBondContact OG1-N 3.21Å; R218-L534 PolarHBondContact NH1-O 2.87Å
219	A	85.7	Confident	89.5	Confident	12 Å²	12	64.6 Å²	64.6	10%	0.099	33%	0.326	C	S	.	.	S	Bend	trans	-131.5	106.1	-177.5	0	0	0	0	0	109.7	Y214 T216 F221	Y214-A219 WeakPolarHBondContact CB-O 3.29Å; T216-A219 HydrophobicContact CG2-CB 4.07Å; T216-A219 PolarHBondContact O-N 3Å; T216-A219 VanDerWaalsContact O-N 3.16Å; A219-F221 HydrophobicContact CB-CE2 4.08Å; A219-F221 HydrophobicContact CB-CZ 3.97Å
220	Q	91.9	Very high	90	Very high	112 Å²	112	57.7 Å²	57.7	52%	0.523	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	143.3	-178	-59.3	174.6	27.1	0	0	109.4	L208 T217	L208-Q220 HydrophobicContact CD1-CB 4.25Å; L208-Q220 HydrophobicContact CD1-CG 4.21Å; T217-Q220 PolarHBondContact O-NE2 2.9Å; T217-Q220 VanDerWaalsContact O-NE2 3.1Å
221	F	94.2	Very high	90.6	Very high	21 Å²	21	51.2 Å²	51.2	9%	0.092	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	146.1	-173.8	-53.1	-80.5	0	0	0	109.7	G212 Y213 A219 T223 Q226 L227 H230 Y231	G212-F221 CarbonylContact C-O 3.56Å; G212-F221 WeakPolarHBondContact CA-O 3.17Å; Y213-F221 PolarHBondContact N-O 3.46Å; Y213-F221 PolarHBondContact O-N 3.32Å; A219-F221 HydrophobicContact CB-CE2 4.08Å; A219-F221 HydrophobicContact CB-CZ 3.97Å; F221-T223 WeakPolarHBondContact CB-O 3.49Å; F221-Q226 HydrophobicContact CB-CB 4.12Å; F221-Q226 HydrophobicContact CD1-CB 4.16Å; F221-L227 HydrophobicContact CB-CB 4.1Å; F221-L227 HydrophobicContact CD1-CB 4.47Å; F221-L227 HydrophobicContact CD2-CB 3.58Å; F221-L227 HydrophobicContact CD2-CD1 3.84Å; F221-L227 HydrophobicContact CD2-CG 3.73Å; F221-L227 HydrophobicContact CE2-CB 4.09Å; F221-L227 HydrophobicContact CE2-CD1 4.23Å; F221-L227 HydrophobicContact CE2-CG 3.89Å; F221-L227 HydrophobicContact CG-CB 3.78Å; F221-L227 HydrophobicContact CG-CG 4.44Å; F221-H230 HydrophobicContact CD1-CB 4.48Å; F221-H230 HydrophobicContact CE1-CB 3.48Å; F221-H230 VanDerWaalsContact CE1-CB 3.48Å; F221-H230 AromaticContact CE1-CG 3.59Å; F221-H230 AromaticContact CE1-ND1 3.75Å; F221-H230 HydrophobicContact CZ-CB 3.77Å; F221-H230 AromaticContact CZ-CD2 3.66Å; F221-H230 AromaticContact CZ-CG 3.56Å; F221-H230 AromaticContact CZ-ND1 3.91Å; F221-Y231 HydrophobicContact CE2-CE2 4.03Å; F221-Y231 HydrophobicContact CZ-CE2 4.33Å
222	E	93.5	Very high	91.3	Very high	148 Å²	148	51.8 Å²	51.8	69%	0.692	25%	0.252	S	S	*	.	S	Bend	trans	-74.9	-33.2	177	-62.4	178.2	163.3	0	0	110.9
223	T	93.1	Very high	91.6	Very high	50 Å²	50	57.7 Å²	57.7	31%	0.307	28%	0.277	S	S	.	.	S	Bend	trans	-131.9	159.7	-178.8	73.7	0	0	0	0	111.7	F221 Q225 Q226 L227	F221-T223 WeakPolarHBondContact CB-O 3.49Å; T223-Q225 VanDerWaalsContact C-N 3.28Å; T223-Q225 VanDerWaalsContact CB-OE1 3.31Å; T223-Q225 PolarHBondContact O-N 2.78Å; T223-Q225 PolarHBondContact OG1-OE1 3.01Å; T223-Q226 PolarHBondContact O-N 3.32Å; T223-Q226 WeakPolarHBondContact OG1-CG 3.24Å; T223-Q226 PolarHBondContact OG1-N 2.89Å; T223-L227 PolarHBondContact O-N 2.91Å
224	L	93.5	Very high	91.6	Very high	5 Å²	5	60.7 Å²	60.7	3%	0.026	29%	0.291	C	S	.	.	H	α-helix	trans	-69	-29	175.3	-72	169.8	0	0	0	112.1	I144 W149 Y185 I205 Y213 Q226 L227 V228	I144-L224 HydrophobicContact CD1-CD1 3.24Å; I144-L224 HydrophobicContact CG1-CD1 4.24Å; W149-L224 HydrophobicContact CH2-CB 3.54Å; W149-L224 HydrophobicContact CH2-CD1 4.45Å; W149-L224 HydrophobicContact CZ2-CB 4.36Å; W149-L224 HydrophobicContact CZ3-CB 4.26Å; Y185-L224 HydrophobicContact CD2-CD1 3.83Å; Y185-L224 HydrophobicContact CD2-CD2 4.5Å; Y185-L224 HydrophobicContact CE1-CD1 4.48Å; Y185-L224 HydrophobicContact CE2-CD1 3.8Å; Y185-L224 HydrophobicContact CG-CD1 4.19Å; I205-L224 HydrophobicContact CD1-CD2 3.96Å; I205-L224 HydrophobicContact CG2-CD2 3.75Å; Y213-L224 HydrophobicContact CD1-CD2 3.76Å; Y213-L224 HydrophobicContact CD1-CG 4.01Å; Y213-L224 HydrophobicContact CD2-CD2 4.3Å; Y213-L224 HydrophobicContact CD2-CG 4.01Å; Y213-L224 HydrophobicContact CE1-CD1 4.34Å; Y213-L224 HydrophobicContact CE1-CD2 4.37Å; Y213-L224 HydrophobicContact CE1-CG 4.19Å; Y213-L224 HydrophobicContact CE2-CG 4.18Å; Y213-L224 HydrophobicContact CG-CD2 3.72Å; Y213-L224 HydrophobicContact CG-CG 3.92Å; L224-Q226 VanDerWaalsContact C-N 3.33Å; L224-Q226 PolarHBondContact O-N 2.87Å; L224-L227 HydrophobicContact CD2-CD1 4.36Å; L224-L227 WeakPolarHBondContact O-CB 3.34Å; L224-L227 PolarHBondContact O-N 3.05Å; L224-V228 WeakPolarHBondContact O-CG2 3.43Å; L224-V228 PolarHBondContact O-N 2.83Å
225	Q	94.4	Very high	91.6	Very high	72 Å²	72	59.9 Å²	59.9	34%	0.336	29%	0.292	S	S	.	.	H	α-helix	trans	-59	-45.2	173	-66.2	81.2	-8.6	0	0	111	E147 W149 T223 L227 V228 Q229	E147-Q225 HydrophobicContact CG-CG 4.5Å; E147-Q225 VanDerWaalsContact OE1-CG 3.25Å; E147-Q225 WeakPolarHBondContact OE1-CG 3.12Å; E147-Q225 PolarHBondContact OE1-NE2 3.35Å; W149-Q225 HydrophobicContact CZ2-CG 4.15Å; T223-Q225 VanDerWaalsContact C-N 3.28Å; T223-Q225 VanDerWaalsContact CB-OE1 3.31Å; T223-Q225 PolarHBondContact O-N 2.78Å; T223-Q225 PolarHBondContact OG1-OE1 3.01Å; Q225-L227 VanDerWaalsContact C-N 3.34Å; Q225-L227 PolarHBondContact O-N 3.11Å; Q225-V228 PolarHBondContact O-N 3.49Å; Q225-Q229 WeakPolarHBondContact O-CB 3.46Å; Q225-Q229 PolarHBondContact O-N 3.06Å
226	Q	95.2	Very high	91.6	Very high	82 Å²	82	62.3 Å²	62.3	38%	0.383	31%	0.305	S	S	.	.	H	α-helix	trans	-63.4	-40.2	175.6	-71.9	173.3	-0.5	0	0	111.8	F221 T223 L224 Q229 H230	F221-Q226 HydrophobicContact CB-CB 4.12Å; F221-Q226 HydrophobicContact CD1-CB 4.16Å; T223-Q226 PolarHBondContact O-N 3.32Å; T223-Q226 WeakPolarHBondContact OG1-CG 3.24Å; T223-Q226 PolarHBondContact OG1-N 2.89Å; L224-Q226 VanDerWaalsContact C-N 3.33Å; L224-Q226 PolarHBondContact O-N 2.87Å; Q226-Q229 PolarHBondContact O-N 2.96Å; Q226-H230 WeakPolarHBondContact O-CB 3.2Å; Q226-H230 PolarHBondContact O-N 3.24Å
227	L	95.6	Very high	91.7	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60	-47.9	175.1	-177.4	156	0	0	0	111.3	I205 I215 F221 T223 L224 Q225 H230 Y231	I205-L227 HydrophobicContact CD1-CD1 4.47Å; I205-L227 HydrophobicContact CD1-CD2 4.38Å; I205-L227 HydrophobicContact CG2-CD1 3.76Å; I215-L227 HydrophobicContact CD1-CD2 4.36Å; I215-L227 HydrophobicContact CG1-CD1 4.35Å; F221-L227 HydrophobicContact CB-CB 4.1Å; F221-L227 HydrophobicContact CD1-CB 4.47Å; F221-L227 HydrophobicContact CD2-CB 3.58Å; F221-L227 HydrophobicContact CD2-CD1 3.84Å; F221-L227 HydrophobicContact CD2-CG 3.73Å; F221-L227 HydrophobicContact CE2-CB 4.09Å; F221-L227 HydrophobicContact CE2-CD1 4.23Å; F221-L227 HydrophobicContact CE2-CG 3.89Å; F221-L227 HydrophobicContact CG-CB 3.78Å; F221-L227 HydrophobicContact CG-CG 4.44Å; T223-L227 PolarHBondContact O-N 2.91Å; L224-L227 HydrophobicContact CD2-CD1 4.36Å; L224-L227 WeakPolarHBondContact O-CB 3.34Å; L224-L227 PolarHBondContact O-N 3.05Å; Q225-L227 VanDerWaalsContact C-N 3.34Å; Q225-L227 PolarHBondContact O-N 3.11Å; L227-H230 PolarHBondContact O-N 2.9Å; L227-Y231 HydrophobicContact CD2-CD2 3.73Å; L227-Y231 HydrophobicContact CD2-CE2 4.12Å; L227-Y231 HydrophobicContact CG-CD2 3.91Å; L227-Y231 HydrophobicContact CG-CE2 3.96Å; L227-Y231 VanDerWaalsContact O-CD2 3.27Å; L227-Y231 WeakPolarHBondContact O-CD2 3.25Å; L227-Y231 PolarHBondContact O-N 2.77Å; L227-Y231 VanDerWaalsContact O-N 3.11Å
228	V	96	Very high	92.3	Very high	11 Å²	11	59.5 Å²	59.5	7%	0.067	29%	0.294	C	S	.	.	H	α-helix	trans	-64.2	-44.9	179.4	171.5	0	0	0	0	110.9	W149 F173 I175 L224 Q225 H230 Y231 S232 L242	W149-V228 HydrophobicContact CD2-CG2 3.88Å; W149-V228 HydrophobicContact CE3-CG2 4.11Å; W149-V228 HydrophobicContact CG-CG1 4.45Å; W149-V228 HydrophobicContact CG-CG2 4.42Å; W149-V228 HydrophobicContact CH2-CG2 4.36Å; W149-V228 HydrophobicContact CZ2-CG2 4.12Å; W149-V228 HydrophobicContact CZ3-CG2 4.36Å; F173-V228 HydrophobicContact CE2-CG1 3.81Å; F173-V228 HydrophobicContact CE2-CG2 4.3Å; F173-V228 HydrophobicContact CZ-CG1 3.69Å; I175-V228 HydrophobicContact CD1-CG2 3.54Å; L224-V228 WeakPolarHBondContact O-CG2 3.43Å; L224-V228 PolarHBondContact O-N 2.83Å; Q225-V228 PolarHBondContact O-N 3.49Å; V228-H230 PolarHBondContact O-N 3.42Å; V228-Y231 PolarHBondContact O-N 3.12Å; V228-S232 WeakPolarHBondContact O-CB 3.42Å; V228-S232 PolarHBondContact O-N 2.97Å; V228-S232 PolarHBondContact O-OG 3.42Å; V228-L242 HydrophobicContact CG1-CD1 4.26Å
229	Q	95.4	Very high	92.7	Very high	110 Å²	110	51.7 Å²	51.7	51%	0.514	27%	0.269	S	S	.	.	H	α-helix	trans	-56.9	-49.5	177.5	-177.7	61.9	29.4	0	0	111.4	Q225 Q226 Y231 S232 E233	Q225-Q229 WeakPolarHBondContact O-CB 3.46Å; Q225-Q229 PolarHBondContact O-N 3.06Å; Q226-Q229 PolarHBondContact O-N 2.96Å; Q229-Y231 PolarHBondContact O-N 3.41Å; Q229-S232 WeakPolarHBondContact O-CB 3.42Å; Q229-S232 PolarHBondContact O-N 3.09Å; Q229-E233 PolarHBondContact NE2-OE1 3.41Å; Q229-E233 PolarHBondContact O-N 3.4Å
230	H	95.5	Very high	93.2	Very high	37 Å²	37	54 Å²	54	17%	0.171	28%	0.277	C	S	.	.	H	α-helix	trans	-58.2	-48.7	179.2	175.5	105.1	0	0	0	112.6	F221 Q226 L227 V228 S232 E233 K234 D236	F221-H230 HydrophobicContact CD1-CB 4.48Å; F221-H230 HydrophobicContact CE1-CB 3.48Å; F221-H230 VanDerWaalsContact CE1-CB 3.48Å; F221-H230 AromaticContact CE1-CG 3.59Å; F221-H230 AromaticContact CE1-ND1 3.75Å; F221-H230 HydrophobicContact CZ-CB 3.77Å; F221-H230 AromaticContact CZ-CD2 3.66Å; F221-H230 AromaticContact CZ-CG 3.56Å; F221-H230 AromaticContact CZ-ND1 3.91Å; Q226-H230 WeakPolarHBondContact O-CB 3.2Å; Q226-H230 PolarHBondContact O-N 3.24Å; L227-H230 PolarHBondContact O-N 2.9Å; V228-H230 PolarHBondContact O-N 3.42Å; H230-S232 VanDerWaalsContact C-N 3.25Å; H230-S232 PolarHBondContact O-N 2.92Å; H230-E233 PolarHBondContact O-N 2.85Å; H230-K234 WeakPolarHBondContact CE1-CE 3.39Å; H230-K234 PolarHBondContact CE1-NZ 3.24Å; H230-K234 PolarHBondContact O-N 2.91Å; H230-K234 VanDerWaalsContact O-N 3.1Å; H230-D236 IonicContact CE1-OD2 3.67Å; H230-D236 PolarHBondContact CE1-OD2 3.31Å; H230-D236 IonicContact NE2-OD2 3.46Å; H230-D236 PolarHBondContact NE2-OD2 2.99Å
231	Y	95.6	Very high	93.3	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-75.6	-14.6	-178.4	-74.8	-60.7	0	0	0	113.8	I215 F221 L227 V228 Q229 K234 A235 D236 L238 L242	I215-Y231 HydrophobicContact CD1-CD2 4.36Å; I215-Y231 HydrophobicContact CD1-CE2 3.81Å; I215-Y231 HydrophobicContact CG1-CE2 4.46Å; F221-Y231 HydrophobicContact CE2-CE2 4.03Å; F221-Y231 HydrophobicContact CZ-CE2 4.33Å; L227-Y231 HydrophobicContact CD2-CD2 3.73Å; L227-Y231 HydrophobicContact CD2-CE2 4.12Å; L227-Y231 HydrophobicContact CG-CD2 3.91Å; L227-Y231 HydrophobicContact CG-CE2 3.96Å; L227-Y231 VanDerWaalsContact O-CD2 3.27Å; L227-Y231 WeakPolarHBondContact O-CD2 3.25Å; L227-Y231 PolarHBondContact O-N 2.77Å; L227-Y231 VanDerWaalsContact O-N 3.11Å; V228-Y231 PolarHBondContact O-N 3.12Å; Q229-Y231 PolarHBondContact O-N 3.41Å; Y231-K234 CarbonylContact C-O 3.53Å; Y231-K234 VanDerWaalsContact CA-O 3.29Å; Y231-K234 WeakPolarHBondContact CA-O 3.36Å; Y231-A235 VanDerWaalsContact CD1-O 3.25Å; Y231-A235 WeakPolarHBondContact CD1-O 3.45Å; Y231-A235 VanDerWaalsContact CE1-O 3.31Å; Y231-A235 WeakPolarHBondContact CE1-O 3.45Å; Y231-D236 HydrophobicContact CD1-CB 4.34Å; Y231-D236 HydrophobicContact CE1-CB 3.92Å; Y231-L238 HydrophobicContact CD1-CD1 3.23Å; Y231-L238 HydrophobicContact CD1-CG 3.6Å; Y231-L238 HydrophobicContact CD2-CD1 4.06Å; Y231-L238 HydrophobicContact CE1-CD1 3.73Å; Y231-L238 HydrophobicContact CE1-CD2 4.31Å; Y231-L238 HydrophobicContact CE1-CG 3.61Å; Y231-L238 HydrophobicContact CE2-CD1 4.48Å; Y231-L238 HydrophobicContact CG-CD1 3.41Å; Y231-L238 VanDerWaalsContact CG-CD1 3.41Å; Y231-L238 HydrophobicContact CG-CG 4.25Å; Y231-L242 PolarHBondContact O-N 3.34Å
232	S	95.7	Very high	93.4	Very high	45 Å²	45	50.7 Å²	50.7	32%	0.315	26%	0.263	S	S	.	.	H	α-helix	trans	-74.4	-36.4	169.2	-56	0	0	0	0	111.7	V228 Q229 H230 L242	V228-S232 WeakPolarHBondContact O-CB 3.42Å; V228-S232 PolarHBondContact O-N 2.97Å; V228-S232 PolarHBondContact O-OG 3.42Å; Q229-S232 WeakPolarHBondContact O-CB 3.42Å; Q229-S232 PolarHBondContact O-N 3.09Å; H230-S232 VanDerWaalsContact C-N 3.25Å; H230-S232 PolarHBondContact O-N 2.92Å; S232-L242 WeakPolarHBondContact CA-O 3.43Å
233	E	94.9	Very high	93.4	Very high	131 Å²	131	47 Å²	47	61%	0.612	25%	0.251	S	S	*	.	H	α-helix	trans	-76.1	-39.4	178	-68.7	173.7	-167.9	0	0	112.5	Q229 H230	Q229-E233 PolarHBondContact NE2-OE1 3.41Å; Q229-E233 PolarHBondContact O-N 3.4Å; H230-E233 PolarHBondContact O-N 2.85Å
234	K	92.5	Very high	93.4	Very high	94 Å²	94	47.7 Å²	47.7	41%	0.409	26%	0.255	S	S	.	.			trans	-148	144	-178.9	52.3	168.6	175	149.6	0	112.3	H230 Y231 D236	H230-K234 WeakPolarHBondContact CE1-CE 3.39Å; H230-K234 PolarHBondContact CE1-NZ 3.24Å; H230-K234 PolarHBondContact O-N 2.91Å; H230-K234 VanDerWaalsContact O-N 3.1Å; Y231-K234 CarbonylContact C-O 3.53Å; Y231-K234 VanDerWaalsContact CA-O 3.29Å; Y231-K234 WeakPolarHBondContact CA-O 3.36Å; K234-D236 VanDerWaalsContact C-N 3.34Å; K234-D236 HydrophobicContact CD-CB 4.13Å; K234-D236 HydrophobicContact CG-CB 4.24Å; K234-D236 IonicContact NZ-OD1 2.75Å; K234-D236 IonicContact NZ-OD2 3.76Å; K234-D236 PolarHBondContact NZ-OD2 2.89Å; K234-D236 PolarHBondContact O-N 2.96Å
235	A	89.1	Confident	93.3	Very high	22 Å²	22	50 Å²	50	18%	0.182	27%	0.267	C	S	.	.			trans	-62.7	-38.1	178.1	0	0	0	0	0	113.3	Y231 G237 L238 N241	Y231-A235 VanDerWaalsContact CD1-O 3.25Å; Y231-A235 WeakPolarHBondContact CD1-O 3.45Å; Y231-A235 VanDerWaalsContact CE1-O 3.31Å; Y231-A235 WeakPolarHBondContact CE1-O 3.45Å; A235-G237 VanDerWaalsContact C-N 3.25Å; A235-G237 PolarHBondContact O-N 3.39Å; A235-G237 VanDerWaalsContact O-N 3.12Å; A235-L238 VanDerWaalsContact O-CB 3.26Å; A235-L238 WeakPolarHBondContact O-CB 3.27Å; A235-L238 VanDerWaalsContact O-CG 3.31Å; A235-L238 WeakPolarHBondContact O-CG 3.35Å; A235-L238 PolarHBondContact O-N 3.2Å; A235-N241 WeakPolarHBondContact CB-OD1 3.45Å
236	D	88.2	Confident	92.9	Very high	64 Å²	64	46.7 Å²	46.7	34%	0.342	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.2	49.9	176.6	-147.1	12.5	0	0	0	113.7	H230 Y231 K234	H230-D236 IonicContact CE1-OD2 3.67Å; H230-D236 PolarHBondContact CE1-OD2 3.31Å; H230-D236 IonicContact NE2-OD2 3.46Å; H230-D236 PolarHBondContact NE2-OD2 2.99Å; Y231-D236 HydrophobicContact CD1-CB 4.34Å; Y231-D236 HydrophobicContact CE1-CB 3.92Å; K234-D236 VanDerWaalsContact C-N 3.34Å; K234-D236 HydrophobicContact CD-CB 4.13Å; K234-D236 HydrophobicContact CG-CB 4.24Å; K234-D236 IonicContact NZ-OD1 2.75Å; K234-D236 IonicContact NZ-OD2 3.76Å; K234-D236 PolarHBondContact NZ-OD2 2.89Å; K234-D236 PolarHBondContact O-N 2.96Å
237	G	84.2	Confident	92	Very high	33 Å²	33	47 Å²	47	34%	0.34	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	98	-24.2	-177.5	0	0	0	0	0	114.9	A235 L534	A235-G237 VanDerWaalsContact C-N 3.25Å; A235-G237 PolarHBondContact O-N 3.39Å; A235-G237 VanDerWaalsContact O-N 3.12Å; G237-L534 WeakPolarHBondContact O-CD2 3.48Å
238	L	91.6	Very high	90.8	Very high	11 Å²	11	49 Å²	49	6%	0.058	28%	0.277	C	S	.	.	S	Bend	trans	-60.6	157.2	172.6	-58.5	-177.8	0	0	0	111.5	L187 I189 Y203 I215 Y231 A235 F240 L242	L187-L238 HydrophobicContact CD2-CD1 3.88Å; I189-L238 HydrophobicContact CD1-CB 4.39Å; I189-L238 HydrophobicContact CD1-CD1 3.86Å; Y203-L238 HydrophobicContact CD1-CD2 3.55Å; Y203-L238 HydrophobicContact CD2-CD2 3.91Å; Y203-L238 HydrophobicContact CE1-CD2 3.61Å; Y203-L238 HydrophobicContact CE2-CD2 3.98Å; Y203-L238 HydrophobicContact CG-CD2 3.71Å; I215-L238 HydrophobicContact CD1-CD2 4.14Å; I215-L238 HydrophobicContact CG2-CD2 4.48Å; Y231-L238 HydrophobicContact CD1-CD1 3.23Å; Y231-L238 HydrophobicContact CD1-CG 3.6Å; Y231-L238 HydrophobicContact CD2-CD1 4.06Å; Y231-L238 HydrophobicContact CE1-CD1 3.73Å; Y231-L238 HydrophobicContact CE1-CD2 4.31Å; Y231-L238 HydrophobicContact CE1-CG 3.61Å; Y231-L238 HydrophobicContact CE2-CD1 4.48Å; Y231-L238 HydrophobicContact CG-CD1 3.41Å; Y231-L238 VanDerWaalsContact CG-CD1 3.41Å; Y231-L238 HydrophobicContact CG-CG 4.25Å; A235-L238 VanDerWaalsContact O-CB 3.26Å; A235-L238 WeakPolarHBondContact O-CB 3.27Å; A235-L238 VanDerWaalsContact O-CG 3.31Å; A235-L238 WeakPolarHBondContact O-CG 3.35Å; A235-L238 PolarHBondContact O-N 3.2Å; L238-F240 PolarHBondContact O-N 3.06Å; L238-L242 HydrophobicContact CD1-CD2 4.42Å
239	C	91.8	Very high	89.5	Confident	26 Å²	26	53.6 Å²	53.6	18%	0.176	31%	0.309	C	S	.	.	S	Bend	trans	-60.8	-26.8	178.1	57.6	0	0	0	0	114.1	D191 K201 Y203	D191-C239 VanDerWaalsContact OD2-CB 3.28Å; D191-C239 WeakPolarHBondContact OD2-CB 3.02Å; K201-C239 HydrophobicContact CD-CB 3.37Å; Y203-C239 WeakPolarHBondContact OH-CB 3.33Å; Y203-C239 PolarHBondContact OH-N 3.38Å; Y203-C239 PolarHBondContact OH-SG 3.23Å
240	F	94.3	Very high	88.7	Confident	61 Å²	61	52.3 Å²	52.3	27%	0.268	31%	0.308	S	S	.	.	S	Bend	trans	-161.8	158.9	175.8	-154.1	-104.5	0	0	0	109.7	R170 L238 T243	R170-F240 HydrophobicContact CG-CB 4.49Å; R170-F240 HydrophobicContact CG-CD1 4.1Å; R170-F240 HydrophobicContact CG-CD2 4.14Å; R170-F240 HydrophobicContact CG-CE1 4.35Å; R170-F240 HydrophobicContact CG-CE2 4.4Å; R170-F240 HydrophobicContact CG-CG 3.98Å; R170-F240 HydrophobicContact CG-CZ 4.5Å; L238-F240 PolarHBondContact O-N 3.06Å; F240-T243 HydrophobicContact CD1-CG2 4.2Å; F240-T243 HydrophobicContact CE1-CG2 3.8Å
241	N	94.8	Very high	88.1	Confident	57 Å²	57	52.3 Å²	52.3	31%	0.305	31%	0.312	S	S	.	.			trans	-64.5	151.1	173.4	-44.6	27.7	0	0	0	109.8	G171 A235 T243	G171-N241 WeakPolarHBondContact CA-O 3.33Å; A235-N241 WeakPolarHBondContact CB-OD1 3.45Å; N241-T243 PolarHBondContact O-N 2.89Å
242	L	96.8	Very high	87.4	Confident	5 Å²	5	55.9 Å²	55.9	3%	0.026	33%	0.328	C	S	.	.			trans	-74.3	117.8	172.7	-52.9	-177.2	0	0	0	108.9	F173 L187 I189 V228 Y231 S232 L238	F173-L242 HydrophobicContact CB-CD2 3.74Å; F173-L242 HydrophobicContact CD1-CB 3.65Å; F173-L242 HydrophobicContact CD1-CD2 4.14Å; F173-L242 HydrophobicContact CD1-CG 4.31Å; F173-L242 HydrophobicContact CD2-CB 4.49Å; F173-L242 HydrophobicContact CD2-CD1 3.95Å; F173-L242 HydrophobicContact CD2-CD2 4.07Å; F173-L242 HydrophobicContact CD2-CG 4.38Å; F173-L242 HydrophobicContact CE1-CB 3.69Å; F173-L242 HydrophobicContact CE2-CD1 3.89Å; F173-L242 HydrophobicContact CG-CB 4.07Å; F173-L242 HydrophobicContact CG-CD1 4.29Å; F173-L242 HydrophobicContact CG-CD2 3.71Å; F173-L242 HydrophobicContact CG-CG 4.22Å; F173-L242 HydrophobicContact CZ-CB 4.14Å; F173-L242 HydrophobicContact CZ-CD1 4.2Å; L187-L242 HydrophobicContact CD1-CD1 4.38Å; L187-L242 HydrophobicContact CD1-CD2 4.07Å; L187-L242 HydrophobicContact CD2-CD2 4.21Å; I189-L242 HydrophobicContact CD1-CD2 3.56Å; I189-L242 HydrophobicContact CG1-CD2 3.9Å; V228-L242 HydrophobicContact CG1-CD1 4.26Å; Y231-L242 PolarHBondContact O-N 3.34Å; S232-L242 WeakPolarHBondContact CA-O 3.43Å; L238-L242 HydrophobicContact CD1-CD2 4.42Å
243	T	93.9	Very high	86.9	Confident	70 Å²	70	53.8 Å²	53.8	43%	0.429	31%	0.313	S	S	.	.			trans	-109.6	-56	-173.1	55.8	0	0	0	0	112.5	R170 G171 F240 N241	R170-T243 PolarHBondContact O-OG1 2.8Å; R170-T243 VanDerWaalsContact O-OG1 3.04Å; G171-T243 WeakPolarHBondContact CA-OG1 3.41Å; G171-T243 PolarHBondContact O-N 2.84Å; G171-T243 PolarHBondContact O-OG1 3.41Å; F240-T243 HydrophobicContact CD1-CG2 4.2Å; F240-T243 HydrophobicContact CE1-CG2 3.8Å; N241-T243 PolarHBondContact O-N 2.89Å
244	V	92.5	Very high	86.4	Confident	66 Å²	66	49.1 Å²	49.1	40%	0.4	30%	0.296	S	S	.	.			trans	-130.7	135.7	-172	-178.9	0	0	0	0	109.2	P169 T172 F173	P169-V244 HydrophobicContact CG-CB 4.3Å; P169-V244 HydrophobicContact CG-CG2 3.83Å; T172-V244 CarbonylContact C-O 3.56Å; T172-V244 WeakPolarHBondContact CA-O 3.29Å; T172-V244 WeakPolarHBondContact CG2-O 3.42Å; F173-V244 VanDerWaalsContact CD1-O 3.31Å; F173-V244 WeakPolarHBondContact CD1-O 3.35Å; F173-V244 PolarHBondContact N-O 3.48Å
245	I	91.6	Very high	86	Confident	52 Å²	52	45.3 Å²	45.3	27%	0.267	28%	0.283	S	S	.	.	B	Isolated β-bridge	trans	-72	134	173.2	-57	176.1	0	0	0	108.4	E148 W149 F173 S247	E148-I245 HydrophobicContact CB-CD1 3.94Å; E148-I245 WeakPolarHBondContact O-CG2 3.47Å; W149-I245 HydrophobicContact CB-CD1 4.11Å; W149-I245 HydrophobicContact CB-CG1 4.16Å; W149-I245 HydrophobicContact CB-CG2 4.01Å; F173-I245 HydrophobicContact CE1-CG1 3.98Å; F173-I245 HydrophobicContact CZ-CG1 3.97Å; I245-S247 PolarHBondContact O-N 2.89Å
246	S	85.2	Confident	85.8	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.021	28%	0.275	C	S	.	.			trans	-56.6	135.9	175.4	-164.6	0	0	0	0	110.8	F151 Q162 F173 S248	F151-S246 WeakPolarHBondContact CZ-O 3.4Å; Q162-S246 WeakPolarHBondContact CG-OG 3.42Å; Q162-S246 PolarHBondContact NE2-OG 2.99Å; F173-S246 PolarHBondContact O-N 3.35Å; S246-S248 PolarHBondContact O-N 2.97Å; S246-S248 VanDerWaalsContact O-N 3.13Å
247	S	77	Confident	85.6	Confident	88 Å²	88	41.7 Å²	41.7	62%	0.615	26%	0.261	S	S	*	.			trans	-68.1	113.2	177.8	-54.2	0	0	0	0	110.2	Q162 I245 C249	Q162-S247 PolarHBondContact NE2-O 2.84Å; I245-S247 PolarHBondContact O-N 2.89Å; S247-C249 PolarHBondContact O-N 2.93Å
248	S	69.7	Low	85.5	Confident	44 Å²	44	43 Å²	43	31%	0.308	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-65	131	172.1	-54.1	0	0	0	0	110.6	F151 S246 T250	F151-S248 WeakPolarHBondContact CE1-OG 3.29Å; F151-S248 WeakPolarHBondContact CZ-OG 3.46Å; S246-S248 PolarHBondContact O-N 2.97Å; S246-S248 VanDerWaalsContact O-N 3.13Å; S248-T250 PolarHBondContact O-N 3.29Å
249	C	68.5	Low	85	Confident	107 Å²	107	48.8 Å²	48.8	72%	0.723	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-70.9	128.5	163.3	-66.1	0	0	0	0	108.2	S247 P251	S247-C249 PolarHBondContact O-N 2.93Å; C249-P251 WeakPolarHBondContact O-CD 3.39Å; C249-P251 VanDerWaalsContact O-N 3.13Å
250	T	79.5	Confident	84.5	Confident	83 Å²	83	48.5 Å²	48.5	51%	0.509	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-53.8	120.5	171.2	-51.6	0	0	0	0	108.5	Y91 Y137 S248	Y91-T250 HydrophobicContact CD1-CG2 4.39Å; Y91-T250 HydrophobicContact CG-CG2 4.19Å; Y137-T250 HydrophobicContact CE1-CG2 3.78Å; Y137-T250 WeakPolarHBondContact OH-CG2 3.45Å; S248-T250 PolarHBondContact O-N 3.29Å
251	P	81.8	Confident	84.1	Confident	37 Å²	37	48.3 Å²	48.3	24%	0.24	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-67.4	154.4	-176.8	28.2	-34.4	0	0	0	109.9	Y91 Y137 C249	Y91-P251 HydrophobicContact CD2-CG 3.94Å; Y91-P251 HydrophobicContact CE2-CG 3.55Å; Y91-P251 VanDerWaalsContact CZ-CD 3.41Å; Y137-P251 HydrophobicContact CD2-CG 4.14Å; Y137-P251 HydrophobicContact CE2-CG 3.9Å; Y137-P251 WeakPolarHBondContact CE2-O 3.28Å; Y137-P251 PolarHBondContact OH-O 3.44Å; C249-P251 WeakPolarHBondContact O-CD 3.39Å; C249-P251 VanDerWaalsContact O-N 3.13Å
252	Q	82.3	Confident	83.8	Confident	74 Å²	74	51.1 Å²	51.1	35%	0.346	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-70.4	146.6	168.3	-74.8	174.1	-32.5	0	0	109.9	N136 E340	N136-Q252 PolarHBondContact ND2-O 3.08Å; Q252-E340 PolarHBondContact NE2-OE2 2.9Å; Q252-E340 PolarHBondContact OE1-OE2 3.28Å; Q252-E340 VanDerWaalsContact OE1-OE2 3.08Å
253	T	85.4	Confident	83.6	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.006	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-74.1	150.3	170.9	54.3	0	0	0	0	109.8	Y93 R96 W119 P134 Y137 G255 Q325	Y93-T253 HydrophobicContact CE2-CG2 4.18Å; R96-T253 PolarHBondContact NH1-OG1 3.44Å; R96-T253 PolarHBondContact NH2-OG1 3.19Å; W119-T253 HydrophobicContact CH2-CG2 4.14Å; W119-T253 HydrophobicContact CZ2-CG2 4.17Å; P134-T253 HydrophobicContact CB-CG2 3.72Å; P134-T253 HydrophobicContact CG-CG2 3.94Å; Y137-T253 HydrophobicContact CE2-CG2 3.74Å; T253-G255 PolarHBondContact O-N 3.32Å; T253-G255 PolarHBondContact OG1-O 3.31Å; T253-Q325 PolarHBondContact O-NE2 3.26Å
254	S	83.4	Confident	83.5	Confident	34 Å²	34	51.5 Å²	51.5	24%	0.238	31%	0.307	C	S	.	.	S	Bend	trans	-71.7	95.2	168.8	-67	0	0	0	0	109.9	D118 W119	D118-S254 VanDerWaalsContact CG-OG 3.22Å; D118-S254 PolarHBondContact OD1-OG 2.82Å; D118-S254 WeakPolarHBondContact OD2-CB 3.34Å; D118-S254 PolarHBondContact OD2-OG 2.82Å; W119-S254 PolarHBondContact NE1-O 3.49Å
255	G	84.4	Confident	83.5	Confident	14 Å²	14	51.1 Å²	51.1	14%	0.144	30%	0.298	C	S	.	.	S	Bend	trans	81.6	-175.5	-175.2	0	0	0	0	0	113	T253 Q325	T253-G255 PolarHBondContact O-N 3.32Å; T253-G255 PolarHBondContact OG1-O 3.31Å; G255-Q325 VanDerWaalsContact N-NE2 3.18Å
256	L	83.9	Confident	83.6	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	33%	0.326	C	S	.	.	S	Bend	trans	-78.9	-47.5	-175.2	-70.3	171.5	0	0	0	112.9	R96 A260 V263 W287 T291 V293 Y327 A328	R96-L256 WeakPolarHBondContact CD-O 2.89Å; R96-L256 PolarHBondContact NH1-O 3.42Å; L256-A260 HydrophobicContact CB-CB 4.18Å; L256-V263 HydrophobicContact CD1-CG1 4.36Å; L256-W287 HydrophobicContact CB-CD2 4.17Å; L256-W287 HydrophobicContact CB-CE3 3.82Å; L256-W287 HydrophobicContact CB-CH2 3.7Å; L256-W287 HydrophobicContact CB-CZ2 4.05Å; L256-W287 HydrophobicContact CB-CZ3 3.56Å; L256-W287 HydrophobicContact CD1-CD2 3.77Å; L256-W287 HydrophobicContact CD1-CE3 4.18Å; L256-W287 HydrophobicContact CD1-CG 3.94Å; L256-W287 HydrophobicContact CD1-CZ2 4.46Å; L256-W287 HydrophobicContact CD2-CD2 4.07Å; L256-W287 HydrophobicContact CD2-CE3 3.73Å; L256-W287 HydrophobicContact CD2-CG 4.44Å; L256-W287 HydrophobicContact CD2-CZ3 4.27Å; L256-W287 HydrophobicContact CG-CD2 4.2Å; L256-W287 HydrophobicContact CG-CE3 4.09Å; L256-W287 HydrophobicContact CG-CZ3 4.34Å; L256-T291 HydrophobicContact CD2-CG2 3.94Å; L256-V293 HydrophobicContact CD2-CG1 4.1Å; L256-Y327 HydrophobicContact CD2-CD2 3.64Å; L256-Y327 HydrophobicContact CD2-CE2 4.28Å; L256-Y327 HydrophobicContact CD2-CG 3.89Å; L256-Y327 HydrophobicContact CG-CD2 4.35Å; L256-Y327 HydrophobicContact CG-CG 4.1Å; L256-A328 HydrophobicContact CD1-CB 3.7Å
257	A	84.6	Confident	84	Confident	8 Å²	8	57.4 Å²	57.4	7%	0.066	33%	0.334	C	S	.	.	S	Bend	trans	-158.8	179	177.2	0	0	0	0	0	108.7	T97 W119 D259 A260 W287	T97-A257 HydrophobicContact CG2-CB 3.54Å; W119-A257 VanDerWaalsContact CZ2-CA 3.49Å; A257-D259 PolarHBondContact O-N 3.46Å; A257-A260 HydrophobicContact CB-CB 4.02Å; A257-A260 PolarHBondContact O-N 3.5Å; A257-W287 HydrophobicContact CB-CH2 3.8Å
258	K	83.2	Confident	85	Confident	62 Å²	62	54 Å²	54	27%	0.27	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	129.8	173.6	-174.6	-178.7	177.5	-136.6	0	110.4	W119 Y132 A260	W119-K258 HydrophobicContact CB-CB 4Å; W119-K258 HydrophobicContact CB-CG 4.38Å; W119-K258 HydrophobicContact CG-CB 4.16Å; Y132-K258 HydrophobicContact CD1-CD 3.63Å; Y132-K258 HydrophobicContact CD2-CD 4.19Å; Y132-K258 HydrophobicContact CE1-CD 3.24Å; Y132-K258 HydrophobicContact CE2-CD 3.85Å; Y132-K258 HydrophobicContact CG-CB 4.38Å; Y132-K258 HydrophobicContact CG-CD 4.09Å; Y132-K258 PolarHBondContact OH-NZ 2.64Å; K258-A260 PolarHBondContact O-N 3.49Å
259	D	80.5	Confident	86.2	Confident	132 Å²	132	58.5 Å²	58.5	71%	0.706	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	11.3	177.4	-56.7	-39.6	0	0	0	116.3	A257 W261	A257-D259 PolarHBondContact O-N 3.46Å; D259-W261 PolarHBondContact O-N 2.74Å
260	A	82.2	Confident	87.5	Confident	19 Å²	19	55.9 Å²	55.9	16%	0.157	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	49	-179.5	0	0	0	0	0	112.9	L256 A257 K258 V263 W287 A328	L256-A260 HydrophobicContact CB-CB 4.18Å; A257-A260 HydrophobicContact CB-CB 4.02Å; A257-A260 PolarHBondContact O-N 3.5Å; K258-A260 PolarHBondContact O-N 3.49Å; A260-V263 HydrophobicContact CB-CG1 4.47Å; A260-W287 HydrophobicContact CB-CZ2 4.39Å; A260-A328 WeakPolarHBondContact O-CB 3.49Å
261	W	85.3	Confident	88.3	Confident	58 Å²	58	55.4 Å²	55.4	22%	0.22	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-44.5	178.2	167.6	-104.8	0	0	0	112.5	D259 A312 K316 L326 A328 V329	D259-W261 PolarHBondContact O-N 2.74Å; W261-A312 HydrophobicContact CH2-CB 4.1Å; W261-A312 HydrophobicContact CZ2-CB 4.21Å; W261-K316 HydrophobicContact CD2-CD 4.31Å; W261-K316 HydrophobicContact CE3-CD 4.03Å; W261-K316 HydrophobicContact CE3-CG 4.49Å; W261-K316 HydrophobicContact CH2-CB 3.77Å; W261-K316 HydrophobicContact CH2-CD 3.74Å; W261-K316 HydrophobicContact CH2-CG 4.11Å; W261-K316 HydrophobicContact CZ2-CD 4.08Å; W261-K316 HydrophobicContact CZ3-CB 3.9Å; W261-K316 HydrophobicContact CZ3-CD 3.73Å; W261-K316 HydrophobicContact CZ3-CG 3.9Å; W261-L326 HydrophobicContact CH2-CD2 3.22Å; W261-L326 HydrophobicContact CH2-CG 4.27Å; W261-L326 HydrophobicContact CZ2-CD2 4.44Å; W261-L326 HydrophobicContact CZ3-CD2 3.32Å; W261-L326 HydrophobicContact CZ3-CG 3.91Å; W261-A328 CarbonylContact O-C 3.46Å; W261-A328 WeakPolarHBondContact O-CA 3.19Å; W261-A328 WeakPolarHBondContact O-CB 3.39Å; W261-V329 HydrophobicContact CH2-CG1 4.33Å; W261-V329 HydrophobicContact CZ2-CG1 4.19Å; W261-V329 HydrophobicContact CZ2-CG2 4.17Å; W261-V329 PolarHBondContact O-N 3.44Å
262	E	88.5	Confident	89	Confident	115 Å²	115	60.1 Å²	60.1	54%	0.537	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-111.1	119.8	175.6	-174.8	166.4	-168.3	0	0	107.8	V329 S331	E262-V329 WeakPolarHBondContact CA-O 3.08Å; E262-S331 VanDerWaalsContact OE1-CB 3.26Å; E262-S331 WeakPolarHBondContact OE1-CB 3.34Å; E262-S331 PolarHBondContact OE1-OG 2.98Å
263	V	91.5	Very high	89.6	Confident	16 Å²	16	60.1 Å²	60.1	10%	0.097	31%	0.309	C	S	.	.			trans	-115.3	148.4	-173.1	-64.6	0	0	0	0	110.7	L256 A260 L268 A328 V329 V330	L256-V263 HydrophobicContact CD1-CG1 4.36Å; A260-V263 HydrophobicContact CB-CG1 4.47Å; V263-L268 HydrophobicContact CG2-CD1 4.02Å; V263-L268 HydrophobicContact CG2-CG 4.41Å; V263-A328 HydrophobicContact CB-CB 4.46Å; V263-A328 HydrophobicContact CG1-CB 3.76Å; V263-A328 HydrophobicContact CG2-CB 3.9Å; V263-V329 PolarHBondContact N-O 3.41Å; V263-V330 HydrophobicContact CG2-CG2 4.05Å
264	A	92	Very high	89.9	Confident	68 Å²	68	63.6 Å²	63.6	56%	0.562	33%	0.327	S	S	*	.			trans	-65.8	138.2	173.9	0	0	0	0	0	110.2	D266 S267	A264-D266 PolarHBondContact O-N 2.98Å; A264-S267 WeakPolarHBondContact O-CB 3.29Å; A264-S267 PolarHBondContact O-N 3.49Å; A264-S267 PolarHBondContact O-OG 3.44Å
265	R	93.4	Very high	90	Very high	57 Å²	57	63.4 Å²	63.4	22%	0.215	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-54.8	-39.2	179.3	-174.1	-179.2	-55.7	-69.9	-3.6	112.7	S267 L268 V330 E332 E333 P334 Y336	R265-S267 PolarHBondContact O-N 2.77Å; R265-L268 WeakPolarHBondContact O-CB 3.14Å; R265-L268 PolarHBondContact O-N 3.11Å; R265-V330 HydrophobicContact CB-CG1 4.25Å; R265-E332 PolarHBondContact NH2-O 3.34Å; R265-E333 VanDerWaalsContact NH2-C 3.26Å; R265-E333 PolarHBondContact NH2-O 2.76Å; R265-P334 VanDerWaalsContact CZ-O 3.22Å; R265-P334 PolarHBondContact NH1-O 3.14Å; R265-P334 PolarHBondContact NH2-O 3.22Å; R265-Y336 HydrophobicContact CG-CE2 4.18Å
266	D	93.9	Very high	89.9	Confident	162 Å²	162	68.7 Å²	68.7	87%	0.866	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-68.8	-14.5	-177.7	-62.9	-15.6	0	0	0	113.2	A264 L268	A264-D266 PolarHBondContact O-N 2.98Å; D266-L268 PolarHBondContact O-N 3.24Å
267	S	94.1	Very high	89.4	Confident	25 Å²	25	70.6 Å²	70.6	18%	0.175	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-75	-10.8	170.9	73.6	0	0	0	0	113.3	A264 R265 W287 N288	A264-S267 WeakPolarHBondContact O-CB 3.29Å; A264-S267 PolarHBondContact O-N 3.49Å; A264-S267 PolarHBondContact O-OG 3.44Å; R265-S267 PolarHBondContact O-N 2.77Å; S267-W287 WeakPolarHBondContact O-CA 3.29Å; S267-W287 PolarHBondContact OG-NE1 3.36Å; S267-N288 WeakPolarHBondContact CB-OD1 3.43Å; S267-N288 PolarHBondContact O-N 3.35Å
268	L	96.4	Very high	88.6	Confident	16 Å²	16	74.9 Å²	74.9	8%	0.084	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121.9	-176.3	-64.3	168.8	0	0	0	110.8	V263 R265 D266 W287 V293 I295 V330 Y336 V338	V263-L268 HydrophobicContact CG2-CD1 4.02Å; V263-L268 HydrophobicContact CG2-CG 4.41Å; R265-L268 WeakPolarHBondContact O-CB 3.14Å; R265-L268 PolarHBondContact O-N 3.11Å; D266-L268 PolarHBondContact O-N 3.24Å; L268-W287 HydrophobicContact CD2-CB 3.88Å; L268-W287 HydrophobicContact CD2-CG 4.24Å; L268-V293 HydrophobicContact CD2-CG2 4.31Å; L268-I295 HydrophobicContact CB-CD1 4.04Å; L268-I295 HydrophobicContact CD2-CD1 4.06Å; L268-I295 HydrophobicContact CG-CD1 4.46Å; L268-V330 HydrophobicContact CD1-CG2 3.66Å; L268-Y336 HydrophobicContact CD1-CD2 3.85Å; L268-V338 HydrophobicContact CD1-CG2 3.66Å; L268-V338 HydrophobicContact CD2-CG1 4.27Å; L268-V338 HydrophobicContact CD2-CG2 4.05Å
269	F	96.3	Very high	87.8	Confident	139 Å²	139	77.8 Å²	77.8	61%	0.61	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	119	173.7	-174.7	-110.8	0	0	0	110.6	E271 G285 T286	F269-E271 HydrophobicContact CD1-CG 3.49Å; F269-E271 VanDerWaalsContact CD1-CG 3.49Å; F269-E271 HydrophobicContact CE1-CG 3.72Å; F269-G285 CarbonylContact O-C 3.56Å; F269-G285 WeakPolarHBondContact O-CA 3.41Å; F269-T286 PolarHBondContact N-O 3.23Å; F269-T286 PolarHBondContact O-N 3.08Å
270	L	95.9	Very high	87.8	Confident	53 Å²	53	72 Å²	72	28%	0.277	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	116	174.8	-61.6	173.2	0	0	0	109.6	W283 I295	L270-W283 HydrophobicContact CB-CD2 4.38Å; L270-W283 HydrophobicContact CB-CE3 4.11Å; L270-W283 HydrophobicContact CD2-CB 3.58Å; L270-W283 HydrophobicContact CD2-CD2 4.41Å; L270-W283 HydrophobicContact CD2-CG 3.82Å; L270-I295 HydrophobicContact CD2-CB 3.87Å; L270-I295 HydrophobicContact CD2-CD1 3.67Å; L270-I295 HydrophobicContact CD2-CG1 4.38Å; L270-I295 HydrophobicContact CD2-CG2 3.84Å
271	E	95.6	Very high	88	Confident	73 Å²	73	72.9 Å²	72.9	34%	0.341	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-56.8	-173.8	-66.2	178.6	-177.8	0	0	112.8	F269 L284 T286 K292	F269-E271 HydrophobicContact CD1-CG 3.49Å; F269-E271 VanDerWaalsContact CD1-CG 3.49Å; F269-E271 HydrophobicContact CE1-CG 3.72Å; E271-L284 WeakPolarHBondContact CB-O 3.44Å; E271-L284 PolarHBondContact N-O 3.23Å; E271-T286 WeakPolarHBondContact OE1-CB 3.43Å; E271-T286 PolarHBondContact OE1-OG1 3.13Å; E271-K292 IonicContact OE1-NZ 2.64Å; E271-K292 PolarHBondContact OE1-NZ 2.82Å; E271-K292 IonicContact OE2-NZ 3.87Å; E271-K292 PolarHBondContact OE2-NZ 2.91Å
272	K	95.7	Very high	88.3	Confident	135 Å²	135	72.4 Å²	72.4	59%	0.587	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.2	127.5	-171.3	179.4	-175.6	174.7	-173.7	0	110	L274 W283 L284	K272-L274 PolarHBondContact O-N 3.39Å; K272-W283 CarbonylContact O-C 3.55Å; K272-W283 WeakPolarHBondContact O-CA 3.19Å; K272-L284 HydrophobicContact CB-CB 4.29Å; K272-L284 PolarHBondContact N-O 3.07Å; K272-L284 PolarHBondContact O-N 3.25Å
273	K	95.3	Very high	88.7	Confident	75 Å²	75	69.9 Å²	69.9	33%	0.326	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	121.8	171.3	-162.3	175.7	-166.8	172.7	0	109.8	E281 W283	K273-E281 VanDerWaalsContact CE-CD 3.46Å; K273-E281 WeakPolarHBondContact CE-OE2 3.11Å; K273-E281 IonicContact NZ-OE1 2.75Å; K273-E281 PolarHBondContact NZ-OE1 2.75Å; K273-E281 IonicContact NZ-OE2 3.15Å; K273-E281 PolarHBondContact NZ-OE2 2.9Å; K273-E281 VanDerWaalsContact NZ-OE2 3.15Å; K273-W283 HydrophobicContact CB-CD2 4.15Å; K273-W283 HydrophobicContact CB-CE3 3.95Å; K273-W283 HydrophobicContact CB-CH2 3.96Å; K273-W283 HydrophobicContact CB-CZ2 4.15Å; K273-W283 HydrophobicContact CB-CZ3 3.86Å; K273-W283 HydrophobicContact CD-CH2 4.41Å; K273-W283 HydrophobicContact CD-CZ2 4.07Å; K273-W283 HydrophobicContact CG-CD2 4.31Å; K273-W283 HydrophobicContact CG-CH2 4.38Å; K273-W283 HydrophobicContact CG-CZ2 4.08Å; K273-W283 VanDerWaalsContact N-CE3 3.32Å
274	L	91.1	Very high	88.9	Confident	73 Å²	73	70.1 Å²	70.1	38%	0.382	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-37.8	178.1	-64.7	176.2	0	0	0	111.4	K272 V282 L284 Y341	K272-L274 PolarHBondContact O-N 3.39Å; L274-V282 HydrophobicContact CB-CG1 4.37Å; L274-V282 HydrophobicContact CD1-CG1 4.31Å; L274-V282 PolarHBondContact N-O 2.97Å; L274-L284 HydrophobicContact CD1-CB 3.98Å; L274-L284 HydrophobicContact CD2-CB 3.98Å; L274-L284 HydrophobicContact CG-CB 3.96Å; L274-Y341 HydrophobicContact CD1-CD2 4.1Å; L274-Y341 HydrophobicContact CD1-CE2 3.83Å; L274-Y341 HydrophobicContact CD2-CE2 4.28Å
275	G	85.8	Confident	89.1	Confident	30 Å²	30	66.9 Å²	66.9	31%	0.309	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	163.7	-176.7	0	0	0	0	0	113.2	V282	G275-V282 PolarHBondContact N-O 3.24Å; G275-V282 VanDerWaalsContact N-O 3.13Å; G275-V282 PolarHBondContact O-N 2.82Å
276	Q	84	Confident	89.3	Confident	125 Å²	125	64.5 Å²	64.5	58%	0.584	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.1	116.1	174.5	-169.4	175.8	18.1	0	0	109.5	E281 K299	Q276-E281 HydrophobicContact CG-CG 4.25Å; Q276-E281 PolarHBondContact NE2-OE1 3.15Å; Q276-K299 VanDerWaalsContact NE2-NZ 3.18Å
277	G	72.3	Confident	89.3	Confident	41 Å²	41	57.1 Å²	57.1	42%	0.423	30%	0.299	S	S	.	.			trans	-95.2	179	171.9	0	0	0	0	0	112.6	F279 A280 K299	G277-F279 PolarHBondContact O-N 3.07Å; G277-A280 WeakPolarHBondContact CA-O 3.31Å; G277-A280 PolarHBondContact N-O 3.21Å; G277-K299 PolarHBondContact O-NZ 3.37Å
278	C	66.9	Low	89.2	Confident	98 Å²	98	59.2 Å²	59.2	66%	0.662	31%	0.308	S	S	*	.	S	Bend	trans	-60.6	-37	171.7	-65.1	0	0	0	0	111.7
279	F	68.1	Low	88.8	Confident	123 Å²	123	61.9 Å²	61.9	54%	0.539	34%	0.339	S	S	.	.	S	Bend	trans	-110.7	-27.5	-169	-50.2	-70.3	0	0	0	113.9	G277 K299 T302	G277-F279 PolarHBondContact O-N 3.07Å; F279-K299 PolarHBondContact O-N 3.03Å; F279-T302 HydrophobicContact CD1-CG2 4.48Å; F279-T302 PolarHBondContact O-OG1 2.72Å
280	A	78.7	Confident	88.2	Confident	11 Å²	11	58.3 Å²	58.3	9%	0.091	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	161.7	-174.6	0	0	0	0	0	112	G277 K296 T297	G277-A280 WeakPolarHBondContact CA-O 3.31Å; G277-A280 PolarHBondContact N-O 3.21Å; A280-K296 HydrophobicContact CB-CD 4.46Å; A280-K296 HydrophobicContact CB-CG 3.78Å; A280-T297 CarbonylContact C-O 3.53Å; A280-T297 WeakPolarHBondContact CA-O 3.37Å; A280-T297 VanDerWaalsContact CB-O 3.28Å; A280-T297 WeakPolarHBondContact CB-O 3.33Å
281	E	88.1	Confident	88	Confident	37 Å²	37	56.5 Å²	56.5	17%	0.173	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	145.3	165.4	-45.1	-158.6	136	0	0	108.9	K273 Q276 K296 T297	K273-E281 VanDerWaalsContact CE-CD 3.46Å; K273-E281 WeakPolarHBondContact CE-OE2 3.11Å; K273-E281 IonicContact NZ-OE1 2.75Å; K273-E281 PolarHBondContact NZ-OE1 2.75Å; K273-E281 IonicContact NZ-OE2 3.15Å; K273-E281 PolarHBondContact NZ-OE2 2.9Å; K273-E281 VanDerWaalsContact NZ-OE2 3.15Å; Q276-E281 HydrophobicContact CG-CG 4.25Å; Q276-E281 PolarHBondContact NE2-OE1 3.15Å; E281-K296 CarbonylContact O-C 3.59Å; E281-K296 WeakPolarHBondContact O-CA 3.49Å; E281-T297 PolarHBondContact N-O 3.48Å; E281-T297 PolarHBondContact O-N 3.35Å; E281-T297 PolarHBondContact O-OG1 2.86Å
282	V	91.7	Very high	87.9	Confident	49 Å²	49	57.9 Å²	57.9	30%	0.297	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	130.8	179	-174.2	0	0	0	0	108.2	L274 G275 I295 K296	L274-V282 HydrophobicContact CB-CG1 4.37Å; L274-V282 HydrophobicContact CD1-CG1 4.31Å; L274-V282 PolarHBondContact N-O 2.97Å; G275-V282 PolarHBondContact N-O 3.24Å; G275-V282 VanDerWaalsContact N-O 3.13Å; G275-V282 PolarHBondContact O-N 2.82Å; V282-I295 WeakPolarHBondContact CA-O 3.49Å; V282-K296 HydrophobicContact CG2-CB 4.49Å; V282-K296 HydrophobicContact CG2-CG 4.31Å
283	W	95.7	Very high	87.9	Confident	61 Å²	61	51.4 Å²	51.4	23%	0.231	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	141.1	-176.7	-65.3	79.4	0	0	0	110.2	L270 K272 K273 A294 I295	L270-W283 HydrophobicContact CB-CD2 4.38Å; L270-W283 HydrophobicContact CB-CE3 4.11Å; L270-W283 HydrophobicContact CD2-CB 3.58Å; L270-W283 HydrophobicContact CD2-CD2 4.41Å; L270-W283 HydrophobicContact CD2-CG 3.82Å; K272-W283 CarbonylContact O-C 3.55Å; K272-W283 WeakPolarHBondContact O-CA 3.19Å; K273-W283 HydrophobicContact CB-CD2 4.15Å; K273-W283 HydrophobicContact CB-CE3 3.95Å; K273-W283 HydrophobicContact CB-CH2 3.96Å; K273-W283 HydrophobicContact CB-CZ2 4.15Å; K273-W283 HydrophobicContact CB-CZ3 3.86Å; K273-W283 HydrophobicContact CD-CH2 4.41Å; K273-W283 HydrophobicContact CD-CZ2 4.07Å; K273-W283 HydrophobicContact CG-CD2 4.31Å; K273-W283 HydrophobicContact CG-CH2 4.38Å; K273-W283 HydrophobicContact CG-CZ2 4.08Å; K273-W283 VanDerWaalsContact N-CE3 3.32Å; W283-A294 CarbonylContact O-C 3.56Å; W283-A294 WeakPolarHBondContact O-CA 3.41Å; W283-I295 PolarHBondContact N-O 3.07Å; W283-I295 PolarHBondContact O-N 3.11Å
284	L	96.5	Very high	88	Confident	21 Å²	21	48.2 Å²	48.2	11%	0.11	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	133.3	156.5	173.3	61.4	0	0	0	106.6	E271 K272 L274 K292 Y341	E271-L284 WeakPolarHBondContact CB-O 3.44Å; E271-L284 PolarHBondContact N-O 3.23Å; K272-L284 HydrophobicContact CB-CB 4.29Å; K272-L284 PolarHBondContact N-O 3.07Å; K272-L284 PolarHBondContact O-N 3.25Å; L274-L284 HydrophobicContact CD1-CB 3.98Å; L274-L284 HydrophobicContact CD2-CB 3.98Å; L274-L284 HydrophobicContact CG-CB 3.96Å; L284-K292 HydrophobicContact CD1-CD 4.25Å; L284-Y341 HydrophobicContact CD1-CD1 3.8Å; L284-Y341 HydrophobicContact CD1-CD2 3.71Å; L284-Y341 HydrophobicContact CD1-CE1 3.9Å; L284-Y341 HydrophobicContact CD1-CE2 3.82Å; L284-Y341 HydrophobicContact CD1-CG 3.69Å
285	G	96.7	Very high	88.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	-176.2	173.3	0	0	0	0	0	112.8	F269 V293	F269-G285 CarbonylContact O-C 3.56Å; F269-G285 WeakPolarHBondContact O-CA 3.41Å; G285-V293 PolarHBondContact N-O 3.31Å; G285-V293 PolarHBondContact O-N 3.36Å
286	T	96.1	Very high	88.3	Confident	7 Å²	7	44.8 Å²	44.8	4%	0.043	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	132.3	176.4	-63	0	0	0	0	109.6	F269 E271 G289 N290 T291 K292	F269-T286 PolarHBondContact N-O 3.23Å; F269-T286 PolarHBondContact O-N 3.08Å; E271-T286 WeakPolarHBondContact OE1-CB 3.43Å; E271-T286 PolarHBondContact OE1-OG1 3.13Å; T286-G289 WeakPolarHBondContact CG2-O 3.44Å; T286-N290 VanDerWaalsContact CG2-N 3.33Å; T286-T291 CarbonylContact C-O 3.5Å; T286-T291 WeakPolarHBondContact CA-O 3.36Å; T286-K292 PolarHBondContact OG1-NZ 2.92Å
287	W	94.8	Very high	88.5	Confident	8 Å²	8	39.6 Å²	39.6	3%	0.03	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	133.8	169.8	177	67.5	0	0	0	109.9	R96 T97 L256 A257 A260 S267 L268 G289 N290 T291 V293	R96-W287 HydrophobicContact CB-CE3 4.37Å; R96-W287 HydrophobicContact CB-CH2 4.17Å; R96-W287 HydrophobicContact CB-CZ3 3.52Å; R96-W287 HydrophobicContact CG-CZ3 4.33Å; T97-W287 HydrophobicContact CG2-CH2 3.68Å; T97-W287 HydrophobicContact CG2-CZ2 4.27Å; L256-W287 HydrophobicContact CB-CD2 4.17Å; L256-W287 HydrophobicContact CB-CE3 3.82Å; L256-W287 HydrophobicContact CB-CH2 3.7Å; L256-W287 HydrophobicContact CB-CZ2 4.05Å; L256-W287 HydrophobicContact CB-CZ3 3.56Å; L256-W287 HydrophobicContact CD1-CD2 3.77Å; L256-W287 HydrophobicContact CD1-CE3 4.18Å; L256-W287 HydrophobicContact CD1-CG 3.94Å; L256-W287 HydrophobicContact CD1-CZ2 4.46Å; L256-W287 HydrophobicContact CD2-CD2 4.07Å; L256-W287 HydrophobicContact CD2-CE3 3.73Å; L256-W287 HydrophobicContact CD2-CG 4.44Å; L256-W287 HydrophobicContact CD2-CZ3 4.27Å; L256-W287 HydrophobicContact CG-CD2 4.2Å; L256-W287 HydrophobicContact CG-CE3 4.09Å; L256-W287 HydrophobicContact CG-CZ3 4.34Å; A257-W287 HydrophobicContact CB-CH2 3.8Å; A260-W287 HydrophobicContact CB-CZ2 4.39Å; S267-W287 WeakPolarHBondContact O-CA 3.29Å; S267-W287 PolarHBondContact OG-NE1 3.36Å; L268-W287 HydrophobicContact CD2-CB 3.88Å; L268-W287 HydrophobicContact CD2-CG 4.24Å; W287-G289 PolarHBondContact O-N 3.35Å; W287-N290 PolarHBondContact O-N 2.9Å; W287-T291 HydrophobicContact CE3-CG2 4.34Å; W287-T291 PolarHBondContact N-O 3.43Å; W287-T291 PolarHBondContact O-N 3.29Å; W287-V293 HydrophobicContact CB-CG1 4.25Å; W287-V293 HydrophobicContact CB-CG2 4.43Å
288	N	91.3	Very high	88.6	Confident	69 Å²	69	38.4 Å²	38.4	37%	0.369	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	31.4	-179.1	-75.8	0.5	0	0	0	114.5	R96 S267 N290	R96-N288 PolarHBondContact O-ND2 3.5Å; S267-N288 WeakPolarHBondContact CB-OD1 3.43Å; S267-N288 PolarHBondContact O-N 3.35Å; N288-N290 PolarHBondContact O-N 2.5Å; N288-N290 VanDerWaalsContact O-N 3.11Å
289	G	88.1	Confident	88.8	Confident	72 Å²	72	36.3 Å²	36.3	74%	0.742	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.7	-12.8	175.8	0	0	0	0	0	116.6	T286 W287	T286-G289 WeakPolarHBondContact CG2-O 3.44Å; W287-G289 PolarHBondContact O-N 3.35Å
290	N	84.4	Confident	89	Confident	63 Å²	63	36.2 Å²	36.2	34%	0.337	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.2	-25.4	-177.5	67.3	7.9	0	0	0	115.4	A95 T286 W287 N288	A95-N290 PolarHBondContact O-ND2 2.91Å; A95-N290 VanDerWaalsContact O-ND2 3.15Å; T286-N290 VanDerWaalsContact CG2-N 3.33Å; W287-N290 PolarHBondContact O-N 2.9Å; N288-N290 PolarHBondContact O-N 2.5Å; N288-N290 VanDerWaalsContact O-N 3.11Å
291	T	90.8	Very high	88.3	Confident	16 Å²	16	39.8 Å²	39.8	10%	0.098	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	110.4	-170.5	-58.8	0	0	0	0	111.2	R96 L256 T286 W287 V293	R96-T291 VanDerWaalsContact CD-OG1 3.3Å; R96-T291 WeakPolarHBondContact CD-OG1 3.18Å; L256-T291 HydrophobicContact CD2-CG2 3.94Å; T286-T291 CarbonylContact C-O 3.5Å; T286-T291 WeakPolarHBondContact CA-O 3.36Å; W287-T291 HydrophobicContact CE3-CG2 4.34Å; W287-T291 PolarHBondContact N-O 3.43Å; W287-T291 PolarHBondContact O-N 3.29Å; T291-V293 HydrophobicContact CG2-CG1 4.27Å; T291-V293 PolarHBondContact O-N 2.78Å
292	K	94.5	Very high	86.8	Confident	101 Å²	101	40.5 Å²	40.5	44%	0.439	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	131.7	176.7	-69	-63.6	-177.9	-168.2	0	111.7	E271 L284 T286	E271-K292 IonicContact OE1-NZ 2.64Å; E271-K292 PolarHBondContact OE1-NZ 2.82Å; E271-K292 IonicContact OE2-NZ 3.87Å; E271-K292 PolarHBondContact OE2-NZ 2.91Å; L284-K292 HydrophobicContact CD1-CD 4.25Å; T286-K292 PolarHBondContact OG1-NZ 2.92Å
293	V	95.9	Very high	85.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	157.2	-176.7	-65.8	0	0	0	0	111.6	L256 L268 G285 W287 T291 I295 Y327 V338	L256-V293 HydrophobicContact CD2-CG1 4.1Å; L268-V293 HydrophobicContact CD2-CG2 4.31Å; G285-V293 PolarHBondContact N-O 3.31Å; G285-V293 PolarHBondContact O-N 3.36Å; W287-V293 HydrophobicContact CB-CG1 4.25Å; W287-V293 HydrophobicContact CB-CG2 4.43Å; T291-V293 HydrophobicContact CG2-CG1 4.27Å; T291-V293 PolarHBondContact O-N 2.78Å; V293-I295 HydrophobicContact CG2-CD1 3.95Å; V293-I295 HydrophobicContact CG2-CG1 3.82Å; V293-Y327 HydrophobicContact CG1-CD2 3.91Å; V293-Y327 HydrophobicContact CG1-CE2 4.29Å; V293-V338 HydrophobicContact CB-CG1 3.63Å; V293-V338 HydrophobicContact CG1-CG1 3.75Å; V293-V338 HydrophobicContact CG2-CG1 3.88Å
294	A	95.9	Very high	84	Confident	8 Å²	8	40.2 Å²	40.2	7%	0.066	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	126.4	165.5	0	0	0	0	0	109.4	W283 V338 T339	W283-A294 CarbonylContact O-C 3.56Å; W283-A294 WeakPolarHBondContact O-CA 3.41Å; A294-V338 WeakPolarHBondContact O-CA 3.41Å; A294-T339 PolarHBondContact N-O 2.91Å; A294-T339 PolarHBondContact O-N 3.35Å; A294-T339 PolarHBondContact O-OG1 2.71Å
295	I	94.4	Very high	82.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	111.2	-175.3	-56.4	165.8	0	0	0	108.6	L268 L270 V282 W283 V293 T297 Y336 I337	L268-I295 HydrophobicContact CB-CD1 4.04Å; L268-I295 HydrophobicContact CD2-CD1 4.06Å; L268-I295 HydrophobicContact CG-CD1 4.46Å; L270-I295 HydrophobicContact CD2-CB 3.87Å; L270-I295 HydrophobicContact CD2-CD1 3.67Å; L270-I295 HydrophobicContact CD2-CG1 4.38Å; L270-I295 HydrophobicContact CD2-CG2 3.84Å; V282-I295 WeakPolarHBondContact CA-O 3.49Å; W283-I295 PolarHBondContact N-O 3.07Å; W283-I295 PolarHBondContact O-N 3.11Å; V293-I295 HydrophobicContact CG2-CD1 3.95Å; V293-I295 HydrophobicContact CG2-CG1 3.82Å; I295-T297 HydrophobicContact CG2-CG2 4.02Å; I295-Y336 HydrophobicContact CG2-CD1 4.43Å; I295-Y336 HydrophobicContact CG2-CD2 3.63Å; I295-Y336 HydrophobicContact CG2-CE2 4.19Å; I295-Y336 HydrophobicContact CG2-CG 3.77Å; I295-I337 WeakPolarHBondContact CA-O 3.35Å
296	K	90	Very high	81.5	Confident	31 Å²	31	46.9 Å²	46.9	14%	0.135	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	116.5	174.6	-176.4	176.9	177.7	-176.4	0	108.4	A280 E281 V282 E311 Y336 I337 D405	A280-K296 HydrophobicContact CB-CD 4.46Å; A280-K296 HydrophobicContact CB-CG 3.78Å; E281-K296 CarbonylContact O-C 3.59Å; E281-K296 WeakPolarHBondContact O-CA 3.49Å; V282-K296 HydrophobicContact CG2-CB 4.49Å; V282-K296 HydrophobicContact CG2-CG 4.31Å; K296-E311 IonicContact NZ-OE1 3.58Å; K296-E311 PolarHBondContact NZ-OE1 3.29Å; K296-Y336 WeakPolarHBondContact O-CA 3.41Å; K296-I337 HydrophobicContact CB-CB 4.24Å; K296-I337 PolarHBondContact N-O 3.08Å; K296-I337 PolarHBondContact O-N 3.08Å; K296-D405 IonicContact NZ-OD1 2.95Å; K296-D405 PolarHBondContact NZ-OD1 3.49Å
297	T	87.3	Confident	80.2	Confident	15 Å²	15	49 Å²	49	9%	0.092	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.6	-178.6	69.3	0	0	0	0	110.2	A280 E281 I295 Y336	A280-T297 CarbonylContact C-O 3.53Å; A280-T297 WeakPolarHBondContact CA-O 3.37Å; A280-T297 VanDerWaalsContact CB-O 3.28Å; A280-T297 WeakPolarHBondContact CB-O 3.33Å; E281-T297 PolarHBondContact N-O 3.48Å; E281-T297 PolarHBondContact O-N 3.35Å; E281-T297 PolarHBondContact O-OG1 2.86Å; I295-T297 HydrophobicContact CG2-CG2 4.02Å; T297-Y336 HydrophobicContact CG2-CD1 3.5Å; T297-Y336 HydrophobicContact CG2-CE1 3.27Å; T297-Y336 HydrophobicContact CG2-CG 4.26Å
298	L	74.6	Confident	79	Confident	16 Å²	16	48.8 Å²	48.8	8%	0.084	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	136.4	179.3	-169.8	69.2	0	0	0	111.3	T302 M303 F308 I335	L298-T302 VanDerWaalsContact CD1-OG1 3.25Å; L298-T302 WeakPolarHBondContact CD1-OG1 3.44Å; L298-T302 WeakPolarHBondContact CG-OG1 3.24Å; L298-M303 HydrophobicContact CD1-CG 3.61Å; L298-M303 HydrophobicContact CD1-SD 3.47Å; L298-M303 WeakPolarHBondContact CD1-SD 3.38Å; L298-M303 HydrophobicContact CD2-CG 3.45Å; L298-M303 VanDerWaalsContact CD2-CG 3.45Å; L298-M303 HydrophobicContact CD2-SD 4.25Å; L298-M303 HydrophobicContact CG-CG 4.13Å; L298-F308 HydrophobicContact CB-CE2 4.35Å; L298-F308 HydrophobicContact CD1-CD2 4.24Å; L298-F308 HydrophobicContact CD1-CE2 4.29Å; L298-F308 HydrophobicContact CD2-CD2 4.45Å; L298-I335 PolarHBondContact N-O 2.99Å
299	K	71.8	Confident	78.2	Confident	55 Å²	55	48.4 Å²	48.4	24%	0.239	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-74.8	134.5	171.2	-68	177.7	178.4	171.8	0	109.7	Q276 G277 F279 G301 T302	Q276-K299 VanDerWaalsContact NE2-NZ 3.18Å; G277-K299 PolarHBondContact O-NZ 3.37Å; F279-K299 PolarHBondContact O-N 3.03Å; K299-G301 PolarHBondContact O-N 3.46Å; K299-T302 HydrophobicContact CB-CG2 3.83Å; K299-T302 WeakPolarHBondContact O-CG2 3.41Å; K299-T302 PolarHBondContact O-N 3.17Å; K299-T302 PolarHBondContact O-OG1 3.22Å
300	P	71.1	Confident	77.5	Confident	121 Å²	121	51 Å²	51	79%	0.786	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	136.2	178.5	-27.7	34.6	0	0	0	112.7
301	G	63.5	Low	77.1	Confident	86 Å²	86	48.2 Å²	48.2	89%	0.887	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	10.6	175.5	0	0	0	0	0	116.5	K299	K299-G301 PolarHBondContact O-N 3.46Å
302	T	57.2	Low	76.6	Confident	51 Å²	51	47.4 Å²	47.4	31%	0.313	28%	0.276	S	S	.	.	S	Bend	trans	-91.7	-32.6	-178.3	53.1	0	0	0	0	114.9	F279 L298 K299	F279-T302 HydrophobicContact CD1-CG2 4.48Å; F279-T302 PolarHBondContact O-OG1 2.72Å; L298-T302 VanDerWaalsContact CD1-OG1 3.25Å; L298-T302 WeakPolarHBondContact CD1-OG1 3.44Å; L298-T302 WeakPolarHBondContact CG-OG1 3.24Å; K299-T302 HydrophobicContact CB-CG2 3.83Å; K299-T302 WeakPolarHBondContact O-CG2 3.41Å; K299-T302 PolarHBondContact O-N 3.17Å; K299-T302 PolarHBondContact O-OG1 3.22Å
303	M	61.7	Low	76	Confident	56 Å²	56	46.4 Å²	46.4	28%	0.276	27%	0.273	S	S	.	.	S	Bend	trans	-155.7	160.5	173.8	60.8	-161.8	-70.5	0	0	109.8	L298 F308	L298-M303 HydrophobicContact CD1-CG 3.61Å; L298-M303 HydrophobicContact CD1-SD 3.47Å; L298-M303 WeakPolarHBondContact CD1-SD 3.38Å; L298-M303 HydrophobicContact CD2-CG 3.45Å; L298-M303 VanDerWaalsContact CD2-CG 3.45Å; L298-M303 HydrophobicContact CD2-SD 4.25Å; L298-M303 HydrophobicContact CG-CG 4.13Å; M303-F308 HydrophobicContact CE-CB 3.8Å; M303-F308 HydrophobicContact CE-CD2 3.95Å; M303-F308 HydrophobicContact CE-CG 4.37Å; M303-F308 HydrophobicContact SD-CB 4.37Å; M303-F308 HydrophobicContact SD-CD2 3.79Å
304	S	67.6	Low	75.3	Confident	49 Å²	49	47.4 Å²	47.4	34%	0.343	28%	0.278	S	S	.	.			trans	-74.5	148.2	177.2	86.3	0	0	0	0	110.5	E306 S307 F308	S304-E306 WeakPolarHBondContact CB-OE2 3.37Å; S304-E306 PolarHBondContact O-N 2.94Å; S304-E306 PolarHBondContact OG-OE2 3.44Å; S304-S307 PolarHBondContact O-N 3.45Å; S304-S307 VanDerWaalsContact O-N 3.08Å; S304-S307 PolarHBondContact OG-N 3.02Å; S304-S307 PolarHBondContact OG-OG 3.13Å; S304-F308 PolarHBondContact O-N 3.39Å
305	P	68.5	Low	74.7	Confident	40 Å²	40	47.6 Å²	47.6	26%	0.26	28%	0.277	S	S	.	.	H	α-helix	trans	-51.5	-36.4	175.1	-28	35.1	0	0	0	113.8	S307 F308 L309 I335	P305-S307 PolarHBondContact O-N 3.39Å; P305-F308 PolarHBondContact O-N 3.4Å; P305-L309 WeakPolarHBondContact O-CG 3.42Å; P305-L309 PolarHBondContact O-N 3.18Å; P305-I335 VanDerWaalsContact CA-CD1 3.43Å; P305-I335 HydrophobicContact CB-CD1 3.54Å; P305-I335 HydrophobicContact CG-CD1 3.95Å
306	E	72.3	Confident	74.2	Confident	120 Å²	120	52.1 Å²	52.1	56%	0.561	30%	0.297	S	S	*	.	H	α-helix	trans	-63.3	-43.7	178.9	-54.8	76	-163.5	0	0	111.5	S304 F308 L309 E310	S304-E306 WeakPolarHBondContact CB-OE2 3.37Å; S304-E306 PolarHBondContact O-N 2.94Å; S304-E306 PolarHBondContact OG-OE2 3.44Å; E306-F308 PolarHBondContact O-N 2.99Å; E306-L309 PolarHBondContact O-N 3.39Å; E306-E310 WeakPolarHBondContact O-CG 3.3Å; E306-E310 PolarHBondContact O-N 2.86Å
307	S	69	Low	74	Confident	53 Å²	53	57 Å²	57	37%	0.371	32%	0.318	S	S	.	.	H	α-helix	trans	-64.7	-29.2	179	-58.1	0	0	0	0	112.2	S304 P305 E311	S304-S307 PolarHBondContact O-N 3.45Å; S304-S307 VanDerWaalsContact O-N 3.08Å; S304-S307 PolarHBondContact OG-N 3.02Å; S304-S307 PolarHBondContact OG-OG 3.13Å; P305-S307 PolarHBondContact O-N 3.39Å; S307-E311 PolarHBondContact O-N 2.95Å
308	F	69.3	Low	74	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.009	32%	0.315	C	S	.	.	H	α-helix	trans	-83	-34.4	179.2	-169	-94.3	0	0	0	111.8	L298 M303 S304 P305 E306 E310 E311 A312 I335 I337	L298-F308 HydrophobicContact CB-CE2 4.35Å; L298-F308 HydrophobicContact CD1-CD2 4.24Å; L298-F308 HydrophobicContact CD1-CE2 4.29Å; L298-F308 HydrophobicContact CD2-CD2 4.45Å; M303-F308 HydrophobicContact CE-CB 3.8Å; M303-F308 HydrophobicContact CE-CD2 3.95Å; M303-F308 HydrophobicContact CE-CG 4.37Å; M303-F308 HydrophobicContact SD-CB 4.37Å; M303-F308 HydrophobicContact SD-CD2 3.79Å; S304-F308 PolarHBondContact O-N 3.39Å; P305-F308 PolarHBondContact O-N 3.4Å; E306-F308 PolarHBondContact O-N 2.99Å; F308-E310 VanDerWaalsContact C-N 3.32Å; F308-E311 WeakPolarHBondContact O-CB 3.36Å; F308-E311 PolarHBondContact O-N 3.41Å; F308-A312 PolarHBondContact O-N 2.89Å; F308-A312 VanDerWaalsContact O-N 3.09Å; F308-I335 HydrophobicContact CB-CD1 4.42Å; F308-I335 HydrophobicContact CD1-CB 4.02Å; F308-I335 HydrophobicContact CD1-CD1 4.41Å; F308-I335 HydrophobicContact CD1-CG2 3.34Å; F308-I335 HydrophobicContact CE1-CB 3.89Å; F308-I335 HydrophobicContact CE1-CG2 3.31Å; F308-I335 HydrophobicContact CG-CG2 4.38Å; F308-I335 HydrophobicContact CZ-CG2 4.4Å; F308-I337 HydrophobicContact CD1-CD1 3.97Å; F308-I337 HydrophobicContact CD1-CG1 4.19Å; F308-I337 HydrophobicContact CD2-CD1 4.16Å; F308-I337 HydrophobicContact CE1-CB 4.22Å; F308-I337 HydrophobicContact CE1-CD1 3.39Å; F308-I337 HydrophobicContact CE1-CG1 3.33Å; F308-I337 HydrophobicContact CE2-CD1 3.56Å; F308-I337 HydrophobicContact CE2-CG1 4.31Å; F308-I337 HydrophobicContact CG-CD1 4.37Å; F308-I337 HydrophobicContact CZ-CB 3.96Å; F308-I337 HydrophobicContact CZ-CD1 3.16Å; F308-I337 HydrophobicContact CZ-CG1 3.41Å; F308-I337 VanDerWaalsContact CZ-CG1 3.41Å
309	L	73.3	Confident	74.7	Confident	62 Å²	62	61.6 Å²	61.6	33%	0.325	34%	0.337	S	S	.	.	H	α-helix	trans	-65.8	-34.9	170.5	-73.6	171.5	0	0	0	111.6	P305 E306 E311 A312 Q313	P305-L309 WeakPolarHBondContact O-CG 3.42Å; P305-L309 PolarHBondContact O-N 3.18Å; E306-L309 PolarHBondContact O-N 3.39Å; L309-E311 VanDerWaalsContact C-N 3.34Å; L309-E311 PolarHBondContact O-N 3.2Å; L309-A312 PolarHBondContact O-N 2.7Å; L309-Q313 WeakPolarHBondContact O-CG 3.36Å; L309-Q313 PolarHBondContact O-N 3.3Å
310	E	75.2	Confident	75.6	Confident	125 Å²	125	61.5 Å²	61.5	58%	0.584	34%	0.337	S	S	*	.	H	α-helix	trans	-57.4	-45.4	170.2	-76.3	177.1	-175	0	0	111.8	E306 F308 A312 Q313 I314	E306-E310 WeakPolarHBondContact O-CG 3.3Å; E306-E310 PolarHBondContact O-N 2.86Å; F308-E310 VanDerWaalsContact C-N 3.32Å; E310-A312 VanDerWaalsContact C-N 3.33Å; E310-A312 PolarHBondContact O-N 3.3Å; E310-Q313 PolarHBondContact O-N 3.38Å; E310-Q313 VanDerWaalsContact O-N 3.15Å; E310-I314 WeakPolarHBondContact O-CG1 3.44Å; E310-I314 PolarHBondContact O-N 3.49Å
311	E	74.6	Confident	76.6	Confident	5 Å²	5	61.3 Å²	61.3	2%	0.023	33%	0.329	C	S	.	.	H	α-helix	trans	-55.8	-47.7	173.8	155.7	160	-159.7	0	0	110.8	K296 S307 F308 L309 Q313 I314 M315 I337 G407	K296-E311 IonicContact NZ-OE1 3.58Å; K296-E311 PolarHBondContact NZ-OE1 3.29Å; S307-E311 PolarHBondContact O-N 2.95Å; F308-E311 WeakPolarHBondContact O-CB 3.36Å; F308-E311 PolarHBondContact O-N 3.41Å; L309-E311 VanDerWaalsContact C-N 3.34Å; L309-E311 PolarHBondContact O-N 3.2Å; E311-Q313 PolarHBondContact O-N 2.86Å; E311-I314 PolarHBondContact O-N 3.25Å; E311-M315 HydrophobicContact CG-SD 4.34Å; E311-M315 WeakPolarHBondContact O-CG 3.45Å; E311-M315 PolarHBondContact O-N 2.88Å; E311-M315 VanDerWaalsContact O-N 3.08Å; E311-I337 HydrophobicContact CG-CD1 3.71Å; E311-G407 WeakPolarHBondContact CA-O 3.3Å; E311-G407 VanDerWaalsContact CB-O 3.25Å; E311-G407 WeakPolarHBondContact CB-O 3.38Å; E311-G407 VanDerWaalsContact CG-CA 3.48Å
312	A	79.9	Confident	78.1	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.6	-38.8	176.3	0	0	0	0	0	113	W261 F308 L309 E310 I314 M315 K316 L326 V329	W261-A312 HydrophobicContact CH2-CB 4.1Å; W261-A312 HydrophobicContact CZ2-CB 4.21Å; F308-A312 PolarHBondContact O-N 2.89Å; F308-A312 VanDerWaalsContact O-N 3.09Å; L309-A312 PolarHBondContact O-N 2.7Å; E310-A312 VanDerWaalsContact C-N 3.33Å; E310-A312 PolarHBondContact O-N 3.3Å; A312-I314 PolarHBondContact O-N 3.15Å; A312-M315 PolarHBondContact O-N 3.08Å; A312-K316 WeakPolarHBondContact O-CB 3.33Å; A312-K316 PolarHBondContact O-N 3.07Å; A312-L326 HydrophobicContact CB-CD2 3.94Å; A312-L326 WeakPolarHBondContact O-CD2 3.46Å; A312-V329 HydrophobicContact CB-CG1 3.62Å
313	Q	82	Confident	79.9	Confident	80 Å²	80	55.7 Å²	55.7	37%	0.374	28%	0.276	S	S	.	.	H	α-helix	trans	-65.5	-37.4	177.6	-69.3	-52.7	-41.5	0	0	112.4	L309 E310 E311 K316 K317	L309-Q313 WeakPolarHBondContact O-CG 3.36Å; L309-Q313 PolarHBondContact O-N 3.3Å; E310-Q313 PolarHBondContact O-N 3.38Å; E310-Q313 VanDerWaalsContact O-N 3.15Å; E311-Q313 PolarHBondContact O-N 2.86Å; Q313-K316 PolarHBondContact O-N 3.29Å; Q313-K317 WeakPolarHBondContact O-CG 3.47Å; Q313-K317 PolarHBondContact O-N 2.86Å; Q313-K317 VanDerWaalsContact O-N 3.13Å
314	I	81.9	Confident	81.4	Confident	21 Å²	21	53.2 Å²	53.2	11%	0.108	26%	0.264	C	S	.	.	H	α-helix	trans	-64.6	-48.2	175.1	-66.9	174.5	0	0	0	109.8	E310 E311 A312 K316 K317 L318 Y383 A409	E310-I314 WeakPolarHBondContact O-CG1 3.44Å; E310-I314 PolarHBondContact O-N 3.49Å; E311-I314 PolarHBondContact O-N 3.25Å; A312-I314 PolarHBondContact O-N 3.15Å; I314-K316 PolarHBondContact O-N 3.45Å; I314-K317 PolarHBondContact O-N 3.4Å; I314-K317 VanDerWaalsContact O-N 3.1Å; I314-L318 HydrophobicContact CG2-CD1 3.67Å; I314-L318 HydrophobicContact CG2-CG 4.23Å; I314-L318 PolarHBondContact O-N 3.17Å; I314-Y383 HydrophobicContact CB-CE1 4.49Å; I314-Y383 HydrophobicContact CD1-CE1 4.06Å; I314-Y383 HydrophobicContact CG1-CE1 3.93Å; I314-Y383 HydrophobicContact CG2-CD1 4.09Å; I314-Y383 HydrophobicContact CG2-CE1 3.88Å; I314-A409 WeakPolarHBondContact CD1-O 3.2Å; I314-A409 HydrophobicContact CG2-CB 4.46Å
315	M	82.8	Confident	82.5	Confident	11 Å²	11	53 Å²	53	5%	0.054	26%	0.258	C	S	.	.	H	α-helix	trans	-63.5	-29.9	178	-61.7	178.9	74.7	0	0	113.2	E311 A312 L326 T339 F406	E311-M315 HydrophobicContact CG-SD 4.34Å; E311-M315 WeakPolarHBondContact O-CG 3.45Å; E311-M315 PolarHBondContact O-N 2.88Å; E311-M315 VanDerWaalsContact O-N 3.08Å; A312-M315 PolarHBondContact O-N 3.08Å; M315-L326 HydrophobicContact CB-CB 3.73Å; M315-L326 HydrophobicContact CB-CD2 3.86Å; M315-L326 HydrophobicContact CB-CG 4.36Å; M315-L326 HydrophobicContact CE-CB 4.21Å; M315-T339 HydrophobicContact CE-CG2 3.72Å; M315-F406 HydrophobicContact CB-CE2 4.08Å; M315-F406 HydrophobicContact CB-CZ 4.17Å; M315-F406 HydrophobicContact CE-CE1 4.25Å; M315-F406 HydrophobicContact CE-CZ 4.16Å; M315-F406 HydrophobicContact CG-CD2 4.27Å; M315-F406 HydrophobicContact CG-CE2 3.7Å; M315-F406 HydrophobicContact CG-CZ 3.86Å
316	K	83.6	Confident	83.6	Confident	95 Å²	95	51.8 Å²	51.8	41%	0.413	25%	0.249	S	C	.	.	H	α-helix	trans	-68.1	-38.4	173.1	-171.9	177.2	-175.2	168.7	0	112.5	W261 A312 Q313 I314	W261-K316 HydrophobicContact CD2-CD 4.31Å; W261-K316 HydrophobicContact CE3-CD 4.03Å; W261-K316 HydrophobicContact CE3-CG 4.49Å; W261-K316 HydrophobicContact CH2-CB 3.77Å; W261-K316 HydrophobicContact CH2-CD 3.74Å; W261-K316 HydrophobicContact CH2-CG 4.11Å; W261-K316 HydrophobicContact CZ2-CD 4.08Å; W261-K316 HydrophobicContact CZ3-CB 3.9Å; W261-K316 HydrophobicContact CZ3-CD 3.73Å; W261-K316 HydrophobicContact CZ3-CG 3.9Å; A312-K316 WeakPolarHBondContact O-CB 3.33Å; A312-K316 PolarHBondContact O-N 3.07Å; Q313-K316 PolarHBondContact O-N 3.29Å; I314-K316 PolarHBondContact O-N 3.45Å
317	K	85.8	Confident	84.5	Confident	134 Å²	134	47 Å²	47	58%	0.583	23%	0.226	S	C	*	.	H	α-helix	trans	-77.1	-40.9	-178.5	-73.1	175	-177.6	178.7	0	112.4	Q313 I314 K319	Q313-K317 WeakPolarHBondContact O-CG 3.47Å; Q313-K317 PolarHBondContact O-N 2.86Å; Q313-K317 VanDerWaalsContact O-N 3.13Å; I314-K317 PolarHBondContact O-N 3.4Å; I314-K317 VanDerWaalsContact O-N 3.1Å; K317-K319 PolarHBondContact O-N 3.42Å
318	L	88.4	Confident	85.6	Confident	5 Å²	5	44.4 Å²	44.4	3%	0.026	21%	0.208	C	C	.	.			trans	-86.3	101	-176.9	-63.1	-177.6	0	0	0	110.1	I314 L323 Y377 M381 Y383 F406	I314-L318 HydrophobicContact CG2-CD1 3.67Å; I314-L318 HydrophobicContact CG2-CG 4.23Å; I314-L318 PolarHBondContact O-N 3.17Å; L318-L323 HydrophobicContact CB-CD1 3.99Å; L318-Y377 HydrophobicContact CB-CE1 4.08Å; L318-Y377 HydrophobicContact CD2-CE1 3.98Å; L318-M381 HydrophobicContact CD2-CB 3.6Å; L318-M381 HydrophobicContact CD2-CE 4.26Å; L318-M381 HydrophobicContact CD2-CG 3.74Å; L318-Y383 HydrophobicContact CD1-CD1 4.35Å; L318-Y383 HydrophobicContact CD1-CD2 4.16Å; L318-Y383 HydrophobicContact CD1-CG 4.04Å; L318-Y383 HydrophobicContact CD2-CD2 3.83Å; L318-Y383 HydrophobicContact CD2-CE2 3.95Å; L318-Y383 HydrophobicContact CG-CD2 4.44Å; L318-Y383 HydrophobicContact CG-CE2 4.5Å; L318-F406 HydrophobicContact CB-CE2 4.03Å; L318-F406 HydrophobicContact CD1-CD2 4.03Å; L318-F406 HydrophobicContact CD1-CE2 4.21Å
319	K	88.6	Confident	86.6	Confident	123 Å²	123	44.4 Å²	44.4	54%	0.535	21%	0.208	S	C	.	.			trans	-115.9	114.8	179.1	-66.5	-173.9	177.4	-173.8	0	110.2	D118 K317 Y377	D118-K319 IonicContact OD2-NZ 2.64Å; K317-K319 PolarHBondContact O-N 3.42Å; K319-Y377 PolarHBondContact N-OH 3.42Å; K319-Y377 VanDerWaalsContact N-OH 3.13Å; K319-Y377 PolarHBondContact O-OH 2.77Å
320	H	91.8	Very high	87.4	Confident	53 Å²	53	41.7 Å²	41.7	25%	0.245	19%	0.194	C	C	.	.			trans	-159	145.7	178.5	-177.2	-96	0	0	0	110.9	K322 L323 Y377	H320-K322 PolarHBondContact ND1-N 3.33Å; H320-K322 VanDerWaalsContact ND1-N 3.14Å; H320-K322 PolarHBondContact O-N 3.33Å; H320-L323 HydrophobicContact CB-CB 4.48Å; H320-L323 HydrophobicContact CB-CD1 4.1Å; H320-L323 HydrophobicContact CB-CG 4Å; H320-L323 PolarHBondContact O-N 3.48Å; H320-Y377 HydrophobicContact CB-CD1 3.57Å; H320-Y377 HydrophobicContact CB-CD2 4.2Å; H320-Y377 HydrophobicContact CB-CE1 3.82Å; H320-Y377 HydrophobicContact CB-CE2 4.42Å; H320-Y377 HydrophobicContact CB-CG 3.76Å; H320-Y377 AromaticContact CD2-CD2 3.83Å; H320-Y377 AromaticContact CD2-CG 3.73Å; H320-Y377 AromaticContact CG-CG 3.79Å
321	D	91	Very high	87.8	Confident	116 Å²	116	37.6 Å²	37.6	62%	0.62	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-17.3	-174.7	-64.2	-7.4	0	0	0	114.8	K402	D321-K402 WeakPolarHBondContact O-CE 3.48Å
322	K	95.6	Very high	88.2	Confident	15 Å²	15	44 Å²	44	7%	0.065	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	13.8	178.6	-52.1	-60.8	-176.8	-87.5	0	112.9	D158 H320 Q370 A373 C401 K402 I403	D158-K322 IonicContact OD1-NZ 2.72Å; D158-K322 PolarHBondContact OD1-NZ 2.76Å; H320-K322 PolarHBondContact ND1-N 3.33Å; H320-K322 VanDerWaalsContact ND1-N 3.14Å; H320-K322 PolarHBondContact O-N 3.33Å; K322-Q370 WeakPolarHBondContact CB-O 3.44Å; K322-Q370 HydrophobicContact CD-CB 4.04Å; K322-Q370 HydrophobicContact CD-CG 4.28Å; K322-A373 HydrophobicContact CG-CB 4.46Å; K322-C401 WeakPolarHBondContact CD-O 2.95Å; K322-K402 CarbonylContact O-C 3.5Å; K322-K402 WeakPolarHBondContact O-CA 3.33Å; K322-I403 PolarHBondContact O-N 3.23Å
323	L	94.9	Very high	88.2	Confident	4 Å²	4	50.4 Å²	50.4	2%	0.021	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-115.6	143	168.9	-59.8	-174.7	0	0	0	109.1	L318 H320 Q325 Y377 I378 I403 F406	L318-L323 HydrophobicContact CB-CD1 3.99Å; H320-L323 HydrophobicContact CB-CB 4.48Å; H320-L323 HydrophobicContact CB-CD1 4.1Å; H320-L323 HydrophobicContact CB-CG 4Å; H320-L323 PolarHBondContact O-N 3.48Å; L323-Q325 PolarHBondContact O-N 2.97Å; L323-Y377 HydrophobicContact CD1-CD1 3.7Å; L323-Y377 HydrophobicContact CD1-CE1 3.84Å; L323-I378 HydrophobicContact CD1-CG1 4.24Å; L323-I378 HydrophobicContact CD2-CD1 3.76Å; L323-I378 HydrophobicContact CD2-CG1 4.19Å; L323-I403 HydrophobicContact CD2-CB 3.74Å; L323-I403 HydrophobicContact CD2-CD1 3.85Å; L323-I403 HydrophobicContact CD2-CG1 4.19Å; L323-I403 HydrophobicContact CD2-CG2 4.42Å; L323-F406 HydrophobicContact CB-CE1 3.93Å; L323-F406 HydrophobicContact CB-CZ 4.04Å; L323-F406 HydrophobicContact CD1-CE2 4.35Å; L323-F406 HydrophobicContact CD1-CZ 4.36Å; L323-F406 HydrophobicContact CD2-CD1 4.45Å
324	V	93.8	Very high	88.3	Confident	5 Å²	5	49.5 Å²	49.5	3%	0.03	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-66.6	124.4	175	171.2	0	0	0	0	109.7	T339 E340 L394 K402 I403 A404 F406	V324-T339 HydrophobicContact CG1-CG2 4.09Å; V324-E340 WeakPolarHBondContact CA-OE1 3.37Å; V324-E340 HydrophobicContact CG1-CG 3.86Å; V324-L394 HydrophobicContact CG2-CD1 3.93Å; V324-L394 HydrophobicContact CG2-CG 4.43Å; V324-K402 HydrophobicContact CG2-CB 3.74Å; V324-I403 WeakPolarHBondContact CG2-O 3.01Å; V324-I403 PolarHBondContact N-O 3.15Å; V324-A404 HydrophobicContact CB-CB 4.45Å; V324-A404 HydrophobicContact CG2-CB 3.85Å; V324-F406 HydrophobicContact CB-CE1 4.45Å; V324-F406 WeakPolarHBondContact O-CE1 3.41Å; V324-F406 WeakPolarHBondContact O-CZ 3.33Å
325	Q	91	Very high	88.3	Confident	44 Å²	44	48.7 Å²	48.7	21%	0.206	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-75.3	128.9	-178.3	-172.4	174.5	-0.3	0	0	111.5	T253 G255 L323 Y327 T339 E340	T253-Q325 PolarHBondContact O-NE2 3.26Å; G255-Q325 VanDerWaalsContact N-NE2 3.18Å; L323-Q325 PolarHBondContact O-N 2.97Å; Q325-Y327 HydrophobicContact CB-CE1 4.35Å; Q325-Y327 HydrophobicContact CG-CD1 4.07Å; Q325-Y327 HydrophobicContact CG-CE1 4.01Å; Q325-T339 WeakPolarHBondContact O-CA 3.37Å; Q325-T339 WeakPolarHBondContact O-CB 3.48Å; Q325-E340 HydrophobicContact CB-CG 4.4Å; Q325-E340 WeakPolarHBondContact CB-OE1 3.34Å; Q325-E340 PolarHBondContact N-OE1 3.08Å; Q325-E340 PolarHBondContact O-N 2.69Å
326	L	90.6	Very high	88.7	Confident	14 Å²	14	49.3 Å²	49.3	7%	0.073	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	129.5	165.1	-179	68.4	0	0	0	109.9	W261 A312 M315 I337 V338 T339	W261-L326 HydrophobicContact CH2-CD2 3.22Å; W261-L326 HydrophobicContact CH2-CG 4.27Å; W261-L326 HydrophobicContact CZ2-CD2 4.44Å; W261-L326 HydrophobicContact CZ3-CD2 3.32Å; W261-L326 HydrophobicContact CZ3-CG 3.91Å; A312-L326 HydrophobicContact CB-CD2 3.94Å; A312-L326 WeakPolarHBondContact O-CD2 3.46Å; M315-L326 HydrophobicContact CB-CB 3.73Å; M315-L326 HydrophobicContact CB-CD2 3.86Å; M315-L326 HydrophobicContact CB-CG 4.36Å; M315-L326 HydrophobicContact CE-CB 4.21Å; L326-I337 HydrophobicContact CD1-CG2 3.69Å; L326-V338 WeakPolarHBondContact CD1-O 3.49Å; L326-T339 HydrophobicContact CD1-CG2 4.2Å
327	Y	90.8	Very high	88.9	Confident	19 Å²	19	44.9 Å²	44.9	8%	0.075	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-52.9	179.4	-81.8	-12.3	0	0	0	111.6	L256 V293 Q325 V338 E340	L256-Y327 HydrophobicContact CD2-CD2 3.64Å; L256-Y327 HydrophobicContact CD2-CE2 4.28Å; L256-Y327 HydrophobicContact CD2-CG 3.89Å; L256-Y327 HydrophobicContact CG-CD2 4.35Å; L256-Y327 HydrophobicContact CG-CG 4.1Å; V293-Y327 HydrophobicContact CG1-CD2 3.91Å; V293-Y327 HydrophobicContact CG1-CE2 4.29Å; Q325-Y327 HydrophobicContact CB-CE1 4.35Å; Q325-Y327 HydrophobicContact CG-CD1 4.07Å; Q325-Y327 HydrophobicContact CG-CE1 4.01Å; Y327-V338 WeakPolarHBondContact CA-O 3.39Å; Y327-V338 WeakPolarHBondContact CB-O 3.38Å; Y327-V338 PolarHBondContact N-O 3.15Å; Y327-E340 HydrophobicContact CE1-CB 4.44Å; Y327-E340 HydrophobicContact CE2-CB 3.93Å
328	A	91.6	Very high	89.3	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	172.3	-177.3	0	0	0	0	0	112.1	L256 A260 W261 V263 V338	L256-A328 HydrophobicContact CD1-CB 3.7Å; A260-A328 WeakPolarHBondContact O-CB 3.49Å; W261-A328 CarbonylContact O-C 3.46Å; W261-A328 WeakPolarHBondContact O-CA 3.19Å; W261-A328 WeakPolarHBondContact O-CB 3.39Å; V263-A328 HydrophobicContact CB-CB 4.46Å; V263-A328 HydrophobicContact CG1-CB 3.76Å; V263-A328 HydrophobicContact CG2-CB 3.9Å; A328-V338 HydrophobicContact CB-CB 4.22Å; A328-V338 HydrophobicContact CB-CG2 4.45Å; A328-V338 PolarHBondContact N-O 3.44Å; A328-V338 WeakPolarHBondContact O-CB 3.26Å; A328-V338 PolarHBondContact O-N 3.4Å
329	V	91.1	Very high	89.6	Confident	1 Å²	1	39 Å²	39	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	154.5	171.3	-62.4	0	0	0	0	111.4	W261 E262 V263 A312 Y336 I337	W261-V329 HydrophobicContact CH2-CG1 4.33Å; W261-V329 HydrophobicContact CZ2-CG1 4.19Å; W261-V329 HydrophobicContact CZ2-CG2 4.17Å; W261-V329 PolarHBondContact O-N 3.44Å; E262-V329 WeakPolarHBondContact CA-O 3.08Å; V263-V329 PolarHBondContact N-O 3.41Å; A312-V329 HydrophobicContact CB-CG1 3.62Å; V329-Y336 CarbonylContact C-O 3.56Å; V329-Y336 VanDerWaalsContact CA-O 3.29Å; V329-Y336 WeakPolarHBondContact CA-O 3.4Å; V329-I337 HydrophobicContact CG1-CG1 4.43Å
330	V	90.8	Very high	89.7	Confident	5 Å²	5	33.3 Å²	33.3	3%	0.03	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	109.6	160.2	-178.4	0	0	0	0	105.8	V263 R265 L268 I335 Y336	V263-V330 HydrophobicContact CG2-CG2 4.05Å; R265-V330 HydrophobicContact CB-CG1 4.25Å; L268-V330 HydrophobicContact CD1-CG2 3.66Å; V330-I335 WeakPolarHBondContact O-CA 3.29Å; V330-I335 WeakPolarHBondContact O-CG2 3.17Å; V330-Y336 HydrophobicContact CB-CG 4.32Å; V330-Y336 HydrophobicContact CG2-CD2 4.05Å; V330-Y336 HydrophobicContact CG2-CG 4.25Å; V330-Y336 PolarHBondContact N-O 2.85Å; V330-Y336 PolarHBondContact O-N 3.37Å; V330-Y336 VanDerWaalsContact O-N 3.08Å
331	S	83.6	Confident	89.8	Confident	40 Å²	40	34.3 Å²	34.3	28%	0.28	17%	0.172	S	C	.	.			trans	-76.9	-29.1	-173.5	70.4	0	0	0	0	113.1	E262	E262-S331 VanDerWaalsContact OE1-CB 3.26Å; E262-S331 WeakPolarHBondContact OE1-CB 3.34Å; E262-S331 PolarHBondContact OE1-OG 2.98Å
332	E	83.2	Confident	90	Very high	139 Å²	139	29.5 Å²	29.5	65%	0.65	15%	0.146	S	C	*	.	S	Bend	trans	-67.1	145.6	177.3	-62.5	-175.4	166.9	0	0	111.5	R265 P334 I335	R265-E332 PolarHBondContact NH2-O 3.34Å; E332-P334 CarbonylContact O-C 3.15Å; E332-P334 VanDerWaalsContact O-O 3.09Å; E332-I335 PolarHBondContact O-N 3.19Å
333	E	80.1	Confident	89.9	Confident	135 Å²	135	32 Å²	32	63%	0.631	16%	0.16	S	C	*	.	S	Bend	trans	-70.1	139.8	176.8	-69.8	-163.7	158.7	0	0	112.2	R265 I335	R265-E333 VanDerWaalsContact NH2-C 3.26Å; R265-E333 PolarHBondContact NH2-O 2.76Å; E333-I335 HydrophobicContact CG-CG1 4.25Å
334	P	82.6	Confident	89.9	Confident	61 Å²	61	34.2 Å²	34.2	40%	0.396	17%	0.169	S	C	.	.	S	Bend	cis	-71.5	131.9	-7.3	29.1	-33.8	0	0	0	112.3	R265 E332 Y336	R265-P334 VanDerWaalsContact CZ-O 3.22Å; R265-P334 PolarHBondContact NH1-O 3.14Å; R265-P334 PolarHBondContact NH2-O 3.22Å; E332-P334 CarbonylContact O-C 3.15Å; E332-P334 VanDerWaalsContact O-O 3.09Å; P334-Y336 HydrophobicContact CB-CE1 4.34Å; P334-Y336 HydrophobicContact CG-CE1 4.02Å; P334-Y336 VanDerWaalsContact O-CD1 3.3Å; P334-Y336 WeakPolarHBondContact O-CD1 3.35Å; P334-Y336 WeakPolarHBondContact O-CE1 3.4Å
335	I	82.8	Confident	90	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.015	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-71.1	134.5	-172.6	-43.9	179.3	0	0	0	110.8	L298 P305 F308 V330 E332 E333	L298-I335 PolarHBondContact N-O 2.99Å; P305-I335 VanDerWaalsContact CA-CD1 3.43Å; P305-I335 HydrophobicContact CB-CD1 3.54Å; P305-I335 HydrophobicContact CG-CD1 3.95Å; F308-I335 HydrophobicContact CB-CD1 4.42Å; F308-I335 HydrophobicContact CD1-CB 4.02Å; F308-I335 HydrophobicContact CD1-CD1 4.41Å; F308-I335 HydrophobicContact CD1-CG2 3.34Å; F308-I335 HydrophobicContact CE1-CB 3.89Å; F308-I335 HydrophobicContact CE1-CG2 3.31Å; F308-I335 HydrophobicContact CG-CG2 4.38Å; F308-I335 HydrophobicContact CZ-CG2 4.4Å; V330-I335 WeakPolarHBondContact O-CA 3.29Å; V330-I335 WeakPolarHBondContact O-CG2 3.17Å; E332-I335 PolarHBondContact O-N 3.19Å; E333-I335 HydrophobicContact CG-CG1 4.25Å
336	Y	90.2	Very high	90.2	Very high	25 Å²	25	34 Å²	34	10%	0.098	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	136.3	177	-64.3	-4.7	0	0	0	111.8	R265 L268 I295 K296 T297 V329 V330 P334	R265-Y336 HydrophobicContact CG-CE2 4.18Å; L268-Y336 HydrophobicContact CD1-CD2 3.85Å; I295-Y336 HydrophobicContact CG2-CD1 4.43Å; I295-Y336 HydrophobicContact CG2-CD2 3.63Å; I295-Y336 HydrophobicContact CG2-CE2 4.19Å; I295-Y336 HydrophobicContact CG2-CG 3.77Å; K296-Y336 WeakPolarHBondContact O-CA 3.41Å; T297-Y336 HydrophobicContact CG2-CD1 3.5Å; T297-Y336 HydrophobicContact CG2-CE1 3.27Å; T297-Y336 HydrophobicContact CG2-CG 4.26Å; V329-Y336 CarbonylContact C-O 3.56Å; V329-Y336 VanDerWaalsContact CA-O 3.29Å; V329-Y336 WeakPolarHBondContact CA-O 3.4Å; V330-Y336 HydrophobicContact CB-CG 4.32Å; V330-Y336 HydrophobicContact CG2-CD2 4.05Å; V330-Y336 HydrophobicContact CG2-CG 4.25Å; V330-Y336 PolarHBondContact N-O 2.85Å; V330-Y336 PolarHBondContact O-N 3.37Å; V330-Y336 VanDerWaalsContact O-N 3.08Å; P334-Y336 HydrophobicContact CB-CE1 4.34Å; P334-Y336 HydrophobicContact CG-CE1 4.02Å; P334-Y336 VanDerWaalsContact O-CD1 3.3Å; P334-Y336 WeakPolarHBondContact O-CD1 3.35Å; P334-Y336 WeakPolarHBondContact O-CE1 3.4Å
337	I	89.3	Confident	90.5	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	123.8	161.6	-83.5	161.6	0	0	0	108	I295 K296 F308 E311 L326 V329 T339	I295-I337 WeakPolarHBondContact CA-O 3.35Å; K296-I337 HydrophobicContact CB-CB 4.24Å; K296-I337 PolarHBondContact N-O 3.08Å; K296-I337 PolarHBondContact O-N 3.08Å; F308-I337 HydrophobicContact CD1-CD1 3.97Å; F308-I337 HydrophobicContact CD1-CG1 4.19Å; F308-I337 HydrophobicContact CD2-CD1 4.16Å; F308-I337 HydrophobicContact CE1-CB 4.22Å; F308-I337 HydrophobicContact CE1-CD1 3.39Å; F308-I337 HydrophobicContact CE1-CG1 3.33Å; F308-I337 HydrophobicContact CE2-CD1 3.56Å; F308-I337 HydrophobicContact CE2-CG1 4.31Å; F308-I337 HydrophobicContact CG-CD1 4.37Å; F308-I337 HydrophobicContact CZ-CB 3.96Å; F308-I337 HydrophobicContact CZ-CD1 3.16Å; F308-I337 HydrophobicContact CZ-CG1 3.41Å; F308-I337 VanDerWaalsContact CZ-CG1 3.41Å; E311-I337 HydrophobicContact CG-CD1 3.71Å; L326-I337 HydrophobicContact CD1-CG2 3.69Å; V329-I337 HydrophobicContact CG1-CG1 4.43Å; I337-T339 HydrophobicContact CG2-CG2 3.72Å
338	V	93.6	Very high	90.8	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	121.3	179.4	-171.5	0	0	0	0	108.5	L268 V293 A294 L326 Y327 A328	L268-V338 HydrophobicContact CD1-CG2 3.66Å; L268-V338 HydrophobicContact CD2-CG1 4.27Å; L268-V338 HydrophobicContact CD2-CG2 4.05Å; V293-V338 HydrophobicContact CB-CG1 3.63Å; V293-V338 HydrophobicContact CG1-CG1 3.75Å; V293-V338 HydrophobicContact CG2-CG1 3.88Å; A294-V338 WeakPolarHBondContact O-CA 3.41Å; L326-V338 WeakPolarHBondContact CD1-O 3.49Å; Y327-V338 WeakPolarHBondContact CA-O 3.39Å; Y327-V338 WeakPolarHBondContact CB-O 3.38Å; Y327-V338 PolarHBondContact N-O 3.15Å; A328-V338 HydrophobicContact CB-CB 4.22Å; A328-V338 HydrophobicContact CB-CG2 4.45Å; A328-V338 PolarHBondContact N-O 3.44Å; A328-V338 WeakPolarHBondContact O-CB 3.26Å; A328-V338 PolarHBondContact O-N 3.4Å
339	T	93.6	Very high	91	Very high	16 Å²	16	38.2 Å²	38.2	10%	0.098	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	169.3	-177.2	51.5	0	0	0	0	110.8	A294 M315 V324 Q325 L326 I337	A294-T339 PolarHBondContact N-O 2.91Å; A294-T339 PolarHBondContact O-N 3.35Å; A294-T339 PolarHBondContact O-OG1 2.71Å; M315-T339 HydrophobicContact CE-CG2 3.72Å; V324-T339 HydrophobicContact CG1-CG2 4.09Å; Q325-T339 WeakPolarHBondContact O-CA 3.37Å; Q325-T339 WeakPolarHBondContact O-CB 3.48Å; L326-T339 HydrophobicContact CD1-CG2 4.2Å; I337-T339 HydrophobicContact CG2-CG2 3.72Å
340	E	92	Very high	91.3	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.009	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	142.6	168.3	62.8	176.1	124.1	0	0	112.2	Q252 V324 Q325 Y327 K402	Q252-E340 PolarHBondContact NE2-OE2 2.9Å; Q252-E340 PolarHBondContact OE1-OE2 3.28Å; Q252-E340 VanDerWaalsContact OE1-OE2 3.08Å; V324-E340 WeakPolarHBondContact CA-OE1 3.37Å; V324-E340 HydrophobicContact CG1-CG 3.86Å; Q325-E340 HydrophobicContact CB-CG 4.4Å; Q325-E340 WeakPolarHBondContact CB-OE1 3.34Å; Q325-E340 PolarHBondContact N-OE1 3.08Å; Q325-E340 PolarHBondContact O-N 2.69Å; Y327-E340 HydrophobicContact CE1-CB 4.44Å; Y327-E340 HydrophobicContact CE2-CB 3.93Å; E340-K402 VanDerWaalsContact OE1-CD 3.26Å; E340-K402 WeakPolarHBondContact OE1-CD 2.87Å; E340-K402 IonicContact OE1-NZ 3.71Å; E340-K402 PolarHBondContact OE1-NZ 3.4Å; E340-K402 IonicContact OE2-NZ 3.08Å; E340-K402 PolarHBondContact OE2-NZ 3.39Å
341	Y	94.6	Very high	91.6	Very high	75 Å²	75	38.2 Å²	38.2	29%	0.294	20%	0.201	S	C	.	.			trans	-88.9	120.3	175.8	172.7	-119.1	0	0	0	111.4	L274 L284 N343	L274-Y341 HydrophobicContact CD1-CD2 4.1Å; L274-Y341 HydrophobicContact CD1-CE2 3.83Å; L274-Y341 HydrophobicContact CD2-CE2 4.28Å; L284-Y341 HydrophobicContact CD1-CD1 3.8Å; L284-Y341 HydrophobicContact CD1-CD2 3.71Å; L284-Y341 HydrophobicContact CD1-CE1 3.9Å; L284-Y341 HydrophobicContact CD1-CE2 3.82Å; L284-Y341 HydrophobicContact CD1-CG 3.69Å; Y341-N343 HydrophobicContact CD1-CB 4.42Å; Y341-N343 HydrophobicContact CE1-CB 3.79Å
342	M	94.7	Very high	92.1	Very high	14 Å²	14	39.7 Å²	39.7	7%	0.069	20%	0.203	C	C	.	.			trans	-98	104.4	177.1	-63.4	-65.9	-77.3	0	0	110.3	K344 G345 L394 K402	M342-K344 VanDerWaalsContact C-N 3.31Å; M342-K344 PolarHBondContact O-N 3.49Å; M342-G345 PolarHBondContact O-N 3.18Å; M342-G345 VanDerWaalsContact O-N 3.11Å; M342-L394 HydrophobicContact CB-CB 3.61Å; M342-L394 HydrophobicContact CB-CD1 4Å; M342-L394 HydrophobicContact CB-CG 4.39Å; M342-L394 HydrophobicContact CE-CB 4.32Å; M342-L394 WeakPolarHBondContact CE-O 3.49Å; M342-L394 HydrophobicContact CG-CB 3.61Å; M342-L394 HydrophobicContact CG-CD1 3.84Å; M342-L394 HydrophobicContact CG-CG 4.39Å; M342-K402 HydrophobicContact CE-CB 3.98Å; M342-K402 HydrophobicContact CE-CD 3.97Å; M342-K402 HydrophobicContact CE-CG 3.8Å; M342-K402 HydrophobicContact SD-CD 4.02Å; M342-K402 HydrophobicContact SD-CG 4.5Å
343	N	93.2	Very high	92.4	Very high	69 Å²	69	39.7 Å²	39.7	37%	0.369	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-15.2	-163	70.6	-40.2	0	0	0	116.2	Y341 N397	Y341-N343 HydrophobicContact CD1-CB 4.42Å; Y341-N343 HydrophobicContact CE1-CB 3.79Å; N343-N397 PolarHBondContact ND2-OD1 3.15Å; N343-N397 PolarHBondContact OD1-N 3.17Å; N343-N397 PolarHBondContact OD1-OD1 3.08Å
344	K	94.8	Very high	92.9	Very high	49 Å²	49	34.7 Å²	34.7	21%	0.213	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	5.4	174.8	-60.9	-176.6	178.4	-79.8	0	113.1	M342 F350 E355 V395 G396	M342-K344 VanDerWaalsContact C-N 3.31Å; M342-K344 PolarHBondContact O-N 3.49Å; K344-F350 HydrophobicContact CB-CD2 4.06Å; K344-F350 HydrophobicContact CB-CE2 4.41Å; K344-F350 HydrophobicContact CD-CD2 4.27Å; K344-F350 HydrophobicContact CD-CE2 3.76Å; K344-F350 HydrophobicContact CD-CZ 4.45Å; K344-E355 IonicContact NZ-OE1 2.71Å; K344-E355 PolarHBondContact NZ-OE1 3.38Å; K344-E355 IonicContact NZ-OE2 2.68Å; K344-E355 PolarHBondContact NZ-OE2 2.93Å; K344-V395 WeakPolarHBondContact CA-O 3.22Å; K344-V395 HydrophobicContact CB-CB 3.93Å; K344-V395 HydrophobicContact CB-CG1 4.03Å; K344-V395 VanDerWaalsContact CB-O 3.3Å; K344-V395 WeakPolarHBondContact CB-O 3.23Å; K344-V395 HydrophobicContact CD-CG1 4.06Å; K344-V395 PolarHBondContact N-O 3.18Å; K344-G396 WeakPolarHBondContact CD-O 3.26Å
345	G	94.9	Very high	93.3	Very high	31 Å²	31	37.9 Å²	37.9	32%	0.32	20%	0.202	S	C	.	.			trans	71	-154.3	174.6	0	0	0	0	0	113.2	M342 L394 V395	M342-G345 PolarHBondContact O-N 3.18Å; M342-G345 VanDerWaalsContact O-N 3.11Å; G345-L394 CarbonylContact O-C 3.29Å; G345-L394 WeakPolarHBondContact O-CA 3.37Å; G345-V395 PolarHBondContact O-N 3.37Å
346	S	96.2	Very high	93.7	Very high	15 Å²	15	37.8 Å²	37.8	11%	0.105	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-71.3	149.1	179.5	80.2	0	0	0	0	111.7	L348 D349 F350 I393	S346-L348 PolarHBondContact O-N 2.7Å; S346-D349 PolarHBondContact O-N 3.49Å; S346-D349 PolarHBondContact OG-N 2.9Å; S346-D349 VanDerWaalsContact OG-N 3.12Å; S346-D349 PolarHBondContact OG-OD2 2.97Å; S346-F350 VanDerWaalsContact O-CB 3.22Å; S346-F350 WeakPolarHBondContact O-CB 3.48Å; S346-F350 PolarHBondContact O-N 3.1Å; S346-I393 CarbonylContact C-O 3.45Å; S346-I393 WeakPolarHBondContact CA-O 3.46Å
347	L	97.9	Very high	93.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.1	-34.7	174.1	175.5	61.8	0	0	0	110.9	F350 L351 M367 S390 I393 V395 L456	L347-F350 HydrophobicContact CD1-CD1 4.27Å; L347-F350 PolarHBondContact O-N 3.31Å; L347-L351 HydrophobicContact CD1-CD1 3.85Å; L347-L351 HydrophobicContact CD1-CD2 4.36Å; L347-L351 HydrophobicContact CD1-CG 3.82Å; L347-L351 HydrophobicContact CG-CD1 3.83Å; L347-L351 HydrophobicContact CG-CG 4.26Å; L347-L351 WeakPolarHBondContact O-CB 3.47Å; L347-L351 WeakPolarHBondContact O-CG 3.41Å; L347-L351 PolarHBondContact O-N 3.41Å; L347-M367 HydrophobicContact CD1-CE 3.24Å; L347-M367 HydrophobicContact CD1-SD 4.23Å; L347-S390 WeakPolarHBondContact CB-O 3.41Å; L347-S390 PolarHBondContact N-O 3.46Å; L347-I393 HydrophobicContact CB-CB 3.79Å; L347-I393 HydrophobicContact CB-CG2 4.06Å; L347-I393 HydrophobicContact CD2-CB 3.98Å; L347-I393 HydrophobicContact CD2-CG1 4.27Å; L347-I393 HydrophobicContact CD2-CG2 4Å; L347-I393 PolarHBondContact N-O 2.78Å; L347-V395 HydrophobicContact CB-CG2 3.96Å; L347-V395 HydrophobicContact CD1-CG2 3.94Å; L347-L456 HydrophobicContact CD1-CD2 4.25Å; L347-L456 HydrophobicContact CD2-CD2 3.99Å; L347-L456 HydrophobicContact CD2-CG 4.46Å
348	L	96.6	Very high	93.9	Very high	33 Å²	33	49.4 Å²	49.4	17%	0.173	26%	0.264	C	S	.	.	H	α-helix	trans	-57.6	-54.1	175.1	-179.5	60	0	0	0	111.9	S346 F350 L351 K352 S390 A391	S346-L348 PolarHBondContact O-N 2.7Å; L348-F350 VanDerWaalsContact C-N 3.34Å; L348-L351 PolarHBondContact O-N 2.89Å; L348-K352 HydrophobicContact CD1-CD 3.98Å; L348-K352 VanDerWaalsContact CD1-CE 3.43Å; L348-K352 HydrophobicContact CD1-CG 4.44Å; L348-K352 HydrophobicContact CG-CD 4.32Å; L348-K352 WeakPolarHBondContact O-CB 3.37Å; L348-K352 WeakPolarHBondContact O-CG 3.38Å; L348-K352 PolarHBondContact O-N 2.68Å; L348-K352 VanDerWaalsContact O-N 3.09Å; L348-S390 WeakPolarHBondContact CB-OG 3.4Å; L348-S390 WeakPolarHBondContact CD1-OG 3.22Å; L348-S390 PolarHBondContact N-O 2.96Å; L348-S390 VanDerWaalsContact N-O 3.14Å; L348-A391 HydrophobicContact CB-CB 4.45Å; L348-A391 HydrophobicContact CD2-CB 4.05Å
349	D	95.8	Very high	93.9	Very high	88 Å²	88	50.9 Å²	50.9	47%	0.471	27%	0.271	S	S	.	.	H	α-helix	trans	-69.4	-38.2	-178.4	-57.2	-37.8	0	0	0	110.3	S346 L351 K352 D353 G354	S346-D349 PolarHBondContact O-N 3.49Å; S346-D349 PolarHBondContact OG-N 2.9Å; S346-D349 VanDerWaalsContact OG-N 3.12Å; S346-D349 PolarHBondContact OG-OD2 2.97Å; D349-L351 VanDerWaalsContact C-N 3.33Å; D349-L351 PolarHBondContact O-N 2.95Å; D349-K352 PolarHBondContact O-N 3.35Å; D349-D353 PolarHBondContact O-N 2.79Å; D349-G354 PolarHBondContact O-N 2.93Å; D349-G354 VanDerWaalsContact O-N 3.08Å
350	F	97.1	Very high	93.8	Very high	6 Å²	6	57.7 Å²	57.7	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-59.3	-41.1	176.1	-179.9	-106.1	0	0	0	112.7	K344 S346 L347 L348 G354 E355 G356 L359 M367 V395 L399	K344-F350 HydrophobicContact CB-CD2 4.06Å; K344-F350 HydrophobicContact CB-CE2 4.41Å; K344-F350 HydrophobicContact CD-CD2 4.27Å; K344-F350 HydrophobicContact CD-CE2 3.76Å; K344-F350 HydrophobicContact CD-CZ 4.45Å; S346-F350 VanDerWaalsContact O-CB 3.22Å; S346-F350 WeakPolarHBondContact O-CB 3.48Å; S346-F350 PolarHBondContact O-N 3.1Å; L347-F350 HydrophobicContact CD1-CD1 4.27Å; L347-F350 PolarHBondContact O-N 3.31Å; L348-F350 VanDerWaalsContact C-N 3.34Å; F350-G354 CarbonylContact O-C 3.57Å; F350-G354 VanDerWaalsContact O-C 3.29Å; F350-G354 VanDerWaalsContact O-CA 3.29Å; F350-G354 WeakPolarHBondContact O-CA 3.31Å; F350-G354 PolarHBondContact O-N 3.13Å; F350-E355 HydrophobicContact CE2-CB 3.8Å; F350-E355 HydrophobicContact CZ-CB 4.21Å; F350-G356 WeakPolarHBondContact O-CA 3.27Å; F350-G356 PolarHBondContact O-N 2.85Å; F350-L359 HydrophobicContact CE1-CD1 3.68Å; F350-L359 HydrophobicContact CZ-CD1 4.19Å; F350-M367 HydrophobicContact CD1-CE 3.98Å; F350-M367 HydrophobicContact CE1-CE 3.83Å; F350-V395 HydrophobicContact CB-CG2 4.23Å; F350-V395 HydrophobicContact CD1-CG1 4.29Å; F350-V395 HydrophobicContact CD1-CG2 4.14Å; F350-V395 HydrophobicContact CD2-CG1 4.5Å; F350-V395 HydrophobicContact CE1-CG1 4.3Å; F350-V395 HydrophobicContact CG-CB 4.42Å; F350-V395 HydrophobicContact CG-CG1 4.39Å; F350-V395 HydrophobicContact CG-CG2 4.22Å; F350-V395 HydrophobicContact CZ-CG1 4.44Å; F350-L399 HydrophobicContact CE1-CD2 4.04Å; F350-L399 HydrophobicContact CZ-CD2 3.57Å
351	L	96.9	Very high	93.8	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-75.1	-38	178.2	-71.8	169.3	0	0	0	113.3	L347 L348 D349 R357 L364 L456 K459	L347-L351 HydrophobicContact CD1-CD1 3.85Å; L347-L351 HydrophobicContact CD1-CD2 4.36Å; L347-L351 HydrophobicContact CD1-CG 3.82Å; L347-L351 HydrophobicContact CG-CD1 3.83Å; L347-L351 HydrophobicContact CG-CG 4.26Å; L347-L351 WeakPolarHBondContact O-CB 3.47Å; L347-L351 WeakPolarHBondContact O-CG 3.41Å; L347-L351 PolarHBondContact O-N 3.41Å; L348-L351 PolarHBondContact O-N 2.89Å; D349-L351 VanDerWaalsContact C-N 3.33Å; D349-L351 PolarHBondContact O-N 2.95Å; L351-R357 WeakPolarHBondContact O-CA 3.45Å; L351-L364 HydrophobicContact CD2-CD2 3.75Å; L351-L456 HydrophobicContact CD1-CD2 4.11Å; L351-K459 HydrophobicContact CD2-CD 4.46Å
352	K	93.9	Very high	93.4	Very high	71 Å²	71	59.4 Å²	59.4	31%	0.309	32%	0.318	S	S	.	.	H	α-helix	trans	-77.8	-54.5	-176.5	-76.8	-178.8	175.9	174.1	0	112.6	L348 D349 G460	L348-K352 HydrophobicContact CD1-CD 3.98Å; L348-K352 VanDerWaalsContact CD1-CE 3.43Å; L348-K352 HydrophobicContact CD1-CG 4.44Å; L348-K352 HydrophobicContact CG-CD 4.32Å; L348-K352 WeakPolarHBondContact O-CB 3.37Å; L348-K352 WeakPolarHBondContact O-CG 3.38Å; L348-K352 PolarHBondContact O-N 2.68Å; L348-K352 VanDerWaalsContact O-N 3.09Å; D349-K352 PolarHBondContact O-N 3.35Å; K352-G460 WeakPolarHBondContact CE-O 3.32Å
353	D	90.1	Very high	93.3	Very high	138 Å²	138	61.7 Å²	61.7	74%	0.738	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.9	-11.4	-163.8	-59.2	-41.9	0	0	0	112.3	D349	D349-D353 PolarHBondContact O-N 2.79Å
354	G	90.6	Very high	93.4	Very high	31 Å²	31	58.8 Å²	58.8	32%	0.32	31%	0.314	S	S	.	.	S	Bend	trans	-99.2	-166.8	180	0	0	0	0	0	115.3	D349 F350 G356 R357	D349-G354 PolarHBondContact O-N 2.93Å; D349-G354 VanDerWaalsContact O-N 3.08Å; F350-G354 CarbonylContact O-C 3.57Å; F350-G354 VanDerWaalsContact O-C 3.29Å; F350-G354 VanDerWaalsContact O-CA 3.29Å; F350-G354 WeakPolarHBondContact O-CA 3.31Å; F350-G354 PolarHBondContact O-N 3.13Å; G354-G356 PolarHBondContact O-N 3.33Å; G354-G356 VanDerWaalsContact O-N 3.17Å; G354-R357 PolarHBondContact O-N 3.24Å
355	E	90.5	Very high	93.4	Very high	128 Å²	128	56.7 Å²	56.7	60%	0.598	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-61.7	-21.8	178.1	-57	161.9	-140.3	0	0	112.5	K344 F350 R357 A358	K344-E355 IonicContact NZ-OE1 2.71Å; K344-E355 PolarHBondContact NZ-OE1 3.38Å; K344-E355 IonicContact NZ-OE2 2.68Å; K344-E355 PolarHBondContact NZ-OE2 2.93Å; F350-E355 HydrophobicContact CE2-CB 3.8Å; F350-E355 HydrophobicContact CZ-CB 4.21Å; E355-R357 PolarHBondContact O-N 2.94Å; E355-R357 VanDerWaalsContact O-N 3.14Å; E355-A358 PolarHBondContact O-N 2.78Å
356	G	91.5	Very high	93.3	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-60.3	-22.2	179.5	0	0	0	0	0	114.4	F350 G354 A358 L359 K459	F350-G356 WeakPolarHBondContact O-CA 3.27Å; F350-G356 PolarHBondContact O-N 2.85Å; G354-G356 PolarHBondContact O-N 3.33Å; G354-G356 VanDerWaalsContact O-N 3.17Å; G356-A358 PolarHBondContact O-N 3.25Å; G356-L359 WeakPolarHBondContact O-CB 3.46Å; G356-L359 PolarHBondContact O-N 3.12Å; G356-K459 PolarHBondContact O-NZ 3.04Å
357	R	92	Very high	93.3	Very high	183 Å²	183	56.2 Å²	56.2	69%	0.691	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-59.7	-35.6	178.2	-171	173	176.7	178	-0.9	112.4	L351 G354 E355	L351-R357 WeakPolarHBondContact O-CA 3.45Å; G354-R357 PolarHBondContact O-N 3.24Å; E355-R357 PolarHBondContact O-N 2.94Å; E355-R357 VanDerWaalsContact O-N 3.14Å
358	A	92.3	Very high	93.3	Very high	89 Å²	89	56.3 Å²	56.3	74%	0.736	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-87	-6	-178.5	0	0	0	0	0	114	E355 G356	E355-A358 PolarHBondContact O-N 2.78Å; G356-A358 PolarHBondContact O-N 3.25Å
359	L	93.3	Very high	93.3	Very high	30 Å²	30	55 Å²	55	16%	0.157	29%	0.289	C	S	.	.			trans	-64.2	141.2	-177.2	-69.9	-177.6	0	0	0	112.2	F350 G356 N363 L364 M367 L399 K459	F350-L359 HydrophobicContact CE1-CD1 3.68Å; F350-L359 HydrophobicContact CZ-CD1 4.19Å; G356-L359 WeakPolarHBondContact O-CB 3.46Å; G356-L359 PolarHBondContact O-N 3.12Å; L359-N363 HydrophobicContact CB-CB 4.09Å; L359-N363 HydrophobicContact CD1-CB 4.15Å; L359-N363 HydrophobicContact CD2-CB 3.94Å; L359-N363 HydrophobicContact CG-CB 4.28Å; L359-L364 HydrophobicContact CB-CD2 4.22Å; L359-M367 HydrophobicContact CD1-SD 3.76Å; L359-L399 HydrophobicContact CD1-CD1 4.26Å; L359-L399 HydrophobicContact CD1-CD2 4.26Å; L359-L399 HydrophobicContact CD2-CD1 3.93Å; L359-K459 PolarHBondContact O-NZ 3.11Å
360	K	91.9	Very high	93.4	Very high	159 Å²	159	51 Å²	51	69%	0.691	27%	0.267	S	S	*	.			trans	-88.3	167.4	175.1	-63.7	-177.7	-178.7	178.3	0	110.4	P362 N363 L364	K360-P362 VanDerWaalsContact C-CD 3.44Å; K360-P362 VanDerWaalsContact C-N 3.32Å; K360-N363 PolarHBondContact O-N 3.31Å; K360-N363 VanDerWaalsContact O-N 3.08Å; K360-L364 PolarHBondContact O-N 2.91Å
361	L	90.4	Very high	93.5	Very high	45 Å²	45	50.7 Å²	50.7	24%	0.236	27%	0.267	C	S	.	.	H	α-helix	trans	-49.7	-42.8	-179.6	-179.9	72.4	0	0	0	114	N363 L364 V365 V457 P489 L492 F521	L361-N363 VanDerWaalsContact C-N 3.3Å; L361-N363 PolarHBondContact O-N 3.12Å; L361-L364 PolarHBondContact O-N 3.4Å; L361-V365 HydrophobicContact CD1-CG2 3.94Å; L361-V365 HydrophobicContact CG-CG2 4.07Å; L361-V365 WeakPolarHBondContact O-CG2 3.29Å; L361-V365 PolarHBondContact O-N 3.18Å; L361-V457 HydrophobicContact CD1-CG1 4.49Å; L361-P489 HydrophobicContact CD1-CG 4.41Å; L361-P489 HydrophobicContact CD2-CG 3.33Å; L361-P489 HydrophobicContact CG-CG 4.49Å; L361-L492 HydrophobicContact CD1-CD2 4.12Å; L361-F521 HydrophobicContact CD2-CE1 4.47Å; L361-F521 HydrophobicContact CD2-CZ 4.03Å; L361-F521 HydrophobicContact CG-CZ 4.13Å
362	P	87.8	Confident	93.5	Very high	69 Å²	69	50.7 Å²	50.7	45%	0.448	27%	0.267	S	S	.	.	H	α-helix	trans	-56.5	-41.3	178.3	-27.6	37	0	0	0	113.9	K360 D366 F521	K360-P362 VanDerWaalsContact C-CD 3.44Å; K360-P362 VanDerWaalsContact C-N 3.32Å; P362-D366 WeakPolarHBondContact O-CB 3.2Å; P362-D366 PolarHBondContact O-N 3.45Å; P362-F521 HydrophobicContact CB-CE2 4.05Å; P362-F521 HydrophobicContact CB-CZ 4.34Å; P362-F521 HydrophobicContact CG-CE2 4.23Å; P362-F521 HydrophobicContact CG-CZ 4.03Å
363	N	91.3	Very high	93.7	Very high	61 Å²	61	47.8 Å²	47.8	33%	0.326	26%	0.255	S	S	.	.	H	α-helix	trans	-67.9	-38.4	176.5	-56	105.4	0	0	0	111.6	L359 K360 L361 D366 M367 L399	L359-N363 HydrophobicContact CB-CB 4.09Å; L359-N363 HydrophobicContact CD1-CB 4.15Å; L359-N363 HydrophobicContact CD2-CB 3.94Å; L359-N363 HydrophobicContact CG-CB 4.28Å; K360-N363 PolarHBondContact O-N 3.31Å; K360-N363 VanDerWaalsContact O-N 3.08Å; L361-N363 VanDerWaalsContact C-N 3.3Å; L361-N363 PolarHBondContact O-N 3.12Å; N363-D366 PolarHBondContact O-N 3.38Å; N363-M367 WeakPolarHBondContact O-CG 3.42Å; N363-M367 PolarHBondContact O-N 3.17Å; N363-L399 HydrophobicContact CB-CD1 4.33Å
364	L	96	Very high	94	Very high	9 Å²	9	41.2 Å²	41.2	5%	0.047	22%	0.22	C	C	.	.	H	α-helix	trans	-67.3	-40.9	179.1	-59.9	176.5	0	0	0	112.1	L351 L359 K360 L361 D366 M367 A368 L456	L351-L364 HydrophobicContact CD2-CD2 3.75Å; L359-L364 HydrophobicContact CB-CD2 4.22Å; K360-L364 PolarHBondContact O-N 2.91Å; L361-L364 PolarHBondContact O-N 3.4Å; L364-D366 VanDerWaalsContact C-N 3.34Å; L364-M367 PolarHBondContact O-N 3.41Å; L364-A368 PolarHBondContact O-N 3.43Å; L364-L456 WeakPolarHBondContact CD1-O 3.38Å; L364-L456 HydrophobicContact CD2-CD2 4.1Å
365	V	94	Very high	94.4	Very high	5 Å²	5	39.7 Å²	39.7	3%	0.03	21%	0.205	C	C	.	.	H	α-helix	trans	-65.2	-40.9	175	172.3	0	0	0	0	110.4	L361 A368 A369 L492 L517 Y520 F521	L361-V365 HydrophobicContact CD1-CG2 3.94Å; L361-V365 HydrophobicContact CG-CG2 4.07Å; L361-V365 WeakPolarHBondContact O-CG2 3.29Å; L361-V365 PolarHBondContact O-N 3.18Å; V365-A368 WeakPolarHBondContact O-CB 3.38Å; V365-A368 PolarHBondContact O-N 3.05Å; V365-A369 PolarHBondContact O-N 3.17Å; V365-L492 HydrophobicContact CG2-CD2 4.27Å; V365-L517 HydrophobicContact CG1-CD2 4.1Å; V365-Y520 HydrophobicContact CG1-CD1 4.09Å; V365-Y520 HydrophobicContact CG1-CG 3.95Å; V365-Y520 HydrophobicContact CG2-CD1 4.17Å; V365-Y520 HydrophobicContact CG2-CE1 4.31Å; V365-F521 HydrophobicContact CB-CE2 3.97Å; V365-F521 HydrophobicContact CG1-CE2 4.11Å; V365-F521 HydrophobicContact CG2-CE2 4.05Å; V365-F521 HydrophobicContact CG2-CZ 4.31Å
366	D	92.6	Very high	94.7	Very high	36 Å²	36	33.8 Å²	33.8	19%	0.193	18%	0.178	C	C	.	.	H	α-helix	trans	-61	-45.3	174.4	-179.9	85.1	0	0	0	112.2	R161 P362 N363 L364 A368 A369 Q370	R161-D366 WeakPolarHBondContact CD-OD2 3.26Å; R161-D366 IonicContact CZ-OD1 3.51Å; R161-D366 IonicContact CZ-OD2 3.76Å; R161-D366 IonicContact NH1-OD1 3.67Å; R161-D366 PolarHBondContact NH1-OD1 3.16Å; R161-D366 IonicContact NH1-OD2 2.76Å; R161-D366 PolarHBondContact NH1-OD2 3.34Å; P362-D366 WeakPolarHBondContact O-CB 3.2Å; P362-D366 PolarHBondContact O-N 3.45Å; N363-D366 PolarHBondContact O-N 3.38Å; L364-D366 VanDerWaalsContact C-N 3.34Å; D366-A368 VanDerWaalsContact C-N 3.3Å; D366-A368 PolarHBondContact O-N 3.05Å; D366-A369 WeakPolarHBondContact O-CB 3.49Å; D366-A369 PolarHBondContact O-N 3.24Å; D366-Q370 WeakPolarHBondContact O-CG 3.48Å; D366-Q370 PolarHBondContact O-N 2.91Å; D366-Q370 PolarHBondContact OD2-NE2 3.05Å
367	M	97.5	Very high	94.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.6	-39.8	174.1	-66.5	173.2	95.2	0	0	111.6	L347 F350 L359 N363 L364 Q370 V371 V395 C401 L456	L347-M367 HydrophobicContact CD1-CE 3.24Å; L347-M367 HydrophobicContact CD1-SD 4.23Å; F350-M367 HydrophobicContact CD1-CE 3.98Å; F350-M367 HydrophobicContact CE1-CE 3.83Å; L359-M367 HydrophobicContact CD1-SD 3.76Å; N363-M367 WeakPolarHBondContact O-CG 3.42Å; N363-M367 PolarHBondContact O-N 3.17Å; L364-M367 PolarHBondContact O-N 3.41Å; M367-Q370 PolarHBondContact O-N 3.49Å; M367-V371 WeakPolarHBondContact O-CG2 3.4Å; M367-V371 PolarHBondContact O-N 2.89Å; M367-V371 VanDerWaalsContact O-N 3.15Å; M367-V395 HydrophobicContact CE-CG1 4.22Å; M367-V395 HydrophobicContact CE-CG2 3.96Å; M367-C401 WeakPolarHBondContact CE-SG 3.48Å; M367-L456 HydrophobicContact CB-CD2 4.21Å
368	A	98.3	Very high	95	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.008	15%	0.151	C	C	.	.	H	α-helix	trans	-62.9	-43.1	173.9	0	0	0	0	0	112.3	L364 V365 D366 Q370 V371 A372 F449 L453 L456 L517	L364-A368 PolarHBondContact O-N 3.43Å; V365-A368 WeakPolarHBondContact O-CB 3.38Å; V365-A368 PolarHBondContact O-N 3.05Å; D366-A368 VanDerWaalsContact C-N 3.3Å; D366-A368 PolarHBondContact O-N 3.05Å; A368-Q370 VanDerWaalsContact C-N 3.31Å; A368-Q370 PolarHBondContact O-N 3.27Å; A368-V371 PolarHBondContact O-N 2.8Å; A368-A372 WeakPolarHBondContact O-CB 3.36Å; A368-A372 PolarHBondContact O-N 3.03Å; A368-F449 HydrophobicContact CB-CZ 4.38Å; A368-L453 HydrophobicContact CB-CD2 3.51Å; A368-L456 HydrophobicContact CB-CD1 3.69Å; A368-L517 HydrophobicContact CB-CD1 3.85Å; A368-L517 HydrophobicContact CB-CD2 4.3Å
369	A	96.1	Very high	95.1	Very high	6 Å²	6	24.1 Å²	24.1	5%	0.05	12%	0.124	C	C	.	.	H	α-helix	trans	-60.7	-41.4	177.2	0	0	0	0	0	111.3	V365 D366 V371 A372 A373 L517 E518	V365-A369 PolarHBondContact O-N 3.17Å; D366-A369 WeakPolarHBondContact O-CB 3.49Å; D366-A369 PolarHBondContact O-N 3.24Å; A369-V371 PolarHBondContact O-N 3.07Å; A369-A372 PolarHBondContact O-N 3.33Å; A369-A373 WeakPolarHBondContact O-CB 3.43Å; A369-A373 PolarHBondContact O-N 2.98Å; A369-L517 HydrophobicContact CB-CB 3.78Å; A369-E518 HydrophobicContact CB-CG 4.07Å
370	Q	97.4	Very high	95.2	Very high	3 Å²	3	30.2 Å²	30.2	1%	0.014	15%	0.145	C	C	.	.	H	α-helix	trans	-60.9	-44.2	175.2	-69.3	-176	63.2	0	0	112.5	R161 K322 D366 M367 A368 A373 G374 L399 C401	R161-Q370 VanDerWaalsContact NH1-CD 3.33Å; K322-Q370 WeakPolarHBondContact CB-O 3.44Å; K322-Q370 HydrophobicContact CD-CB 4.04Å; K322-Q370 HydrophobicContact CD-CG 4.28Å; D366-Q370 WeakPolarHBondContact O-CG 3.48Å; D366-Q370 PolarHBondContact O-N 2.91Å; D366-Q370 PolarHBondContact OD2-NE2 3.05Å; M367-Q370 PolarHBondContact O-N 3.49Å; A368-Q370 VanDerWaalsContact C-N 3.31Å; A368-Q370 PolarHBondContact O-N 3.27Å; Q370-A373 PolarHBondContact O-N 3.13Å; Q370-G374 PolarHBondContact O-N 3.31Å; Q370-G374 VanDerWaalsContact O-N 3.15Å; Q370-L399 PolarHBondContact NE2-O 2.95Å; Q370-L399 VanDerWaalsContact NE2-O 3.08Å; Q370-C401 HydrophobicContact CB-CB 4.02Å
371	V	98.6	Very high	95.3	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	13%	0.13	C	C	.	.	H	α-helix	trans	-66.1	-41.9	175.9	176.2	0	0	0	0	110.8	M367 A368 A369 A373 G374 M375 L388 I393 C401 I403 F449 L452	M367-V371 WeakPolarHBondContact O-CG2 3.4Å; M367-V371 PolarHBondContact O-N 2.89Å; M367-V371 VanDerWaalsContact O-N 3.15Å; A368-V371 PolarHBondContact O-N 2.8Å; A369-V371 PolarHBondContact O-N 3.07Å; V371-A373 VanDerWaalsContact C-N 3.33Å; V371-A373 PolarHBondContact O-N 3.38Å; V371-G374 PolarHBondContact O-N 3.49Å; V371-M375 PolarHBondContact O-N 3.35Å; V371-L388 HydrophobicContact CG1-CD1 4.09Å; V371-I393 HydrophobicContact CG1-CD1 3.9Å; V371-I393 HydrophobicContact CG2-CD1 3.9Å; V371-I393 HydrophobicContact CG2-CG1 3.99Å; V371-I393 HydrophobicContact CG2-CG2 3.85Å; V371-C401 HydrophobicContact CG2-CB 4.34Å; V371-I403 HydrophobicContact CG1-CD1 4.38Å; V371-I403 HydrophobicContact CG1-CG1 4.36Å; V371-F449 HydrophobicContact CB-CE2 4.15Å; V371-F449 HydrophobicContact CG1-CD2 4.09Å; V371-F449 HydrophobicContact CG1-CE2 3.94Å; V371-L452 HydrophobicContact CG1-CD1 4.1Å
372	A	98.3	Very high	95.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.4	-41.5	175.7	0	0	0	0	0	111.9	A368 A369 G374 M375 A376 F449 L513 Q514 L517	A368-A372 WeakPolarHBondContact O-CB 3.36Å; A368-A372 PolarHBondContact O-N 3.03Å; A369-A372 PolarHBondContact O-N 3.33Å; A372-G374 PolarHBondContact O-N 3.08Å; A372-M375 CarbonylContact O-C 3.46Å; A372-M375 PolarHBondContact O-N 2.9Å; A372-A376 WeakPolarHBondContact O-CB 3.42Å; A372-A376 PolarHBondContact O-N 3.34Å; A372-F449 HydrophobicContact CB-CE2 4.08Å; A372-F449 HydrophobicContact CB-CZ 3.82Å; A372-L513 HydrophobicContact CB-CB 4.39Å; A372-Q514 HydrophobicContact CB-CB 4.07Å; A372-L517 HydrophobicContact CB-CD1 4.18Å
373	A	96.9	Very high	95.4	Very high	9 Å²	9	27 Å²	27	7%	0.074	13%	0.129	C	C	.	.	H	α-helix	trans	-61.7	-42.3	175.8	0	0	0	0	0	112.5	K322 A369 Q370 V371 A376 Y377 Q514	K322-A373 HydrophobicContact CG-CB 4.46Å; A369-A373 WeakPolarHBondContact O-CB 3.43Å; A369-A373 PolarHBondContact O-N 2.98Å; Q370-A373 PolarHBondContact O-N 3.13Å; V371-A373 VanDerWaalsContact C-N 3.33Å; V371-A373 PolarHBondContact O-N 3.38Å; A373-A376 PolarHBondContact O-N 2.82Å; A373-Y377 PolarHBondContact O-N 3.28Å; A373-Y377 VanDerWaalsContact O-N 3.11Å; A373-Q514 HydrophobicContact CB-CG 4.09Å
374	G	97.4	Very high	95.3	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.4	-42.3	173.5	0	0	0	0	0	112.7	Q370 V371 A372 Y377 I378	Q370-G374 PolarHBondContact O-N 3.31Å; Q370-G374 VanDerWaalsContact O-N 3.15Å; V371-G374 PolarHBondContact O-N 3.49Å; A372-G374 PolarHBondContact O-N 3.08Å; G374-Y377 WeakPolarHBondContact O-CB 3.45Å; G374-Y377 PolarHBondContact O-N 3.39Å; G374-I378 PolarHBondContact O-N 3.29Å; G374-I378 VanDerWaalsContact O-N 3.07Å
375	M	97.9	Very high	95.1	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-71.9	-32.1	177.4	-72.1	-58	-55	0	0	113.4	V371 A372 Y377 I378 E379 H385 L388 I403 I442 D445 F510	V371-M375 PolarHBondContact O-N 3.35Å; A372-M375 CarbonylContact O-C 3.46Å; A372-M375 PolarHBondContact O-N 2.9Å; M375-Y377 VanDerWaalsContact C-N 3.29Å; M375-Y377 PolarHBondContact O-N 3.44Å; M375-I378 HydrophobicContact CE-CG2 4.24Å; M375-I378 PolarHBondContact O-N 2.83Å; M375-I378 HydrophobicContact SD-CD1 3.81Å; M375-E379 WeakPolarHBondContact O-CB 3.47Å; M375-E379 PolarHBondContact O-N 2.82Å; M375-H385 HydrophobicContact CE-CB 3.86Å; M375-H385 HydrophobicContact SD-CB 3.98Å; M375-L388 HydrophobicContact CE-CD2 4.33Å; M375-L388 HydrophobicContact CG-CD1 4.27Å; M375-L388 HydrophobicContact CG-CD2 3.84Å; M375-L388 HydrophobicContact SD-CD1 4.04Å; M375-L388 HydrophobicContact SD-CD2 4.01Å; M375-I403 HydrophobicContact CG-CD1 3.73Å; M375-I403 HydrophobicContact SD-CD1 3.85Å; M375-I442 HydrophobicContact CE-CD1 3.97Å; M375-D445 HydrophobicContact CE-CB 3.68Å; M375-F510 HydrophobicContact CB-CB 4.23Å; M375-F510 HydrophobicContact CB-CD1 3.32Å; M375-F510 HydrophobicContact CB-CD2 3.78Å; M375-F510 HydrophobicContact CB-CE1 3.4Å; M375-F510 VanDerWaalsContact CB-CE1 3.4Å; M375-F510 HydrophobicContact CB-CE2 3.85Å; M375-F510 HydrophobicContact CB-CG 3.51Å; M375-F510 HydrophobicContact CB-CZ 3.66Å; M375-F510 HydrophobicContact CE-CD2 4.32Å; M375-F510 HydrophobicContact CE-CE2 3.59Å; M375-F510 HydrophobicContact CE-CZ 3.74Å; M375-F510 HydrophobicContact CG-CD1 4.18Å; M375-F510 HydrophobicContact CG-CE1 3.75Å; M375-F510 HydrophobicContact CG-CE2 4.35Å; M375-F510 HydrophobicContact CG-CZ 3.84Å
376	A	97.3	Very high	94.8	Very high	3 Å²	3	25 Å²	25	3%	0.025	12%	0.116	C	C	.	.	H	α-helix	trans	-65.3	-35.2	172.6	0	0	0	0	0	111.2	A372 A373 R380 F510	A372-A376 WeakPolarHBondContact O-CB 3.42Å; A372-A376 PolarHBondContact O-N 3.34Å; A373-A376 PolarHBondContact O-N 2.82Å; A376-R380 WeakPolarHBondContact O-CG 3.5Å; A376-R380 PolarHBondContact O-N 2.97Å; A376-R380 PolarHBondContact O-NE 3.4Å; A376-F510 HydrophobicContact CB-CB 3.88Å
377	Y	96.4	Very high	94.6	Very high	33 Å²	33	24.7 Å²	24.7	13%	0.129	11%	0.114	C	C	.	.	H	α-helix	trans	-65.1	-47.2	169.1	175.7	-97.5	0	0	0	112	L318 K319 H320 L323 A373 G374 M375 E379 R380 M381	L318-Y377 HydrophobicContact CB-CE1 4.08Å; L318-Y377 HydrophobicContact CD2-CE1 3.98Å; K319-Y377 PolarHBondContact N-OH 3.42Å; K319-Y377 VanDerWaalsContact N-OH 3.13Å; K319-Y377 PolarHBondContact O-OH 2.77Å; H320-Y377 HydrophobicContact CB-CD1 3.57Å; H320-Y377 HydrophobicContact CB-CD2 4.2Å; H320-Y377 HydrophobicContact CB-CE1 3.82Å; H320-Y377 HydrophobicContact CB-CE2 4.42Å; H320-Y377 HydrophobicContact CB-CG 3.76Å; H320-Y377 AromaticContact CD2-CD2 3.83Å; H320-Y377 AromaticContact CD2-CG 3.73Å; H320-Y377 AromaticContact CG-CG 3.79Å; L323-Y377 HydrophobicContact CD1-CD1 3.7Å; L323-Y377 HydrophobicContact CD1-CE1 3.84Å; A373-Y377 PolarHBondContact O-N 3.28Å; A373-Y377 VanDerWaalsContact O-N 3.11Å; G374-Y377 WeakPolarHBondContact O-CB 3.45Å; G374-Y377 PolarHBondContact O-N 3.39Å; M375-Y377 VanDerWaalsContact C-N 3.29Å; M375-Y377 PolarHBondContact O-N 3.44Å; Y377-E379 VanDerWaalsContact C-N 3.31Å; Y377-E379 PolarHBondContact O-N 2.71Å; Y377-R380 PolarHBondContact O-N 3.24Å; Y377-M381 HydrophobicContact CD1-CG 4.3Å; Y377-M381 HydrophobicContact CD2-CG 4.3Å; Y377-M381 HydrophobicContact CE1-CG 3.89Å; Y377-M381 HydrophobicContact CE2-CG 3.87Å; Y377-M381 HydrophobicContact CE2-SD 4.11Å; Y377-M381 HydrophobicContact CG-CG 4.5Å; Y377-M381 VanDerWaalsContact O-CG 3.29Å; Y377-M381 WeakPolarHBondContact O-CG 3.45Å; Y377-M381 PolarHBondContact O-N 3.3Å
378	I	94.2	Very high	94.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-57	-44	175.9	-73.5	172.9	0	0	0	111.5	L323 G374 M375 M381 N382 Y383 I403 F406	L323-I378 HydrophobicContact CD1-CG1 4.24Å; L323-I378 HydrophobicContact CD2-CD1 3.76Å; L323-I378 HydrophobicContact CD2-CG1 4.19Å; G374-I378 PolarHBondContact O-N 3.29Å; G374-I378 VanDerWaalsContact O-N 3.07Å; M375-I378 HydrophobicContact CE-CG2 4.24Å; M375-I378 PolarHBondContact O-N 2.83Å; M375-I378 HydrophobicContact SD-CD1 3.81Å; I378-M381 PolarHBondContact O-N 2.79Å; I378-N382 PolarHBondContact O-N 3.08Å; I378-Y383 VanDerWaalsContact CG2-O 3.26Å; I378-Y383 WeakPolarHBondContact CG2-O 3.35Å; I378-Y383 PolarHBondContact O-N 3.31Å; I378-Y383 VanDerWaalsContact O-N 3.08Å; I378-I403 HydrophobicContact CD1-CD1 4.47Å; I378-F406 HydrophobicContact CD1-CB 4.37Å
379	E	94.4	Very high	94.4	Very high	36 Å²	36	27.8 Å²	27.8	17%	0.168	13%	0.126	C	C	.	.	H	α-helix	trans	-57.9	-50.9	175.5	178.2	170.4	-120.9	0	0	111.3	M375 Y377 M381 N382 I442 F510	M375-E379 WeakPolarHBondContact O-CB 3.47Å; M375-E379 PolarHBondContact O-N 2.82Å; Y377-E379 VanDerWaalsContact C-N 3.31Å; Y377-E379 PolarHBondContact O-N 2.71Å; E379-M381 PolarHBondContact O-N 3.22Å; E379-N382 PolarHBondContact O-N 3.4Å; E379-I442 HydrophobicContact CB-CD1 3.97Å; E379-I442 HydrophobicContact CB-CG1 3.86Å; E379-I442 HydrophobicContact CG-CG1 3.9Å; E379-F510 PolarHBondContact OE2-N 3.31Å
380	R	95.2	Very high	94.4	Very high	158 Å²	158	27.5 Å²	27.5	60%	0.596	12%	0.123	S	C	*	.	H	α-helix	trans	-61.9	-28.9	177.7	-73.6	-177.9	-60.9	-173.5	1.6	113.6	A376 Y377 N382	A376-R380 WeakPolarHBondContact O-CG 3.5Å; A376-R380 PolarHBondContact O-N 2.97Å; A376-R380 PolarHBondContact O-NE 3.4Å; Y377-R380 PolarHBondContact O-N 3.24Å; R380-N382 VanDerWaalsContact C-N 3.27Å
381	M	92.6	Very high	94.3	Very high	76 Å²	76	28.6 Å²	28.6	37%	0.374	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	0.4	177	-63.1	-58.1	-65	0	0	112.9	L318 Y377 I378 E379 Y383	L318-M381 HydrophobicContact CD2-CB 3.6Å; L318-M381 HydrophobicContact CD2-CE 4.26Å; L318-M381 HydrophobicContact CD2-CG 3.74Å; Y377-M381 HydrophobicContact CD1-CG 4.3Å; Y377-M381 HydrophobicContact CD2-CG 4.3Å; Y377-M381 HydrophobicContact CE1-CG 3.89Å; Y377-M381 HydrophobicContact CE2-CG 3.87Å; Y377-M381 HydrophobicContact CE2-SD 4.11Å; Y377-M381 HydrophobicContact CG-CG 4.5Å; Y377-M381 VanDerWaalsContact O-CG 3.29Å; Y377-M381 WeakPolarHBondContact O-CG 3.45Å; Y377-M381 PolarHBondContact O-N 3.3Å; I378-M381 PolarHBondContact O-N 2.79Å; E379-M381 PolarHBondContact O-N 3.22Å; M381-Y383 HydrophobicContact CB-CD2 3.88Å; M381-Y383 HydrophobicContact CB-CE2 4.39Å; M381-Y383 WeakPolarHBondContact O-CD2 3.49Å; M381-Y383 WeakPolarHBondContact O-CE2 3.43Å
382	N	89.7	Confident	94.1	Very high	110 Å²	110	29 Å²	29	59%	0.588	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	39.5	-177.7	-56.9	-58.8	0	0	0	114.1	I378 E379 R380 I412	I378-N382 PolarHBondContact O-N 3.08Å; E379-N382 PolarHBondContact O-N 3.4Å; R380-N382 VanDerWaalsContact C-N 3.27Å; N382-I412 PolarHBondContact O-N 2.98Å
383	Y	90.4	Very high	94.1	Very high	19 Å²	19	29 Å²	29	8%	0.075	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	160.6	173.4	-77.3	-95.5	0	0	0	111.8	I314 L318 I378 M381 A409 L411	I314-Y383 HydrophobicContact CB-CE1 4.49Å; I314-Y383 HydrophobicContact CD1-CE1 4.06Å; I314-Y383 HydrophobicContact CG1-CE1 3.93Å; I314-Y383 HydrophobicContact CG2-CD1 4.09Å; I314-Y383 HydrophobicContact CG2-CE1 3.88Å; L318-Y383 HydrophobicContact CD1-CD1 4.35Å; L318-Y383 HydrophobicContact CD1-CD2 4.16Å; L318-Y383 HydrophobicContact CD1-CG 4.04Å; L318-Y383 HydrophobicContact CD2-CD2 3.83Å; L318-Y383 HydrophobicContact CD2-CE2 3.95Å; L318-Y383 HydrophobicContact CG-CD2 4.44Å; L318-Y383 HydrophobicContact CG-CE2 4.5Å; I378-Y383 VanDerWaalsContact CG2-O 3.26Å; I378-Y383 WeakPolarHBondContact CG2-O 3.35Å; I378-Y383 PolarHBondContact O-N 3.31Å; I378-Y383 VanDerWaalsContact O-N 3.08Å; M381-Y383 HydrophobicContact CB-CD2 3.88Å; M381-Y383 HydrophobicContact CB-CE2 4.39Å; M381-Y383 WeakPolarHBondContact O-CD2 3.49Å; M381-Y383 WeakPolarHBondContact O-CE2 3.43Å; Y383-A409 HydrophobicContact CD1-CB 4.3Å; Y383-L411 HydrophobicContact CE1-CB 4.09Å; Y383-L411 HydrophobicContact CE1-CD1 4.37Å; Y383-L411 HydrophobicContact CE2-CD1 4.01Å
384	I	89.6	Confident	94.1	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	132.1	172.3	43.9	167.8	0	0	0	111.3	R386 A409 R410 I412 F440 I442 D445	I384-R386 HydrophobicContact CB-CG 4.16Å; I384-R386 HydrophobicContact CD1-CG 3.81Å; I384-R386 HydrophobicContact CG1-CG 4.03Å; I384-A409 WeakPolarHBondContact O-CA 3.05Å; I384-A409 WeakPolarHBondContact O-CB 3.37Å; I384-R410 WeakPolarHBondContact CG1-O 3.37Å; I384-I412 HydrophobicContact CB-CD1 4.24Å; I384-I412 HydrophobicContact CD1-CD1 3.94Å; I384-I412 HydrophobicContact CD1-CG1 4.12Å; I384-I412 HydrophobicContact CG1-CD1 3.89Å; I384-I412 HydrophobicContact CG1-CG1 4.01Å; I384-I412 HydrophobicContact CG2-CD1 3.4Å; I384-I412 HydrophobicContact CG2-CG1 4.37Å; I384-F440 HydrophobicContact CD1-CB 3.77Å; I384-I442 HydrophobicContact CG2-CB 4.37Å; I384-I442 VanDerWaalsContact CG2-N 3.26Å; I384-D445 WeakPolarHBondContact CA-OD2 3.3Å
385	H	91.4	Very high	94.1	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.141	C	C	.	.			trans	-75.7	-44.7	-178.1	-171.7	-73.6	0	0	0	112.9	M375 D387 L388 I403 A404 D445	M375-H385 HydrophobicContact CE-CB 3.86Å; M375-H385 HydrophobicContact SD-CB 3.98Å; H385-D387 VanDerWaalsContact CE1-C 3.43Å; H385-D387 PolarHBondContact CE1-O 2.95Å; H385-D387 PolarHBondContact ND1-N 2.61Å; H385-D387 PolarHBondContact ND1-O 3.06Å; H385-D387 PolarHBondContact O-N 2.92Å; H385-L388 PolarHBondContact ND1-N 3.34Å; H385-L388 VanDerWaalsContact ND1-N 3.18Å; H385-I403 VanDerWaalsContact CD2-CG2 3.4Å; H385-I403 WeakPolarHBondContact CD2-CG2 3.29Å; H385-I403 WeakPolarHBondContact NE2-CG2 3.4Å; H385-A404 PolarHBondContact NE2-O 2.82Å; H385-A404 VanDerWaalsContact NE2-O 3.12Å; H385-D445 PolarHBondContact N-OD2 3.21Å
386	R	88.5	Confident	93.9	Very high	33 Å²	33	30.8 Å²	30.8	13%	0.125	14%	0.144	C	C	.	.	S	Bend	trans	70.2	-20.3	176.3	-51.4	170.2	62.4	-155.6	-3	117.3	I384 F440 D445	I384-R386 HydrophobicContact CB-CG 4.16Å; I384-R386 HydrophobicContact CD1-CG 3.81Å; I384-R386 HydrophobicContact CG1-CG 4.03Å; R386-F440 HydrophobicContact CB-CD1 4.02Å; R386-F440 HydrophobicContact CB-CE1 4.29Å; R386-F440 HydrophobicContact CG-CB 4.3Å; R386-F440 HydrophobicContact CG-CD1 3.93Å; R386-F440 HydrophobicContact CG-CG 4.28Å; R386-D445 WeakPolarHBondContact CA-OD1 3.37Å; R386-D445 PolarHBondContact N-OD1 3Å
387	D	88.5	Confident	93.4	Very high	29 Å²	29	35.8 Å²	35.8	16%	0.155	17%	0.171	C	C	.	.			trans	-129.9	47.4	174.3	-168.3	11.9	0	0	0	112.4	H385 R389 N392 P426	H385-D387 VanDerWaalsContact CE1-C 3.43Å; H385-D387 PolarHBondContact CE1-O 2.95Å; H385-D387 PolarHBondContact ND1-N 2.61Å; H385-D387 PolarHBondContact ND1-O 3.06Å; H385-D387 PolarHBondContact O-N 2.92Å; D387-R389 PolarHBondContact O-N 2.72Å; D387-R389 WeakPolarHBondContact OD1-CD 3.48Å; D387-R389 IonicContact OD1-CZ 3.35Å; D387-R389 IonicContact OD1-NE 3.12Å; D387-R389 PolarHBondContact OD1-NE 3.12Å; D387-R389 IonicContact OD1-NH2 3.5Å; D387-R389 IonicContact OD2-CZ 2.7Å; D387-R389 IonicContact OD2-NE 2.77Å; D387-R389 IonicContact OD2-NH2 3.41Å; D387-R389 PolarHBondContact OD2-NH2 2.9Å; D387-R389 VanDerWaalsContact OD2-NH2 3.09Å; D387-N392 PolarHBondContact O-ND2 3.02Å; D387-N392 PolarHBondContact OD2-ND2 3.4Å; D387-P426 WeakPolarHBondContact OD1-CG 3.38Å
388	L	95.6	Very high	92.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.191	C	C	.	.			trans	-77.9	113.4	-179	-177	66.9	0	0	0	110.7	V371 M375 H385 I393 S448 F449 L452 F510	V371-L388 HydrophobicContact CG1-CD1 4.09Å; M375-L388 HydrophobicContact CE-CD2 4.33Å; M375-L388 HydrophobicContact CG-CD1 4.27Å; M375-L388 HydrophobicContact CG-CD2 3.84Å; M375-L388 HydrophobicContact SD-CD1 4.04Å; M375-L388 HydrophobicContact SD-CD2 4.01Å; H385-L388 PolarHBondContact ND1-N 3.34Å; H385-L388 VanDerWaalsContact ND1-N 3.18Å; L388-I393 HydrophobicContact CD1-CD1 3.97Å; L388-S448 WeakPolarHBondContact O-CB 3.5Å; L388-F449 HydrophobicContact CD2-CB 3.83Å; L388-F449 HydrophobicContact CD2-CD2 4.19Å; L388-L452 HydrophobicContact CD1-CD1 4.2Å; L388-L452 HydrophobicContact CG-CD1 4.19Å; L388-F510 HydrophobicContact CD2-CE1 4.47Å; L388-F510 HydrophobicContact CD2-CZ 4.16Å
389	R	96	Very high	92.8	Very high	67 Å²	67	38.4 Å²	38.4	25%	0.253	20%	0.199	S	C	.	.	S	Bend	trans	-162.6	164.5	178.3	55.4	-178.3	167.9	120.9	9.8	111.2	D387 A391 N392 I393 W429	D387-R389 PolarHBondContact O-N 2.72Å; D387-R389 WeakPolarHBondContact OD1-CD 3.48Å; D387-R389 IonicContact OD1-CZ 3.35Å; D387-R389 IonicContact OD1-NE 3.12Å; D387-R389 PolarHBondContact OD1-NE 3.12Å; D387-R389 IonicContact OD1-NH2 3.5Å; D387-R389 IonicContact OD2-CZ 2.7Å; D387-R389 IonicContact OD2-NE 2.77Å; D387-R389 IonicContact OD2-NH2 3.41Å; D387-R389 PolarHBondContact OD2-NH2 2.9Å; D387-R389 VanDerWaalsContact OD2-NH2 3.09Å; R389-A391 HydrophobicContact CG-CB 4.23Å; R389-A391 PolarHBondContact O-N 2.82Å; R389-A391 VanDerWaalsContact O-N 3.07Å; R389-N392 PolarHBondContact O-N 2.78Å; R389-I393 PolarHBondContact O-N 3.44Å; R389-W429 VanDerWaalsContact CB-CD1 3.4Å; R389-W429 HydrophobicContact CB-CD2 4.27Å; R389-W429 HydrophobicContact CB-CG 3.96Å
390	S	97.1	Very high	92.7	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-57.6	-26.3	-178.5	71.2	0	0	0	0	114.4	L347 L348 N392 I393 E455	L347-S390 WeakPolarHBondContact CB-O 3.41Å; L347-S390 PolarHBondContact N-O 3.46Å; L348-S390 WeakPolarHBondContact CB-OG 3.4Å; L348-S390 WeakPolarHBondContact CD1-OG 3.22Å; L348-S390 PolarHBondContact N-O 2.96Å; L348-S390 VanDerWaalsContact N-O 3.14Å; S390-N392 PolarHBondContact O-N 2.81Å; S390-I393 PolarHBondContact O-N 2.96Å; S390-E455 WeakPolarHBondContact CB-OE1 3.45Å; S390-E455 PolarHBondContact N-OE2 2.91Å; S390-E455 PolarHBondContact OG-OE1 3Å
391	A	93.7	Very high	92.8	Very high	26 Å²	26	31.5 Å²	31.5	22%	0.215	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-66.6	-24.9	175	0	0	0	0	0	113.7	L348 R389	L348-A391 HydrophobicContact CB-CB 4.45Å; L348-A391 HydrophobicContact CD2-CB 4.05Å; R389-A391 HydrophobicContact CG-CB 4.23Å; R389-A391 PolarHBondContact O-N 2.82Å; R389-A391 VanDerWaalsContact O-N 3.07Å
392	N	94.9	Very high	93.1	Very high	9 Å²	9	29 Å²	29	5%	0.048	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-106.3	10.9	-178.1	-65	-7.6	0	0	0	112.2	D387 R389 S390 A404	D387-N392 PolarHBondContact O-ND2 3.02Å; D387-N392 PolarHBondContact OD2-ND2 3.4Å; R389-N392 PolarHBondContact O-N 2.78Å; S390-N392 PolarHBondContact O-N 2.81Å; N392-A404 WeakPolarHBondContact O-CB 3.48Å; N392-A404 PolarHBondContact O-N 3.29Å
393	I	98.1	Very high	93.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	129.9	166.9	-53.3	-52.9	0	0	0	107.1	S346 L347 V371 L388 R389 S390 C401 I403 L452	S346-I393 CarbonylContact C-O 3.45Å; S346-I393 WeakPolarHBondContact CA-O 3.46Å; L347-I393 HydrophobicContact CB-CB 3.79Å; L347-I393 HydrophobicContact CB-CG2 4.06Å; L347-I393 HydrophobicContact CD2-CB 3.98Å; L347-I393 HydrophobicContact CD2-CG1 4.27Å; L347-I393 HydrophobicContact CD2-CG2 4Å; L347-I393 PolarHBondContact N-O 2.78Å; V371-I393 HydrophobicContact CG1-CD1 3.9Å; V371-I393 HydrophobicContact CG2-CD1 3.9Å; V371-I393 HydrophobicContact CG2-CG1 3.99Å; V371-I393 HydrophobicContact CG2-CG2 3.85Å; L388-I393 HydrophobicContact CD1-CD1 3.97Å; R389-I393 PolarHBondContact O-N 3.44Å; S390-I393 PolarHBondContact O-N 2.96Å; I393-C401 HydrophobicContact CG2-CB 3.93Å; I393-I403 HydrophobicContact CD1-CB 4.23Å; I393-I403 HydrophobicContact CD1-CG1 3.82Å; I393-I403 HydrophobicContact CD1-CG2 4.27Å; I393-L452 HydrophobicContact CD1-CD1 4.28Å; I393-L452 HydrophobicContact CG1-CD1 3.86Å
394	L	97.4	Very high	93.5	Very high	40 Å²	40	23.2 Å²	23.2	21%	0.209	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	143.7	176	-59.8	-175.4	0	0	0	110.9	V324 M342 G345 C401 K402 A404	V324-L394 HydrophobicContact CG2-CD1 3.93Å; V324-L394 HydrophobicContact CG2-CG 4.43Å; M342-L394 HydrophobicContact CB-CB 3.61Å; M342-L394 HydrophobicContact CB-CD1 4Å; M342-L394 HydrophobicContact CB-CG 4.39Å; M342-L394 HydrophobicContact CE-CB 4.32Å; M342-L394 WeakPolarHBondContact CE-O 3.49Å; M342-L394 HydrophobicContact CG-CB 3.61Å; M342-L394 HydrophobicContact CG-CD1 3.84Å; M342-L394 HydrophobicContact CG-CG 4.39Å; G345-L394 CarbonylContact O-C 3.29Å; G345-L394 WeakPolarHBondContact O-CA 3.37Å; L394-C401 WeakPolarHBondContact O-CA 3.44Å; L394-K402 PolarHBondContact N-O 2.99Å; L394-K402 PolarHBondContact O-N 2.84Å; L394-A404 HydrophobicContact CD1-CB 3.9Å; L394-A404 HydrophobicContact CG-CB 3.81Å
395	V	97.2	Very high	93.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.8	-177.3	-171.2	0	0	0	0	109.9	K344 G345 L347 F350 M367 I400	K344-V395 WeakPolarHBondContact CA-O 3.22Å; K344-V395 HydrophobicContact CB-CB 3.93Å; K344-V395 HydrophobicContact CB-CG1 4.03Å; K344-V395 VanDerWaalsContact CB-O 3.3Å; K344-V395 WeakPolarHBondContact CB-O 3.23Å; K344-V395 HydrophobicContact CD-CG1 4.06Å; K344-V395 PolarHBondContact N-O 3.18Å; G345-V395 PolarHBondContact O-N 3.37Å; L347-V395 HydrophobicContact CB-CG2 3.96Å; L347-V395 HydrophobicContact CD1-CG2 3.94Å; F350-V395 HydrophobicContact CB-CG2 4.23Å; F350-V395 HydrophobicContact CD1-CG1 4.29Å; F350-V395 HydrophobicContact CD1-CG2 4.14Å; F350-V395 HydrophobicContact CD2-CG1 4.5Å; F350-V395 HydrophobicContact CE1-CG1 4.3Å; F350-V395 HydrophobicContact CG-CB 4.42Å; F350-V395 HydrophobicContact CG-CG1 4.39Å; F350-V395 HydrophobicContact CG-CG2 4.22Å; F350-V395 HydrophobicContact CZ-CG1 4.44Å; M367-V395 HydrophobicContact CE-CG1 4.22Å; M367-V395 HydrophobicContact CE-CG2 3.96Å; V395-I400 CarbonylContact C-O 3.52Å; V395-I400 WeakPolarHBondContact CA-O 3.45Å
396	G	92.9	Very high	92.2	Very high	6 Å²	6	25.7 Å²	25.7	6%	0.062	15%	0.147	C	C	.	.			trans	-111.7	-170.8	177.1	0	0	0	0	0	112.6	K344 L399 I400	K344-G396 WeakPolarHBondContact CD-O 3.26Å; G396-L399 PolarHBondContact O-N 3.29Å; G396-I400 PolarHBondContact N-O 3.42Å
397	N	87.9	Confident	90.7	Very high	109 Å²	109	24.4 Å²	24.4	58%	0.583	14%	0.143	S	C	*	.	G	3₁₀ helix	trans	-59.3	148.6	171.6	-70.8	-32.7	0	0	0	111.4	N343 L399 I400	N343-N397 PolarHBondContact ND2-OD1 3.15Å; N343-N397 PolarHBondContact OD1-N 3.17Å; N343-N397 PolarHBondContact OD1-OD1 3.08Å; N397-L399 PolarHBondContact O-N 3.02Å; N397-I400 WeakPolarHBondContact O-CG1 3.37Å; N397-I400 PolarHBondContact O-N 3.49Å
398	G	85.6	Confident	89.1	Confident	53 Å²	53	27 Å²	27	55%	0.546	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	66.9	19.9	-178.6	0	0	0	0	0	114.7	I400	G398-I400 PolarHBondContact O-N 3.36Å
399	L	91.7	Very high	87	Confident	35 Å²	35	27.1 Å²	27.1	18%	0.183	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	61.8	24.7	-176.7	-51.2	177.8	0	0	0	113.9	F350 L359 N363 Q370 G396 N397 C401	F350-L399 HydrophobicContact CE1-CD2 4.04Å; F350-L399 HydrophobicContact CZ-CD2 3.57Å; L359-L399 HydrophobicContact CD1-CD1 4.26Å; L359-L399 HydrophobicContact CD1-CD2 4.26Å; L359-L399 HydrophobicContact CD2-CD1 3.93Å; N363-L399 HydrophobicContact CB-CD1 4.33Å; Q370-L399 PolarHBondContact NE2-O 2.95Å; Q370-L399 VanDerWaalsContact NE2-O 3.08Å; G396-L399 PolarHBondContact O-N 3.29Å; N397-L399 PolarHBondContact O-N 3.02Å; L399-C401 PolarHBondContact O-N 3.2Å
400	I	93.2	Very high	85.2	Confident	48 Å²	48	29.3 Å²	29.3	25%	0.246	17%	0.166	C	C	.	.			trans	-63.7	127	173.4	-65.3	-65.9	0	0	0	109.5	V395 G396 N397 G398 K402	V395-I400 CarbonylContact C-O 3.52Å; V395-I400 WeakPolarHBondContact CA-O 3.45Å; G396-I400 PolarHBondContact N-O 3.42Å; N397-I400 WeakPolarHBondContact O-CG1 3.37Å; N397-I400 PolarHBondContact O-N 3.49Å; G398-I400 PolarHBondContact O-N 3.36Å; I400-K402 HydrophobicContact CG2-CG 4.2Å
401	C	97.3	Very high	82.9	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.007	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.5	176.7	-64.8	0	0	0	0	110	K322 M367 Q370 V371 I393 L394 L399	K322-C401 WeakPolarHBondContact CD-O 2.95Å; M367-C401 WeakPolarHBondContact CE-SG 3.48Å; Q370-C401 HydrophobicContact CB-CB 4.02Å; V371-C401 HydrophobicContact CG2-CB 4.34Å; I393-C401 HydrophobicContact CG2-CB 3.93Å; L394-C401 WeakPolarHBondContact O-CA 3.44Å; L399-C401 PolarHBondContact O-N 3.2Å
402	K	97.6	Very high	81	Confident	22 Å²	22	33.8 Å²	33.8	10%	0.096	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	137.7	173.4	-62.9	-172.5	172.4	-172.3	0	110.5	D321 K322 V324 E340 M342 L394 I400	D321-K402 WeakPolarHBondContact O-CE 3.48Å; K322-K402 CarbonylContact O-C 3.5Å; K322-K402 WeakPolarHBondContact O-CA 3.33Å; V324-K402 HydrophobicContact CG2-CB 3.74Å; E340-K402 VanDerWaalsContact OE1-CD 3.26Å; E340-K402 WeakPolarHBondContact OE1-CD 2.87Å; E340-K402 IonicContact OE1-NZ 3.71Å; E340-K402 PolarHBondContact OE1-NZ 3.4Å; E340-K402 IonicContact OE2-NZ 3.08Å; E340-K402 PolarHBondContact OE2-NZ 3.39Å; M342-K402 HydrophobicContact CE-CB 3.98Å; M342-K402 HydrophobicContact CE-CD 3.97Å; M342-K402 HydrophobicContact CE-CG 3.8Å; M342-K402 HydrophobicContact SD-CD 4.02Å; M342-K402 HydrophobicContact SD-CG 4.5Å; L394-K402 PolarHBondContact N-O 2.99Å; L394-K402 PolarHBondContact O-N 2.84Å; I400-K402 HydrophobicContact CG2-CG 4.2Å
403	I	96.9	Very high	78.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	126	176.3	-54.1	170.2	0	0	0	108.4	K322 L323 V324 V371 M375 I378 H385 I393 F406	K322-I403 PolarHBondContact O-N 3.23Å; L323-I403 HydrophobicContact CD2-CB 3.74Å; L323-I403 HydrophobicContact CD2-CD1 3.85Å; L323-I403 HydrophobicContact CD2-CG1 4.19Å; L323-I403 HydrophobicContact CD2-CG2 4.42Å; V324-I403 WeakPolarHBondContact CG2-O 3.01Å; V324-I403 PolarHBondContact N-O 3.15Å; V371-I403 HydrophobicContact CG1-CD1 4.38Å; V371-I403 HydrophobicContact CG1-CG1 4.36Å; M375-I403 HydrophobicContact CG-CD1 3.73Å; M375-I403 HydrophobicContact SD-CD1 3.85Å; I378-I403 HydrophobicContact CD1-CD1 4.47Å; H385-I403 VanDerWaalsContact CD2-CG2 3.4Å; H385-I403 WeakPolarHBondContact CD2-CG2 3.29Å; H385-I403 WeakPolarHBondContact NE2-CG2 3.4Å; I393-I403 HydrophobicContact CD1-CB 4.23Å; I393-I403 HydrophobicContact CD1-CG1 3.82Å; I393-I403 HydrophobicContact CD1-CG2 4.27Å; I403-F406 WeakPolarHBondContact O-CD1 3.47Å; I403-F406 WeakPolarHBondContact O-CE1 3.42Å
404	A	92.1	Very high	76.3	Confident	9 Å²	9	48 Å²	48	7%	0.074	26%	0.257	C	S	.	.			trans	-109.5	172.5	175.2	0	0	0	0	0	110.7	V324 H385 N392 L394 F406	V324-A404 HydrophobicContact CB-CB 4.45Å; V324-A404 HydrophobicContact CG2-CB 3.85Å; H385-A404 PolarHBondContact NE2-O 2.82Å; H385-A404 VanDerWaalsContact NE2-O 3.12Å; N392-A404 WeakPolarHBondContact O-CB 3.48Å; N392-A404 PolarHBondContact O-N 3.29Å; L394-A404 HydrophobicContact CD1-CB 3.9Å; L394-A404 HydrophobicContact CG-CB 3.81Å; A404-F406 PolarHBondContact O-N 2.87Å
405	D	81.9	Confident	74.1	Confident	53 Å²	53	52.6 Å²	52.6	28%	0.283	28%	0.281	S	S	.	.			trans	54.7	16.8	176.3	-71.6	-32.3	0	0	0	115.6	K296 G407 L408	K296-D405 IonicContact NZ-OD1 2.95Å; K296-D405 PolarHBondContact NZ-OD1 3.49Å; D405-G407 PolarHBondContact O-N 3.17Å; D405-G407 VanDerWaalsContact O-N 3.09Å; D405-L408 PolarHBondContact O-N 3.45Å
406	F	71.6	Confident	71.8	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-67.5	-0.8	164.6	68.4	-89.2	0	0	0	112.2	M315 L318 L323 V324 I378 I403 A404 L408 A409	M315-F406 HydrophobicContact CB-CE2 4.08Å; M315-F406 HydrophobicContact CB-CZ 4.17Å; M315-F406 HydrophobicContact CE-CE1 4.25Å; M315-F406 HydrophobicContact CE-CZ 4.16Å; M315-F406 HydrophobicContact CG-CD2 4.27Å; M315-F406 HydrophobicContact CG-CE2 3.7Å; M315-F406 HydrophobicContact CG-CZ 3.86Å; L318-F406 HydrophobicContact CB-CE2 4.03Å; L318-F406 HydrophobicContact CD1-CD2 4.03Å; L318-F406 HydrophobicContact CD1-CE2 4.21Å; L323-F406 HydrophobicContact CB-CE1 3.93Å; L323-F406 HydrophobicContact CB-CZ 4.04Å; L323-F406 HydrophobicContact CD1-CE2 4.35Å; L323-F406 HydrophobicContact CD1-CZ 4.36Å; L323-F406 HydrophobicContact CD2-CD1 4.45Å; V324-F406 HydrophobicContact CB-CE1 4.45Å; V324-F406 WeakPolarHBondContact O-CE1 3.41Å; V324-F406 WeakPolarHBondContact O-CZ 3.33Å; I378-F406 HydrophobicContact CD1-CB 4.37Å; I403-F406 WeakPolarHBondContact O-CD1 3.47Å; I403-F406 WeakPolarHBondContact O-CE1 3.42Å; A404-F406 PolarHBondContact O-N 2.87Å; F406-L408 PolarHBondContact O-N 2.84Å; F406-A409 WeakPolarHBondContact O-CA 3.44Å; F406-A409 WeakPolarHBondContact O-CB 3.19Å; F406-A409 PolarHBondContact O-N 3.08Å
407	G	56.3	Low	69.9	Low	5 Å²	5	59.7 Å²	59.7	5%	0.052	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-61.7	-24.5	168.2	0	0	0	0	0	114.5	E311 D405 A409	E311-G407 WeakPolarHBondContact CA-O 3.3Å; E311-G407 VanDerWaalsContact CB-O 3.25Å; E311-G407 WeakPolarHBondContact CB-O 3.38Å; E311-G407 VanDerWaalsContact CG-CA 3.48Å; D405-G407 PolarHBondContact O-N 3.17Å; D405-G407 VanDerWaalsContact O-N 3.09Å; G407-A409 PolarHBondContact O-N 3.47Å
408	L	56	Low	68.5	Low	83 Å²	83	59 Å²	59	44%	0.435	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-81.6	0.4	170.6	-61	178.4	0	0	0	113	D405 F406	D405-L408 PolarHBondContact O-N 3.45Å; F406-L408 PolarHBondContact O-N 2.84Å
409	A	52.3	Low	67.1	Low	4 Å²	4	57.4 Å²	57.4	3%	0.033	29%	0.293	C	S	.	.			trans	-61.7	155.6	173	0	0	0	0	0	110.7	I314 Y383 I384 F406 G407	I314-A409 WeakPolarHBondContact CD1-O 3.2Å; I314-A409 HydrophobicContact CG2-CB 4.46Å; Y383-A409 HydrophobicContact CD1-CB 4.3Å; I384-A409 WeakPolarHBondContact O-CA 3.05Å; I384-A409 WeakPolarHBondContact O-CB 3.37Å; F406-A409 WeakPolarHBondContact O-CA 3.44Å; F406-A409 WeakPolarHBondContact O-CB 3.19Å; F406-A409 PolarHBondContact O-N 3.08Å; G407-A409 PolarHBondContact O-N 3.47Å
410	R	58.2	Low	65	Low	112 Å²	112	66.4 Å²	66.4	42%	0.423	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	142.7	177.3	-67	-169.5	174.8	-168.7	-2.3	109.7	I384 Y417	I384-R410 WeakPolarHBondContact CG1-O 3.37Å; R410-Y417 PolarHBondContact NH1-OH 3.48Å
411	L	47.3	Very low	62.5	Low	91 Å²	91	74 Å²	74	48%	0.476	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	135.5	170.1	-176.2	67.3	0	0	0	108.5	Y383	Y383-L411 HydrophobicContact CE1-CB 4.09Å; Y383-L411 HydrophobicContact CE1-CD1 4.37Å; Y383-L411 HydrophobicContact CE2-CD1 4.01Å
412	I	53.6	Low	60	Low	30 Å²	30	77.8 Å²	77.8	15%	0.154	40%	0.398	C	S	.	.			trans	-101.9	119.8	173.4	-64.3	-175.5	0	0	0	108	N382 I384	N382-I412 PolarHBondContact O-N 2.98Å; I384-I412 HydrophobicContact CB-CD1 4.24Å; I384-I412 HydrophobicContact CD1-CD1 3.94Å; I384-I412 HydrophobicContact CD1-CG1 4.12Å; I384-I412 HydrophobicContact CG1-CD1 3.89Å; I384-I412 HydrophobicContact CG1-CG1 4.01Å; I384-I412 HydrophobicContact CG2-CD1 3.4Å; I384-I412 HydrophobicContact CG2-CG1 4.37Å
413	E	47.4	Very low	57.9	Low	165 Å²	165	79.2 Å²	79.2	77%	0.771	41%	0.414	S	S	*	.	S	Bend	trans	-91.1	-32.2	172.3	-66.7	-178.2	172.2	0	0	111.7
414	D	48.6	Very low	56.4	Low	143 Å²	143	88.4 Å²	88.4	77%	0.765	45%	0.454	S	S	*	.	S	Bend	trans	-134	45.4	-173.2	-69	-44.1	0	0	0	114.1	E416	D414-E416 PolarHBondContact O-N 2.97Å
415	N	50.7	Low	55.4	Low	135 Å²	135	90.6 Å²	90.6	72%	0.722	46%	0.462	S	S	*	.	S	Bend	trans	56.6	-7.2	176.3	-70.5	-16.4	0	0	0	119.1	T441	N415-T441 WeakPolarHBondContact O-CG2 3.46Å
416	E	48	Very low	55.6	Low	101 Å²	101	89.4 Å²	89.4	47%	0.472	46%	0.457	S	S	.	.			trans	-140.4	140.3	177.1	-67.4	-168.9	157.2	0	0	112.4	D414 R439 T441	D414-E416 PolarHBondContact O-N 2.97Å; E416-R439 IonicContact OE1-CZ 2.76Å; E416-R439 IonicContact OE1-NH1 3.09Å; E416-R439 PolarHBondContact OE1-NH1 3.33Å; E416-R439 IonicContact OE2-CZ 3.69Å; E416-R439 IonicContact OE2-NE 3.67Å; E416-R439 IonicContact OE2-NH1 2.79Å; E416-T441 HydrophobicContact CG-CG2 4.24Å
417	Y	54.2	Low	56.6	Low	54 Å²	54	91.3 Å²	91.3	21%	0.212	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.1	166.6	172.3	-96.7	0	0	0	110.6	R410 A419 R439 F440	R410-Y417 PolarHBondContact NH1-OH 3.48Å; Y417-A419 HydrophobicContact CE1-CB 4.05Å; Y417-R439 WeakPolarHBondContact O-CA 3.47Å; Y417-F440 HydrophobicContact CD1-CB 4.5Å; Y417-F440 HydrophobicContact CD1-CD2 4.2Å; Y417-F440 PolarHBondContact N-O 2.72Å; Y417-F440 PolarHBondContact O-N 3.17Å
418	T	57.9	Low	58.5	Low	94 Å²	94	92.1 Å²	92.1	58%	0.577	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	118.4	175.1	-56.1	0	0	0	0	111.6	G438	T418-G438 VanDerWaalsContact CA-O 3.31Å; T418-G438 WeakPolarHBondContact CA-O 3.47Å
419	A	55.3	Low	60.4	Low	21 Å²	21	89.8 Å²	89.8	17%	0.174	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-72.2	149.8	177.9	0	0	0	0	0	114.1	Y417 F425 G438 F440	Y417-A419 HydrophobicContact CE1-CB 4.05Å; A419-F425 HydrophobicContact CB-CE2 4.2Å; A419-F425 HydrophobicContact CB-CZ 3.9Å; A419-G438 PolarHBondContact N-O 3.34Å; A419-F440 HydrophobicContact CB-CD2 4.42Å; A419-F440 HydrophobicContact CB-CE2 3.9Å
420	R	49.5	Very low	62.4	Low	223 Å²	223	90.1 Å²	90.1	84%	0.842	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-72.7	144.1	173.3	-64.1	-176.7	-178.5	178.7	1.3	110.8	G422	R420-G422 PolarHBondContact O-N 3.14Å
421	Q	38.9	Very low	64.2	Low	207 Å²	207	84.8 Å²	84.8	97%	0.967	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	133.7	175.5	-76.8	178	-14.1	0	0	111.5
422	G	46.2	Very low	66.5	Low	81 Å²	81	81.2 Å²	81.2	84%	0.835	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.8	0.6	175	0	0	0	0	0	116.7	R420	R420-G422 PolarHBondContact O-N 3.14Å
423	A	53.9	Low	68.4	Low	52 Å²	52	80.9 Å²	80.9	43%	0.43	42%	0.416	S	S	.	.			trans	-72.1	133.6	176.2	0	0	0	0	0	112.3	F425	A423-F425 HydrophobicContact CB-CD2 4.19Å; A423-F425 HydrophobicContact CB-CE1 3.99Å; A423-F425 HydrophobicContact CB-CE2 3.35Å; A423-F425 HydrophobicContact CB-CZ 3.22Å; A423-F425 WeakPolarHBondContact O-CD2 3.48Å
424	K	64.3	Low	70.5	Confident	193 Å²	193	73.1 Å²	73.1	84%	0.839	38%	0.38	S	S	*	.			trans	-84.1	113	175.4	-69.1	-177.6	-179.5	177.8	0	109.2
425	F	71	Confident	72.4	Confident	56 Å²	56	67.6 Å²	67.6	25%	0.246	36%	0.355	C	S	.	.			trans	-114.1	154.8	176.7	-58.8	-67.3	0	0	0	111.2	A419 A423 I427 F440	A419-F425 HydrophobicContact CB-CE2 4.2Å; A419-F425 HydrophobicContact CB-CZ 3.9Å; A423-F425 HydrophobicContact CB-CD2 4.19Å; A423-F425 HydrophobicContact CB-CE1 3.99Å; A423-F425 HydrophobicContact CB-CE2 3.35Å; A423-F425 HydrophobicContact CB-CZ 3.22Å; A423-F425 WeakPolarHBondContact O-CD2 3.48Å; F425-I427 PolarHBondContact O-N 3.3Å; F425-F440 HydrophobicContact CD1-CZ 4.18Å; F425-F440 HydrophobicContact CD2-CZ 4.47Å; F425-F440 HydrophobicContact CE1-CZ 4.03Å; F425-F440 HydrophobicContact CE2-CE2 4.49Å; F425-F440 HydrophobicContact CE2-CZ 4.3Å; F425-F440 HydrophobicContact CG-CZ 4.4Å; F425-F440 HydrophobicContact CZ-CE2 4.21Å; F425-F440 HydrophobicContact CZ-CZ 4.07Å
426	P	87.1	Confident	74.2	Confident	27 Å²	27	64.1 Å²	64.1	18%	0.175	34%	0.336	C	S	.	.			trans	-72.6	77.1	174.2	35.2	-40.8	0	0	0	110.4	D387 K428 W429 T430	D387-P426 WeakPolarHBondContact OD1-CG 3.38Å; P426-K428 PolarHBondContact O-N 3.17Å; P426-W429 HydrophobicContact CB-CE3 3.88Å; P426-W429 HydrophobicContact CG-CB 4.48Å; P426-W429 PolarHBondContact O-N 3.29Å; P426-T430 PolarHBondContact O-N 3.25Å; P426-T430 PolarHBondContact O-OG1 2.69Å; P426-T430 VanDerWaalsContact O-OG1 3.13Å
427	I	91.3	Very high	76.1	Confident	41 Å²	41	66.3 Å²	66.3	21%	0.21	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.7	-36.7	-170.4	-63	-60.5	0	0	0	114.3	F425 W429 T430 N469	F425-I427 PolarHBondContact O-N 3.3Å; I427-W429 PolarHBondContact O-N 3.27Å; I427-T430 PolarHBondContact O-N 3.14Å; I427-N469 HydrophobicContact CB-CB 3.98Å; I427-N469 HydrophobicContact CG1-CB 4.16Å; I427-N469 HydrophobicContact CG2-CB 4.01Å; I427-N469 WeakPolarHBondContact CG2-O 3.26Å
428	K	96.3	Very high	77.6	Confident	22 Å²	22	64.2 Å²	64.2	10%	0.096	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-17.3	-179.3	-62.7	-172.7	165.4	-154.5	0	114.7	P426 V462 P463 Y464 M467 V472	P426-K428 PolarHBondContact O-N 3.17Å; K428-V462 HydrophobicContact CD-CG1 4.09Å; K428-P463 HydrophobicContact CB-CB 4.35Å; K428-P463 WeakPolarHBondContact CD-O 3.38Å; K428-P463 PolarHBondContact NZ-O 2.76Å; K428-Y464 HydrophobicContact CB-CD2 4.15Å; K428-Y464 HydrophobicContact CG-CD2 4.4Å; K428-Y464 PolarHBondContact NZ-O 3.09Å; K428-Y464 WeakPolarHBondContact O-CE2 3.45Å; K428-M467 VanDerWaalsContact CE-O 3.25Å; K428-M467 WeakPolarHBondContact CE-O 3.27Å; K428-M467 PolarHBondContact NZ-O 2.94Å; K428-V472 HydrophobicContact CG-CG2 4.28Å
429	W	96.9	Very high	79.1	Confident	33 Å²	33	65.2 Å²	65.2	13%	0.125	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-21	175.9	-70.1	-100.9	0	0	0	112.1	R389 P426 I427 W447 S448 I451 E455 P463	R389-W429 VanDerWaalsContact CB-CD1 3.4Å; R389-W429 HydrophobicContact CB-CD2 4.27Å; R389-W429 HydrophobicContact CB-CG 3.96Å; P426-W429 HydrophobicContact CB-CE3 3.88Å; P426-W429 HydrophobicContact CG-CB 4.48Å; P426-W429 PolarHBondContact O-N 3.29Å; I427-W429 PolarHBondContact O-N 3.27Å; W429-W447 VanDerWaalsContact O-CD1 3.28Å; W429-S448 WeakPolarHBondContact O-CA 3.47Å; W429-S448 PolarHBondContact O-OG 2.84Å; W429-I451 HydrophobicContact CD2-CG2 4.31Å; W429-I451 HydrophobicContact CG-CB 4.42Å; W429-I451 HydrophobicContact CG-CG2 3.88Å; W429-E455 WeakPolarHBondContact CZ2-OE1 3.33Å; W429-E455 PolarHBondContact NE1-OE2 3.26Å; W429-P463 HydrophobicContact CD2-CG 4.45Å; W429-P463 HydrophobicContact CH2-CG 4.13Å; W429-P463 VanDerWaalsContact CZ2-CD 3.44Å; W429-P463 HydrophobicContact CZ2-CG 3.61Å
430	T	94.6	Very high	80.7	Confident	11 Å²	11	64.3 Å²	64.3	7%	0.067	32%	0.321	C	S	.	.	S	Bend	trans	-76.2	133.6	-174.5	-49.8	0	0	0	0	111.7	P426 I427 A434 A435 F440	P426-T430 PolarHBondContact O-N 3.25Å; P426-T430 PolarHBondContact O-OG1 2.69Å; P426-T430 VanDerWaalsContact O-OG1 3.13Å; I427-T430 PolarHBondContact O-N 3.14Å; T430-A434 HydrophobicContact CG2-CB 3.65Å; T430-A435 HydrophobicContact CG2-CB 3.95Å; T430-F440 HydrophobicContact CG2-CE1 4.28Å; T430-F440 HydrophobicContact CG2-CZ 4.44Å
431	A	96.3	Very high	82.7	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.008	29%	0.287	C	S	.	.			trans	-61.4	149.5	173.4	0	0	0	0	0	111.7	E433 A434 A435 W447	A431-E433 VanDerWaalsContact C-N 3.33Å; A431-E433 WeakPolarHBondContact CB-OE1 3.48Å; A431-E433 WeakPolarHBondContact CB-OE2 3.39Å; A431-E433 PolarHBondContact O-N 3.47Å; A431-A434 HydrophobicContact CB-CB 4.36Å; A431-A434 PolarHBondContact O-N 2.98Å; A431-A434 VanDerWaalsContact O-N 3.1Å; A431-A435 PolarHBondContact O-N 3.13Å; A431-W447 HydrophobicContact CB-CB 3.69Å; A431-W447 HydrophobicContact CB-CD2 4.04Å; A431-W447 HydrophobicContact CB-CE3 4.46Å; A431-W447 HydrophobicContact CB-CG 3.67Å
432	P	94.6	Very high	85.4	Confident	16 Å²	16	46.2 Å²	46.2	10%	0.104	25%	0.248	C	C	.	.	H	α-helix	trans	-59.7	-40.1	-174.9	22.4	-32.7	0	0	0	113	A434 A435 L436 W447 V476	P432-A434 VanDerWaalsContact C-N 3.32Å; P432-A434 PolarHBondContact O-N 2.76Å; P432-A435 PolarHBondContact O-N 2.61Å; P432-L436 VanDerWaalsContact O-CB 3.27Å; P432-L436 WeakPolarHBondContact O-CB 3.38Å; P432-L436 VanDerWaalsContact O-CG 3.29Å; P432-L436 WeakPolarHBondContact O-CG 3.36Å; P432-L436 PolarHBondContact O-N 2.96Å; P432-W447 HydrophobicContact CG-CH2 4.19Å; P432-W447 HydrophobicContact CG-CZ3 4.09Å; P432-V476 HydrophobicContact CB-CG1 4.22Å; P432-V476 HydrophobicContact CG-CG1 4.26Å
433	E	93.9	Very high	87.9	Confident	22 Å²	22	43.5 Å²	43.5	10%	0.103	21%	0.213	C	C	.	.	H	α-helix	trans	-65.6	-34.6	177.4	71.5	-73.2	175.5	0	0	112.9	A431 Y437 G438 R439 P504 R507	A431-E433 VanDerWaalsContact C-N 3.33Å; A431-E433 WeakPolarHBondContact CB-OE1 3.48Å; A431-E433 WeakPolarHBondContact CB-OE2 3.39Å; A431-E433 PolarHBondContact O-N 3.47Å; E433-Y437 HydrophobicContact CB-CD2 4.31Å; E433-Y437 WeakPolarHBondContact O-CA 3.48Å; E433-Y437 WeakPolarHBondContact O-CB 3.34Å; E433-Y437 PolarHBondContact O-N 2.59Å; E433-G438 PolarHBondContact O-N 3.45Å; E433-R439 PolarHBondContact O-N 3.38Å; E433-P504 HydrophobicContact CG-CG 4.04Å; E433-R507 IonicContact OE1-CZ 3.13Å; E433-R507 IonicContact OE1-NH1 2.97Å; E433-R507 PolarHBondContact OE1-NH1 3.21Å; E433-R507 IonicContact OE1-NH2 3.42Å; E433-R507 PolarHBondContact OE1-NH2 3.4Å; E433-R507 IonicContact OE2-CZ 3.84Å; E433-R507 IonicContact OE2-NH1 3.73Å; E433-R507 IonicContact OE2-NH2 2.71Å; E433-R507 PolarHBondContact OE2-NH2 3.08Å
434	A	91.3	Very high	89.9	Confident	2 Å²	2	41.1 Å²	41.1	2%	0.017	19%	0.194	C	C	.	.	H	α-helix	trans	-73.9	-38.5	176.4	0	0	0	0	0	111.5	T430 A431 P432 G438 R439 F440	T430-A434 HydrophobicContact CG2-CB 3.65Å; A431-A434 HydrophobicContact CB-CB 4.36Å; A431-A434 PolarHBondContact O-N 2.98Å; A431-A434 VanDerWaalsContact O-N 3.1Å; P432-A434 VanDerWaalsContact C-N 3.32Å; P432-A434 PolarHBondContact O-N 2.76Å; A434-G438 WeakPolarHBondContact O-CA 3.31Å; A434-G438 PolarHBondContact O-N 3.07Å; A434-G438 VanDerWaalsContact O-N 3.14Å; A434-R439 VanDerWaalsContact CA-O 3.29Å; A434-R439 WeakPolarHBondContact CA-O 3.41Å; A434-R439 WeakPolarHBondContact CB-O 3.39Å; A434-F440 HydrophobicContact CB-CD1 3.91Å; A434-F440 HydrophobicContact CB-CD2 4.43Å; A434-F440 HydrophobicContact CB-CE1 3.84Å; A434-F440 HydrophobicContact CB-CE2 4.34Å; A434-F440 HydrophobicContact CB-CG 4.22Å; A434-F440 HydrophobicContact CB-CZ 4.06Å
435	A	89.2	Confident	91.5	Very high	28 Å²	28	32 Å²	32	23%	0.231	15%	0.154	C	C	.	.	H	α-helix	trans	-74	-40.2	179.3	0	0	0	0	0	113.1	T430 A431 P432 L473	T430-A435 HydrophobicContact CG2-CB 3.95Å; A431-A435 PolarHBondContact O-N 3.13Å; P432-A435 PolarHBondContact O-N 2.61Å; A435-L473 HydrophobicContact CB-CD1 3.75Å
436	L	88.3	Confident	92.8	Very high	62 Å²	62	29.3 Å²	29.3	33%	0.325	14%	0.142	S	C	.	.	H	α-helix	trans	-86.1	-42.8	-175.1	-67.1	169.1	0	0	0	112.8	P432 L473	P432-L436 VanDerWaalsContact O-CB 3.27Å; P432-L436 WeakPolarHBondContact O-CB 3.38Å; P432-L436 VanDerWaalsContact O-CG 3.29Å; P432-L436 WeakPolarHBondContact O-CG 3.36Å; P432-L436 PolarHBondContact O-N 2.96Å; L436-L473 HydrophobicContact CD2-CD1 4.03Å; L436-L473 HydrophobicContact CD2-CD2 3.72Å; L436-L473 HydrophobicContact CD2-CG 3.93Å; L436-L473 HydrophobicContact CG-CD1 4.01Å; L436-L473 HydrophobicContact CG-CG 4.46Å
437	Y	87.9	Confident	93.3	Very high	146 Å²	146	28.1 Å²	28.1	57%	0.573	13%	0.134	S	C	*	.	H	α-helix	trans	-113.6	0.2	-171.4	-46.1	-58	0	0	0	112.6	E433 R439	E433-Y437 HydrophobicContact CB-CD2 4.31Å; E433-Y437 WeakPolarHBondContact O-CA 3.48Å; E433-Y437 WeakPolarHBondContact O-CB 3.34Å; E433-Y437 PolarHBondContact O-N 2.59Å; Y437-R439 PolarHBondContact O-N 2.98Å
438	G	84.7	Confident	93.7	Very high	11 Å²	11	26.5 Å²	26.5	11%	0.113	13%	0.126	C	C	.	.			trans	68.1	14.7	-178.1	0	0	0	0	0	113.7	T418 A419 E433 A434 F440	T418-G438 VanDerWaalsContact CA-O 3.31Å; T418-G438 WeakPolarHBondContact CA-O 3.47Å; A419-G438 PolarHBondContact N-O 3.34Å; E433-G438 PolarHBondContact O-N 3.45Å; A434-G438 WeakPolarHBondContact O-CA 3.31Å; A434-G438 PolarHBondContact O-N 3.07Å; A434-G438 VanDerWaalsContact O-N 3.14Å; G438-F440 VanDerWaalsContact O-CD2 3.28Å; G438-F440 WeakPolarHBondContact O-CD2 3.38Å; G438-F440 PolarHBondContact O-N 2.98Å
439	R	89	Confident	93.8	Very high	114 Å²	114	25.4 Å²	25.4	43%	0.43	12%	0.122	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	98.6	-176.7	-68.4	-173.7	-176	-162.2	4.7	111.5	E416 Y417 E433 A434 Y437	E416-R439 IonicContact OE1-CZ 2.76Å; E416-R439 IonicContact OE1-NH1 3.09Å; E416-R439 PolarHBondContact OE1-NH1 3.33Å; E416-R439 IonicContact OE2-CZ 3.69Å; E416-R439 IonicContact OE2-NE 3.67Å; E416-R439 IonicContact OE2-NH1 2.79Å; Y417-R439 WeakPolarHBondContact O-CA 3.47Å; E433-R439 PolarHBondContact O-N 3.38Å; A434-R439 VanDerWaalsContact CA-O 3.29Å; A434-R439 WeakPolarHBondContact CA-O 3.41Å; A434-R439 WeakPolarHBondContact CB-O 3.39Å; Y437-R439 PolarHBondContact O-N 2.98Å
440	F	88.8	Confident	93.9	Very high	3 Å²	3	23.9 Å²	23.9	1%	0.013	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	129.7	176.6	-68.4	-94.6	0	0	0	110.7	I384 R386 Y417 A419 F425 T430 A434 G438	I384-F440 HydrophobicContact CD1-CB 3.77Å; R386-F440 HydrophobicContact CB-CD1 4.02Å; R386-F440 HydrophobicContact CB-CE1 4.29Å; R386-F440 HydrophobicContact CG-CB 4.3Å; R386-F440 HydrophobicContact CG-CD1 3.93Å; R386-F440 HydrophobicContact CG-CG 4.28Å; Y417-F440 HydrophobicContact CD1-CB 4.5Å; Y417-F440 HydrophobicContact CD1-CD2 4.2Å; Y417-F440 PolarHBondContact N-O 2.72Å; Y417-F440 PolarHBondContact O-N 3.17Å; A419-F440 HydrophobicContact CB-CD2 4.42Å; A419-F440 HydrophobicContact CB-CE2 3.9Å; F425-F440 HydrophobicContact CD1-CZ 4.18Å; F425-F440 HydrophobicContact CD2-CZ 4.47Å; F425-F440 HydrophobicContact CE1-CZ 4.03Å; F425-F440 HydrophobicContact CE2-CE2 4.49Å; F425-F440 HydrophobicContact CE2-CZ 4.3Å; F425-F440 HydrophobicContact CG-CZ 4.4Å; F425-F440 HydrophobicContact CZ-CE2 4.21Å; F425-F440 HydrophobicContact CZ-CZ 4.07Å; T430-F440 HydrophobicContact CG2-CE1 4.28Å; T430-F440 HydrophobicContact CG2-CZ 4.44Å; A434-F440 HydrophobicContact CB-CD1 3.91Å; A434-F440 HydrophobicContact CB-CD2 4.43Å; A434-F440 HydrophobicContact CB-CE1 3.84Å; A434-F440 HydrophobicContact CB-CE2 4.34Å; A434-F440 HydrophobicContact CB-CG 4.22Å; A434-F440 HydrophobicContact CB-CZ 4.06Å; G438-F440 VanDerWaalsContact O-CD2 3.28Å; G438-F440 WeakPolarHBondContact O-CD2 3.38Å; G438-F440 PolarHBondContact O-N 2.98Å
441	T	92.8	Very high	94.1	Very high	18 Å²	18	23.3 Å²	23.3	11%	0.11	11%	0.113	C	C	.	.			trans	-142.7	170.8	177.1	70.8	0	0	0	0	109.7	N415 E416 K443 S444 D445	N415-T441 WeakPolarHBondContact O-CG2 3.46Å; E416-T441 HydrophobicContact CG-CG2 4.24Å; T441-K443 PolarHBondContact O-N 3.5Å; T441-K443 WeakPolarHBondContact OG1-CB 3.18Å; T441-K443 PolarHBondContact OG1-N 2.95Å; T441-S444 PolarHBondContact N-OG 2.73Å; T441-S444 WeakPolarHBondContact O-CB 3.47Å; T441-S444 PolarHBondContact O-N 2.89Å; T441-S444 PolarHBondContact O-OG 3.4Å; T441-S444 PolarHBondContact OG1-N 3.22Å; T441-D445 PolarHBondContact O-N 2.8Å
442	I	95.2	Very high	94.2	Very high	31 Å²	31	23.3 Å²	23.3	16%	0.159	11%	0.112	C	C	.	.	H	α-helix	trans	-59.5	-29.5	173.8	-168.3	64.4	0	0	0	111.6	M375 E379 I384 S444 D445 V446 F510	M375-I442 HydrophobicContact CE-CD1 3.97Å; E379-I442 HydrophobicContact CB-CD1 3.97Å; E379-I442 HydrophobicContact CB-CG1 3.86Å; E379-I442 HydrophobicContact CG-CG1 3.9Å; I384-I442 HydrophobicContact CG2-CB 4.37Å; I384-I442 VanDerWaalsContact CG2-N 3.26Å; I442-S444 VanDerWaalsContact C-N 3.3Å; I442-S444 PolarHBondContact O-N 3.07Å; I442-D445 HydrophobicContact CD1-CB 4.39Å; I442-D445 WeakPolarHBondContact O-CA 3.44Å; I442-D445 WeakPolarHBondContact O-CB 3.19Å; I442-D445 PolarHBondContact O-N 3.25Å; I442-D445 VanDerWaalsContact O-N 3.08Å; I442-V446 WeakPolarHBondContact O-CG2 3.12Å; I442-V446 PolarHBondContact O-N 3.35Å; I442-F510 HydrophobicContact CD1-CD2 3.81Å; I442-F510 HydrophobicContact CD1-CE2 3.71Å; I442-F510 HydrophobicContact CG1-CD2 3.93Å; I442-F510 HydrophobicContact CG1-CE2 4.04Å
443	K	97.9	Very high	94.4	Very high	25 Å²	25	22.6 Å²	22.6	11%	0.109	11%	0.108	C	C	.	.	H	α-helix	trans	-68	-27.9	174.7	-58.7	-59.4	-170.5	174	0	112.9	T441 D445 V446 W447 P504 R507 P508	T441-K443 PolarHBondContact O-N 3.5Å; T441-K443 WeakPolarHBondContact OG1-CB 3.18Å; T441-K443 PolarHBondContact OG1-N 2.95Å; K443-D445 VanDerWaalsContact C-N 3.34Å; K443-V446 WeakPolarHBondContact O-CB 3.41Å; K443-V446 PolarHBondContact O-N 3.16Å; K443-W447 PolarHBondContact O-N 3.33Å; K443-P504 HydrophobicContact CB-CB 3.75Å; K443-P504 WeakPolarHBondContact CD-O 3.03Å; K443-P504 HydrophobicContact CG-CB 4.31Å; K443-P504 WeakPolarHBondContact CG-O 3.37Å; K443-R507 HydrophobicContact CD-CB 4.31Å; K443-R507 PolarHBondContact NZ-O 3.39Å; K443-R507 WeakPolarHBondContact O-CD 3.41Å; K443-R507 PolarHBondContact O-NH1 2.91Å; K443-P508 PolarHBondContact NZ-O 3.44Å
444	S	96.5	Very high	94.6	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.014	10%	0.104	C	C	.	.	H	α-helix	trans	-72	-28.8	170.7	73.2	0	0	0	0	112.4	T441 I442 W447 S448	T441-S444 PolarHBondContact N-OG 2.73Å; T441-S444 WeakPolarHBondContact O-CB 3.47Å; T441-S444 PolarHBondContact O-N 2.89Å; T441-S444 PolarHBondContact O-OG 3.4Å; T441-S444 PolarHBondContact OG1-N 3.22Å; I442-S444 VanDerWaalsContact C-N 3.3Å; I442-S444 PolarHBondContact O-N 3.07Å; S444-W447 WeakPolarHBondContact O-CB 3.42Å; S444-S448 PolarHBondContact O-N 3.05Å; S444-S448 PolarHBondContact O-OG 2.8Å
445	D	97.3	Very high	94.9	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-73	-34.3	169.6	-69.8	-35	0	0	0	111.8	M375 I384 H385 R386 T441 I442 K443 W447 S448 F449 F510	M375-D445 HydrophobicContact CE-CB 3.68Å; I384-D445 WeakPolarHBondContact CA-OD2 3.3Å; H385-D445 PolarHBondContact N-OD2 3.21Å; R386-D445 WeakPolarHBondContact CA-OD1 3.37Å; R386-D445 PolarHBondContact N-OD1 3Å; T441-D445 PolarHBondContact O-N 2.8Å; I442-D445 HydrophobicContact CD1-CB 4.39Å; I442-D445 WeakPolarHBondContact O-CA 3.44Å; I442-D445 WeakPolarHBondContact O-CB 3.19Å; I442-D445 PolarHBondContact O-N 3.25Å; I442-D445 VanDerWaalsContact O-N 3.08Å; K443-D445 VanDerWaalsContact C-N 3.34Å; D445-W447 VanDerWaalsContact C-N 3.29Å; D445-W447 PolarHBondContact O-N 3.41Å; D445-S448 CarbonylContact O-C 3.48Å; D445-S448 WeakPolarHBondContact O-CA 3.49Å; D445-S448 WeakPolarHBondContact O-CB 3.48Å; D445-S448 PolarHBondContact O-N 2.91Å; D445-S448 VanDerWaalsContact O-N 3.08Å; D445-F449 PolarHBondContact O-N 3.11Å; D445-F510 HydrophobicContact CB-CE2 3.95Å; D445-F510 HydrophobicContact CB-CZ 4.08Å
446	V	98.8	Very high	95.3	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-58.9	-41.4	172.6	172.1	0	0	0	0	111.2	I442 K443 S448 F449 G450 C499 R507 P508 F510 L513	I442-V446 WeakPolarHBondContact O-CG2 3.12Å; I442-V446 PolarHBondContact O-N 3.35Å; K443-V446 WeakPolarHBondContact O-CB 3.41Å; K443-V446 PolarHBondContact O-N 3.16Å; V446-S448 VanDerWaalsContact C-N 3.35Å; V446-S448 PolarHBondContact O-N 3.28Å; V446-F449 WeakPolarHBondContact O-CB 3.37Å; V446-F449 PolarHBondContact O-N 3.02Å; V446-G450 PolarHBondContact O-N 3.44Å; V446-C499 HydrophobicContact CG1-CB 4.08Å; V446-C499 WeakPolarHBondContact O-CB 3.45Å; V446-R507 HydrophobicContact CB-CB 4.46Å; V446-R507 HydrophobicContact CG1-CB 3.86Å; V446-P508 HydrophobicContact CG1-CG 4.14Å; V446-P508 WeakPolarHBondContact CG2-O 3.48Å; V446-F510 HydrophobicContact CG2-CD2 3.88Å; V446-F510 HydrophobicContact CG2-CE2 3.58Å; V446-F510 HydrophobicContact CG2-CZ 3.97Å; V446-L513 HydrophobicContact CG1-CD1 4.11Å
447	W	98.7	Very high	95.8	Very high	2 Å²	2	18.9 Å²	18.9	1%	0.008	9%	0.086	C	C	.	.	H	α-helix	trans	-58.1	-48.6	171.7	178.5	-74	0	0	0	111.7	W429 A431 P432 K443 S444 D445 F449 G450 I451 V476 C499 W500	W429-W447 VanDerWaalsContact O-CD1 3.28Å; A431-W447 HydrophobicContact CB-CB 3.69Å; A431-W447 HydrophobicContact CB-CD2 4.04Å; A431-W447 HydrophobicContact CB-CE3 4.46Å; A431-W447 HydrophobicContact CB-CG 3.67Å; P432-W447 HydrophobicContact CG-CH2 4.19Å; P432-W447 HydrophobicContact CG-CZ3 4.09Å; K443-W447 PolarHBondContact O-N 3.33Å; S444-W447 WeakPolarHBondContact O-CB 3.42Å; D445-W447 VanDerWaalsContact C-N 3.29Å; D445-W447 PolarHBondContact O-N 3.41Å; W447-F449 VanDerWaalsContact C-N 3.27Å; W447-F449 PolarHBondContact O-N 3.46Å; W447-G450 WeakPolarHBondContact O-CA 3.49Å; W447-G450 PolarHBondContact O-N 3.1Å; W447-G450 VanDerWaalsContact O-N 3.07Å; W447-I451 PolarHBondContact O-N 2.84Å; W447-I451 VanDerWaalsContact O-N 3.13Å; W447-V476 HydrophobicContact CH2-CG1 3.5Å; W447-V476 HydrophobicContact CZ2-CG1 3.56Å; W447-V476 HydrophobicContact CZ2-CG2 4.47Å; W447-C499 WeakPolarHBondContact CA-O 3.47Å; W447-W500 HydrophobicContact CD2-CB 4.47Å; W447-W500 AromaticContact CD2-CD1 3.67Å; W447-W500 HydrophobicContact CD2-CG 4.39Å; W447-W500 AromaticContact CE2-CD1 3.79Å; W447-W500 HydrophobicContact CE3-CB 4.02Å; W447-W500 HydrophobicContact CE3-CG 4.41Å; W447-W500 AromaticContact CG-CD1 3.95Å; W447-W500 HydrophobicContact CH2-CB 3.96Å; W447-W500 HydrophobicContact CH2-CG 4.44Å; W447-W500 HydrophobicContact CZ2-CB 4.43Å; W447-W500 HydrophobicContact CZ2-CG 4.44Å; W447-W500 HydrophobicContact CZ3-CB 3.76Å; W447-W500 HydrophobicContact CZ3-CG 4.45Å; W447-W500 VanDerWaalsContact CZ3-O 3.29Å; W447-W500 WeakPolarHBondContact CZ3-O 3.48Å; W447-W500 PolarHBondContact O-NE1 3.36Å
448	S	98.5	Very high	96.2	Very high	6 Å²	6	13.4 Å²	13.4	4%	0.042	7%	0.067	C	C	.	.	H	α-helix	trans	-60.6	-38.1	179.6	-53.3	0	0	0	0	111.3	L388 W429 S444 D445 V446 I451 L452	L388-S448 WeakPolarHBondContact O-CB 3.5Å; W429-S448 WeakPolarHBondContact O-CA 3.47Å; W429-S448 PolarHBondContact O-OG 2.84Å; S444-S448 PolarHBondContact O-N 3.05Å; S444-S448 PolarHBondContact O-OG 2.8Å; D445-S448 CarbonylContact O-C 3.48Å; D445-S448 WeakPolarHBondContact O-CA 3.49Å; D445-S448 WeakPolarHBondContact O-CB 3.48Å; D445-S448 PolarHBondContact O-N 2.91Å; D445-S448 VanDerWaalsContact O-N 3.08Å; V446-S448 VanDerWaalsContact C-N 3.35Å; V446-S448 PolarHBondContact O-N 3.28Å; S448-I451 WeakPolarHBondContact O-CB 3.29Å; S448-I451 PolarHBondContact O-N 3.05Å; S448-I451 VanDerWaalsContact O-N 3.16Å; S448-L452 PolarHBondContact O-N 3.07Å
449	F	98.8	Very high	96.7	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-62.5	-42.3	172.8	-176.1	-100.5	0	0	0	112.1	A368 V371 A372 L388 D445 V446 W447 I451 L452 L453 F510 L513 L517	A368-F449 HydrophobicContact CB-CZ 4.38Å; V371-F449 HydrophobicContact CB-CE2 4.15Å; V371-F449 HydrophobicContact CG1-CD2 4.09Å; V371-F449 HydrophobicContact CG1-CE2 3.94Å; A372-F449 HydrophobicContact CB-CE2 4.08Å; A372-F449 HydrophobicContact CB-CZ 3.82Å; L388-F449 HydrophobicContact CD2-CB 3.83Å; L388-F449 HydrophobicContact CD2-CD2 4.19Å; D445-F449 PolarHBondContact O-N 3.11Å; V446-F449 WeakPolarHBondContact O-CB 3.37Å; V446-F449 PolarHBondContact O-N 3.02Å; W447-F449 VanDerWaalsContact C-N 3.27Å; W447-F449 PolarHBondContact O-N 3.46Å; F449-I451 VanDerWaalsContact C-N 3.26Å; F449-I451 PolarHBondContact O-N 3.34Å; F449-L452 WeakPolarHBondContact O-CA 3.34Å; F449-L452 WeakPolarHBondContact O-CB 3.15Å; F449-L452 PolarHBondContact O-N 2.9Å; F449-L452 VanDerWaalsContact O-N 3.08Å; F449-L453 HydrophobicContact CD1-CD1 4.19Å; F449-L453 HydrophobicContact CD1-CG 4.2Å; F449-L453 HydrophobicContact CE1-CD1 3.86Å; F449-L453 HydrophobicContact CE1-CD2 3.91Å; F449-L453 HydrophobicContact CE1-CG 3.9Å; F449-L453 HydrophobicContact CZ-CD2 3.9Å; F449-L453 HydrophobicContact CZ-CG 4.33Å; F449-L453 WeakPolarHBondContact O-CG 3.27Å; F449-L453 PolarHBondContact O-N 3.14Å; F449-F510 HydrophobicContact CB-CE1 3.71Å; F449-F510 HydrophobicContact CB-CZ 4Å; F449-F510 HydrophobicContact CD1-CE1 4.36Å; F449-F510 AromaticContact CD2-CE1 3.94Å; F449-F510 HydrophobicContact CD2-CE1 3.94Å; F449-F510 AromaticContact CG-CE1 3.75Å; F449-F510 HydrophobicContact CG-CE1 3.75Å; F449-L513 HydrophobicContact CD1-CD1 3.74Å; F449-L513 HydrophobicContact CE1-CB 4.32Å; F449-L513 HydrophobicContact CE1-CD1 4.07Å; F449-L513 HydrophobicContact CE1-CD2 4.35Å; F449-L513 HydrophobicContact CE1-CG 4.49Å; F449-L517 HydrophobicContact CE1-CD1 3.9Å; F449-L517 HydrophobicContact CZ-CD1 3.57Å
450	G	98.7	Very high	97	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-56.4	-40.6	172.1	0	0	0	0	0	112.4	V446 W447 L453 T454 W500	V446-G450 PolarHBondContact O-N 3.44Å; W447-G450 WeakPolarHBondContact O-CA 3.49Å; W447-G450 PolarHBondContact O-N 3.1Å; W447-G450 VanDerWaalsContact O-N 3.07Å; G450-L453 PolarHBondContact O-N 3.32Å; G450-T454 PolarHBondContact O-N 3.41Å; G450-W500 VanDerWaalsContact C-CZ2 3.49Å; G450-W500 VanDerWaalsContact O-CZ2 3.27Å; G450-W500 WeakPolarHBondContact O-CZ2 3.41Å
451	I	98.7	Very high	97.4	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-66.7	-42.4	173.9	-55.3	-66.8	0	0	0	110.9	W429 W447 S448 F449 L453 T454 E455 P463 Y464 M482 W500	W429-I451 HydrophobicContact CD2-CG2 4.31Å; W429-I451 HydrophobicContact CG-CB 4.42Å; W429-I451 HydrophobicContact CG-CG2 3.88Å; W447-I451 PolarHBondContact O-N 2.84Å; W447-I451 VanDerWaalsContact O-N 3.13Å; S448-I451 WeakPolarHBondContact O-CB 3.29Å; S448-I451 PolarHBondContact O-N 3.05Å; S448-I451 VanDerWaalsContact O-N 3.16Å; F449-I451 VanDerWaalsContact C-N 3.26Å; F449-I451 PolarHBondContact O-N 3.34Å; I451-L453 VanDerWaalsContact C-N 3.3Å; I451-L453 PolarHBondContact O-N 3.31Å; I451-T454 WeakPolarHBondContact O-CA 3.28Å; I451-T454 WeakPolarHBondContact O-CB 3.31Å; I451-T454 PolarHBondContact O-N 2.89Å; I451-T454 PolarHBondContact O-OG1 3.18Å; I451-E455 PolarHBondContact O-N 3.17Å; I451-E455 VanDerWaalsContact O-N 3.13Å; I451-P463 HydrophobicContact CG2-CB 3.83Å; I451-P463 HydrophobicContact CG2-CG 3.43Å; I451-P463 VanDerWaalsContact CG2-CG 3.43Å; I451-Y464 HydrophobicContact CD1-CE2 3.85Å; I451-Y464 WeakPolarHBondContact CD1-OH 3.26Å; I451-M482 HydrophobicContact CD1-CE 3.52Å; I451-W500 HydrophobicContact CD1-CZ2 3.7Å; I451-W500 HydrophobicContact CG1-CZ2 4.47Å
452	L	98.6	Very high	97.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-58.2	-39.3	175.5	-176.5	157.8	0	0	0	112.3	V371 L388 I393 S448 F449 T454 E455 L456	V371-L452 HydrophobicContact CG1-CD1 4.1Å; L388-L452 HydrophobicContact CD1-CD1 4.2Å; L388-L452 HydrophobicContact CG-CD1 4.19Å; I393-L452 HydrophobicContact CD1-CD1 4.28Å; I393-L452 HydrophobicContact CG1-CD1 3.86Å; S448-L452 PolarHBondContact O-N 3.07Å; F449-L452 WeakPolarHBondContact O-CA 3.34Å; F449-L452 WeakPolarHBondContact O-CB 3.15Å; F449-L452 PolarHBondContact O-N 2.9Å; F449-L452 VanDerWaalsContact O-N 3.08Å; L452-T454 PolarHBondContact O-N 2.77Å; L452-E455 WeakPolarHBondContact CA-OE2 3.25Å; L452-E455 WeakPolarHBondContact O-CB 3.47Å; L452-E455 PolarHBondContact O-N 3.4Å; L452-L456 HydrophobicContact CD2-CD1 3.61Å; L452-L456 HydrophobicContact CD2-CG 4.18Å; L452-L456 PolarHBondContact O-N 3.06Å
453	L	98.6	Very high	97.6	Very high	2 Å²	2	20.3 Å²	20.3	1%	0.01	10%	0.097	C	C	.	.	H	α-helix	trans	-58.7	-38.2	173.5	-66.4	178.9	0	0	0	111.6	A368 F449 G450 I451 L456 V457 L492 L495 M496	A368-L453 HydrophobicContact CB-CD2 3.51Å; F449-L453 HydrophobicContact CD1-CD1 4.19Å; F449-L453 HydrophobicContact CD1-CG 4.2Å; F449-L453 HydrophobicContact CE1-CD1 3.86Å; F449-L453 HydrophobicContact CE1-CD2 3.91Å; F449-L453 HydrophobicContact CE1-CG 3.9Å; F449-L453 HydrophobicContact CZ-CD2 3.9Å; F449-L453 HydrophobicContact CZ-CG 4.33Å; F449-L453 WeakPolarHBondContact O-CG 3.27Å; F449-L453 PolarHBondContact O-N 3.14Å; G450-L453 PolarHBondContact O-N 3.32Å; I451-L453 VanDerWaalsContact C-N 3.3Å; I451-L453 PolarHBondContact O-N 3.31Å; L453-L456 HydrophobicContact CD2-CD1 4.4Å; L453-L456 PolarHBondContact O-N 3.32Å; L453-V457 WeakPolarHBondContact O-CG2 3.37Å; L453-V457 PolarHBondContact O-N 3.24Å; L453-V457 VanDerWaalsContact O-N 3.14Å; L453-L492 HydrophobicContact CD1-CD1 4.48Å; L453-L495 HydrophobicContact CD1-CD2 3.98Å; L453-L495 HydrophobicContact CD1-CG 4.49Å; L453-M496 HydrophobicContact CB-CE 3.64Å; L453-M496 HydrophobicContact CB-CG 3.88Å; L453-M496 HydrophobicContact CB-SD 4.42Å; L453-M496 HydrophobicContact CD1-CG 3.95Å
454	T	98.1	Very high	97.6	Very high	5 Å²	5	19.2 Å²	19.2	3%	0.031	9%	0.092	C	C	.	.	H	α-helix	trans	-65	-40.2	174.2	71.5	0	0	0	0	111.8	G450 I451 L452 L456 V457 T458 M482 M496 W500	G450-T454 PolarHBondContact O-N 3.41Å; I451-T454 WeakPolarHBondContact O-CA 3.28Å; I451-T454 WeakPolarHBondContact O-CB 3.31Å; I451-T454 PolarHBondContact O-N 2.89Å; I451-T454 PolarHBondContact O-OG1 3.18Å; L452-T454 PolarHBondContact O-N 2.77Å; T454-L456 VanDerWaalsContact C-N 3.32Å; T454-L456 PolarHBondContact O-N 3.09Å; T454-V457 PolarHBondContact O-N 2.85Å; T454-T458 VanDerWaalsContact O-CB 3.26Å; T454-T458 WeakPolarHBondContact O-CB 3.42Å; T454-T458 VanDerWaalsContact O-CG2 3.27Å; T454-T458 WeakPolarHBondContact O-CG2 3.29Å; T454-T458 PolarHBondContact O-N 2.9Å; T454-T458 PolarHBondContact O-OG1 2.85Å; T454-M482 HydrophobicContact CG2-CE 3.83Å; T454-M496 HydrophobicContact CG2-CE 4.45Å; T454-M496 HydrophobicContact CG2-SD 3.72Å; T454-W500 HydrophobicContact CG2-CH2 3.41Å; T454-W500 VanDerWaalsContact CG2-CH2 3.41Å; T454-W500 HydrophobicContact CG2-CZ2 3.58Å
455	E	98.2	Very high	97.5	Very high	3 Å²	3	24.2 Å²	24.2	1%	0.014	12%	0.124	C	C	.	.	H	α-helix	trans	-60.9	-43.6	176.5	-60.5	-179.2	92.2	0	0	110.7	S390 W429 I451 L452 T458 K459 G460 P463	S390-E455 WeakPolarHBondContact CB-OE1 3.45Å; S390-E455 PolarHBondContact N-OE2 2.91Å; S390-E455 PolarHBondContact OG-OE1 3Å; W429-E455 WeakPolarHBondContact CZ2-OE1 3.33Å; W429-E455 PolarHBondContact NE1-OE2 3.26Å; I451-E455 PolarHBondContact O-N 3.17Å; I451-E455 VanDerWaalsContact O-N 3.13Å; L452-E455 WeakPolarHBondContact CA-OE2 3.25Å; L452-E455 WeakPolarHBondContact O-CB 3.47Å; L452-E455 PolarHBondContact O-N 3.4Å; E455-T458 PolarHBondContact O-N 2.92Å; E455-K459 PolarHBondContact O-N 2.82Å; E455-G460 PolarHBondContact O-N 3.27Å; E455-P463 HydrophobicContact CG-CG 4.29Å
456	L	98.1	Very high	97.4	Very high	3 Å²	3	28.2 Å²	28.2	2%	0.016	17%	0.166	C	C	.	.	H	α-helix	trans	-58	-56.4	176.9	-81.6	166	0	0	0	112.1	L347 L351 L364 M367 A368 L452 L453 T454 T458 K459	L347-L456 HydrophobicContact CD1-CD2 4.25Å; L347-L456 HydrophobicContact CD2-CD2 3.99Å; L347-L456 HydrophobicContact CD2-CG 4.46Å; L351-L456 HydrophobicContact CD1-CD2 4.11Å; L364-L456 WeakPolarHBondContact CD1-O 3.38Å; L364-L456 HydrophobicContact CD2-CD2 4.1Å; M367-L456 HydrophobicContact CB-CD2 4.21Å; A368-L456 HydrophobicContact CB-CD1 3.69Å; L452-L456 HydrophobicContact CD2-CD1 3.61Å; L452-L456 HydrophobicContact CD2-CG 4.18Å; L452-L456 PolarHBondContact O-N 3.06Å; L453-L456 HydrophobicContact CD2-CD1 4.4Å; L453-L456 PolarHBondContact O-N 3.32Å; T454-L456 VanDerWaalsContact C-N 3.32Å; T454-L456 PolarHBondContact O-N 3.09Å; L456-T458 VanDerWaalsContact C-N 3.25Å; L456-T458 PolarHBondContact O-N 3.49Å; L456-K459 PolarHBondContact O-N 2.76Å
457	V	97.1	Very high	97.3	Very high	25 Å²	25	30.3 Å²	30.3	15%	0.152	18%	0.176	C	C	.	.	H	α-helix	trans	-71.6	-21.6	-175.1	-57.4	0	0	0	0	112.9	L361 L453 T454 P485 C488 L492 M496	L361-V457 HydrophobicContact CD1-CG1 4.49Å; L453-V457 WeakPolarHBondContact O-CG2 3.37Å; L453-V457 PolarHBondContact O-N 3.24Å; L453-V457 VanDerWaalsContact O-N 3.14Å; T454-V457 PolarHBondContact O-N 2.85Å; V457-P485 HydrophobicContact CG2-CB 4.06Å; V457-P485 HydrophobicContact CG2-CG 3.83Å; V457-C488 HydrophobicContact CG2-CB 4.32Å; V457-L492 HydrophobicContact CG1-CD2 3.73Å; V457-M496 HydrophobicContact CG1-CE 4.29Å; V457-M496 HydrophobicContact CG2-CE 3.96Å
458	T	96.6	Very high	97.1	Very high	30 Å²	30	34.1 Å²	34.1	18%	0.184	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	6.9	177.2	65.3	0	0	0	0	114.2	T454 E455 L456 R461 P485	T454-T458 VanDerWaalsContact O-CB 3.26Å; T454-T458 WeakPolarHBondContact O-CB 3.42Å; T454-T458 VanDerWaalsContact O-CG2 3.27Å; T454-T458 WeakPolarHBondContact O-CG2 3.29Å; T454-T458 PolarHBondContact O-N 2.9Å; T454-T458 PolarHBondContact O-OG1 2.85Å; E455-T458 PolarHBondContact O-N 2.92Å; L456-T458 VanDerWaalsContact C-N 3.25Å; L456-T458 PolarHBondContact O-N 3.49Å; T458-R461 WeakPolarHBondContact O-CG 3.37Å; T458-P485 HydrophobicContact CG2-CB 3.77Å; T458-P485 HydrophobicContact CG2-CG 4Å
459	K	96.4	Very high	96.7	Very high	54 Å²	54	37.9 Å²	37.9	24%	0.235	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	61	46.9	179.2	-50.4	-57.4	-169.4	169.9	0	113.3	L351 G356 L359 E455 L456 R461	L351-K459 HydrophobicContact CD2-CD 4.46Å; G356-K459 PolarHBondContact O-NZ 3.04Å; L359-K459 PolarHBondContact O-NZ 3.11Å; E455-K459 PolarHBondContact O-N 2.82Å; L456-K459 PolarHBondContact O-N 2.76Å; K459-R461 PolarHBondContact O-N 3.33Å
460	G	95.6	Very high	96.4	Very high	2 Å²	2	46.4 Å²	46.4	2%	0.021	25%	0.249	C	C	.	.	S	Bend	trans	76	16.8	176.4	0	0	0	0	0	114.3	K352 E455	K352-G460 WeakPolarHBondContact CE-O 3.32Å; E455-G460 PolarHBondContact O-N 3.27Å
461	R	95.6	Very high	96.2	Very high	183 Å²	183	50.1 Å²	50.1	69%	0.691	27%	0.266	S	S	*	.	P	Polyproline II helix	trans	-59.6	144.6	173.9	-74.5	179.1	-173.3	179	1.5	110	T458 K459	T458-R461 WeakPolarHBondContact O-CG 3.37Å; K459-R461 PolarHBondContact O-N 3.33Å
462	V	95.5	Very high	96	Very high	81 Å²	81	50.3 Å²	50.3	49%	0.491	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-63.8	129.4	177.6	-179.9	0	0	0	0	108.9	K428	K428-V462 HydrophobicContact CD-CG1 4.09Å
463	P	97.4	Very high	95.7	Very high	3 Å²	3	52.3 Å²	52.3	2%	0.019	28%	0.278	C	S	.	.	S	Bend	trans	-58	153.9	176.8	-25.7	34.6	0	0	0	112.5	K428 W429 I451 E455 M482	K428-P463 HydrophobicContact CB-CB 4.35Å; K428-P463 WeakPolarHBondContact CD-O 3.38Å; K428-P463 PolarHBondContact NZ-O 2.76Å; W429-P463 HydrophobicContact CD2-CG 4.45Å; W429-P463 HydrophobicContact CH2-CG 4.13Å; W429-P463 VanDerWaalsContact CZ2-CD 3.44Å; W429-P463 HydrophobicContact CZ2-CG 3.61Å; I451-P463 HydrophobicContact CG2-CB 3.83Å; I451-P463 HydrophobicContact CG2-CG 3.43Å; I451-P463 VanDerWaalsContact CG2-CG 3.43Å; E455-P463 HydrophobicContact CG-CG 4.29Å; P463-M482 HydrophobicContact CB-CE 4.22Å; P463-M482 HydrophobicContact CB-SD 4.24Å
464	Y	97.4	Very high	95.5	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.008	29%	0.291	C	S	.	.	S	Bend	trans	50.1	64.7	-178.8	-52.8	-87.8	0	0	0	111.9	K428 I451 G466 M467 V472 V476 Y480 M482	K428-Y464 HydrophobicContact CB-CD2 4.15Å; K428-Y464 HydrophobicContact CG-CD2 4.4Å; K428-Y464 PolarHBondContact NZ-O 3.09Å; K428-Y464 WeakPolarHBondContact O-CE2 3.45Å; I451-Y464 HydrophobicContact CD1-CE2 3.85Å; I451-Y464 WeakPolarHBondContact CD1-OH 3.26Å; Y464-G466 PolarHBondContact O-N 3.44Å; Y464-M467 HydrophobicContact CD1-SD 4.32Å; Y464-M467 PolarHBondContact O-N 3.22Å; Y464-M467 VanDerWaalsContact O-N 3.16Å; Y464-V472 VanDerWaalsContact CB-CG2 3.47Å; Y464-V472 HydrophobicContact CD1-CG1 4.18Å; Y464-V472 HydrophobicContact CD1-CG2 4.24Å; Y464-V472 HydrophobicContact CD2-CG1 3.75Å; Y464-V472 HydrophobicContact CD2-CG2 4.01Å; Y464-V472 HydrophobicContact CE1-CG1 4.28Å; Y464-V472 HydrophobicContact CE2-CG1 3.85Å; Y464-V472 HydrophobicContact CG-CB 4.46Å; Y464-V472 HydrophobicContact CG-CG1 3.94Å; Y464-V472 HydrophobicContact CG-CG2 3.66Å; Y464-V476 HydrophobicContact CE1-CG2 3.86Å; Y464-Y480 HydrophobicContact CD1-CD1 4.25Å; Y464-Y480 AromaticContact CD1-CE1 3.73Å; Y464-Y480 HydrophobicContact CD1-CE1 3.73Å; Y464-Y480 HydrophobicContact CE1-CD1 4.09Å; Y464-Y480 AromaticContact CE1-CE1 3.86Å; Y464-Y480 HydrophobicContact CE1-CE1 3.86Å; Y464-M482 HydrophobicContact CD1-CG 3.73Å; Y464-M482 HydrophobicContact CD1-SD 4.14Å; Y464-M482 HydrophobicContact CD2-CE 4.37Å; Y464-M482 HydrophobicContact CD2-SD 4.22Å; Y464-M482 HydrophobicContact CE1-CE 4.32Å; Y464-M482 HydrophobicContact CE1-CG 3.68Å; Y464-M482 HydrophobicContact CE1-SD 4.25Å; Y464-M482 HydrophobicContact CE2-CE 3.94Å; Y464-M482 HydrophobicContact CE2-SD 4.33Å; Y464-M482 HydrophobicContact CG-CG 4.29Å; Y464-M482 HydrophobicContact CG-SD 4.1Å; Y464-M482 PolarHBondContact N-SD 3.41Å
465	P	95.4	Very high	95.5	Very high	106 Å²	106	58.3 Å²	58.3	69%	0.688	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	134.8	-176.8	25.7	-34.4	0	0	0	110.5	M467	P465-M467 VanDerWaalsContact C-N 3.29Å; P465-M467 PolarHBondContact O-N 2.86Å
466	G	95.4	Very high	95.4	Very high	85 Å²	85	58.6 Å²	58.6	88%	0.876	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	-4.3	-178.9	0	0	0	0	0	115.8	Y464	Y464-G466 PolarHBondContact O-N 3.44Å
467	M	96.3	Very high	95.2	Very high	44 Å²	44	63.3 Å²	63.3	22%	0.217	33%	0.329	C	S	.	.			trans	-105.9	136.7	176.7	-58.1	178.9	-172.3	0	0	111.6	K428 Y464 P465 E471 V472 Q475 Y480	K428-M467 VanDerWaalsContact CE-O 3.25Å; K428-M467 WeakPolarHBondContact CE-O 3.27Å; K428-M467 PolarHBondContact NZ-O 2.94Å; Y464-M467 HydrophobicContact CD1-SD 4.32Å; Y464-M467 PolarHBondContact O-N 3.22Å; Y464-M467 VanDerWaalsContact O-N 3.16Å; P465-M467 VanDerWaalsContact C-N 3.29Å; P465-M467 PolarHBondContact O-N 2.86Å; M467-E471 WeakPolarHBondContact CA-OE2 3.49Å; M467-E471 HydrophobicContact CB-CB 4.23Å; M467-V472 HydrophobicContact CB-CG2 3.61Å; M467-V472 HydrophobicContact SD-CG2 4.36Å; M467-Q475 HydrophobicContact SD-CG 4.49Å; M467-Y480 HydrophobicContact CE-CE1 4.03Å; M467-Y480 HydrophobicContact CE-CE2 4.31Å; M467-Y480 HydrophobicContact SD-CE1 4.46Å
468	N	93.4	Very high	95.1	Very high	82 Å²	82	71 Å²	71	44%	0.439	36%	0.355	S	S	.	.			trans	-80.8	171.1	168.7	73.9	53.4	0	0	0	111.5	R470 E471 V472	N468-R470 VanDerWaalsContact C-N 3.3Å; N468-R470 PolarHBondContact O-N 3.47Å; N468-R470 WeakPolarHBondContact OD1-CB 3.33Å; N468-R470 PolarHBondContact OD1-N 3.04Å; N468-E471 VanDerWaalsContact CG-OE2 3.28Å; N468-E471 PolarHBondContact N-OE2 3.29Å; N468-E471 PolarHBondContact ND2-OE1 2.98Å; N468-E471 PolarHBondContact ND2-OE2 2.95Å; N468-E471 VanDerWaalsContact ND2-OE2 3.07Å; N468-E471 PolarHBondContact O-N 3.27Å; N468-E471 PolarHBondContact OD1-N 3.46Å; N468-V472 WeakPolarHBondContact O-CG2 3.49Å; N468-V472 PolarHBondContact O-N 3.29Å
469	N	91.1	Very high	95.1	Very high	85 Å²	85	71.9 Å²	71.9	46%	0.455	37%	0.371	S	S	.	.	H	α-helix	trans	-59.8	-36.5	-174.8	-70.6	-6.4	0	0	0	113.8	I427 L473	I427-N469 HydrophobicContact CB-CB 3.98Å; I427-N469 HydrophobicContact CG1-CB 4.16Å; I427-N469 HydrophobicContact CG2-CB 4.01Å; I427-N469 WeakPolarHBondContact CG2-O 3.26Å; N469-L473 PolarHBondContact O-N 3.24Å
470	R	91.1	Very high	95.2	Very high	179 Å²	179	72.7 Å²	72.7	68%	0.675	37%	0.373	S	S	*	.	H	α-helix	trans	-69.8	-45.9	179.9	-163.8	-173.1	101	-175.2	2.1	110.7	N468 V472 L473 E474	N468-R470 VanDerWaalsContact C-N 3.3Å; N468-R470 PolarHBondContact O-N 3.47Å; N468-R470 WeakPolarHBondContact OD1-CB 3.33Å; N468-R470 PolarHBondContact OD1-N 3.04Å; R470-V472 VanDerWaalsContact C-N 3.33Å; R470-V472 PolarHBondContact O-N 3.35Å; R470-L473 PolarHBondContact O-N 3.08Å; R470-E474 IonicContact CZ-OE1 3.49Å; R470-E474 IonicContact NE-OE1 2.79Å; R470-E474 PolarHBondContact NE-OE1 3.04Å; R470-E474 IonicContact NH2-OE1 3.38Å; R470-E474 PolarHBondContact NH2-OE1 2.59Å; R470-E474 WeakPolarHBondContact O-CG 3.2Å; R470-E474 PolarHBondContact O-N 3.37Å; R470-E474 VanDerWaalsContact O-N 3.08Å
471	E	95.4	Very high	95.3	Very high	78 Å²	78	74.9 Å²	74.9	36%	0.364	38%	0.381	S	S	.	.	H	α-helix	trans	-60.9	-42.1	177.7	-69.9	166.1	163	0	0	111.7	M467 N468 L473 E474 Q475	M467-E471 WeakPolarHBondContact CA-OE2 3.49Å; M467-E471 HydrophobicContact CB-CB 4.23Å; N468-E471 VanDerWaalsContact CG-OE2 3.28Å; N468-E471 PolarHBondContact N-OE2 3.29Å; N468-E471 PolarHBondContact ND2-OE1 2.98Å; N468-E471 PolarHBondContact ND2-OE2 2.95Å; N468-E471 VanDerWaalsContact ND2-OE2 3.07Å; N468-E471 PolarHBondContact O-N 3.27Å; N468-E471 PolarHBondContact OD1-N 3.46Å; E471-L473 VanDerWaalsContact C-N 3.34Å; E471-L473 PolarHBondContact O-N 3.49Å; E471-E474 PolarHBondContact O-N 2.92Å; E471-Q475 WeakPolarHBondContact O-CB 2.77Å; E471-Q475 WeakPolarHBondContact O-CG 3.36Å; E471-Q475 PolarHBondContact O-N 2.51Å
472	V	95.4	Very high	95.4	Very high	4 Å²	4	66.9 Å²	66.9	2%	0.024	35%	0.351	C	S	.	.	H	α-helix	trans	-57.9	-48.3	176.8	170.6	0	0	0	0	110.9	K428 Y464 M467 N468 R470 Q475 V476	K428-V472 HydrophobicContact CG-CG2 4.28Å; Y464-V472 VanDerWaalsContact CB-CG2 3.47Å; Y464-V472 HydrophobicContact CD1-CG1 4.18Å; Y464-V472 HydrophobicContact CD1-CG2 4.24Å; Y464-V472 HydrophobicContact CD2-CG1 3.75Å; Y464-V472 HydrophobicContact CD2-CG2 4.01Å; Y464-V472 HydrophobicContact CE1-CG1 4.28Å; Y464-V472 HydrophobicContact CE2-CG1 3.85Å; Y464-V472 HydrophobicContact CG-CB 4.46Å; Y464-V472 HydrophobicContact CG-CG1 3.94Å; Y464-V472 HydrophobicContact CG-CG2 3.66Å; M467-V472 HydrophobicContact CB-CG2 3.61Å; M467-V472 HydrophobicContact SD-CG2 4.36Å; N468-V472 WeakPolarHBondContact O-CG2 3.49Å; N468-V472 PolarHBondContact O-N 3.29Å; R470-V472 VanDerWaalsContact C-N 3.33Å; R470-V472 PolarHBondContact O-N 3.35Å; V472-Q475 PolarHBondContact O-N 3.04Å; V472-V476 HydrophobicContact CG1-CG2 4.11Å; V472-V476 VanDerWaalsContact O-CB 3.27Å; V472-V476 WeakPolarHBondContact O-CB 3.29Å; V472-V476 WeakPolarHBondContact O-CG2 3.31Å; V472-V476 PolarHBondContact O-N 3.3Å
473	L	92.3	Very high	95.5	Very high	43 Å²	43	67.4 Å²	67.4	23%	0.225	36%	0.356	C	S	.	.	H	α-helix	trans	-61.3	-48.4	-179.1	-170.5	60.4	0	0	0	111.6	A435 L436 N469 R470 E471 Q475 E477	A435-L473 HydrophobicContact CB-CD1 3.75Å; L436-L473 HydrophobicContact CD2-CD1 4.03Å; L436-L473 HydrophobicContact CD2-CD2 3.72Å; L436-L473 HydrophobicContact CD2-CG 3.93Å; L436-L473 HydrophobicContact CG-CD1 4.01Å; L436-L473 HydrophobicContact CG-CG 4.46Å; N469-L473 PolarHBondContact O-N 3.24Å; R470-L473 PolarHBondContact O-N 3.08Å; E471-L473 VanDerWaalsContact C-N 3.34Å; E471-L473 PolarHBondContact O-N 3.49Å; L473-Q475 PolarHBondContact O-N 3.33Å; L473-E477 WeakPolarHBondContact O-CB 3.46Å; L473-E477 PolarHBondContact O-N 3.09Å
474	E	93.9	Very high	95.5	Very high	63 Å²	63	69.8 Å²	69.8	29%	0.294	37%	0.372	S	S	.	.	H	α-helix	trans	-60.3	-42.6	178	-70.6	174.9	-160.9	0	0	112.2	R470 E471 R478	R470-E474 IonicContact CZ-OE1 3.49Å; R470-E474 IonicContact NE-OE1 2.79Å; R470-E474 PolarHBondContact NE-OE1 3.04Å; R470-E474 IonicContact NH2-OE1 3.38Å; R470-E474 PolarHBondContact NH2-OE1 2.59Å; R470-E474 WeakPolarHBondContact O-CG 3.2Å; R470-E474 PolarHBondContact O-N 3.37Å; R470-E474 VanDerWaalsContact O-N 3.08Å; E471-E474 PolarHBondContact O-N 2.92Å; E474-R478 VanDerWaalsContact O-CG 3.31Å; E474-R478 WeakPolarHBondContact O-CG 3.27Å; E474-R478 PolarHBondContact O-N 2.92Å
475	Q	97.5	Very high	95.4	Very high	69 Å²	69	70.9 Å²	70.9	32%	0.322	38%	0.38	S	S	.	.	H	α-helix	trans	-73.1	-43.2	-178.1	-68.2	-67.7	-11.2	0	0	111.9	M467 E471 V472 L473 E477 R478 G479 Y480	M467-Q475 HydrophobicContact SD-CG 4.49Å; E471-Q475 WeakPolarHBondContact O-CB 2.77Å; E471-Q475 WeakPolarHBondContact O-CG 3.36Å; E471-Q475 PolarHBondContact O-N 2.51Å; V472-Q475 PolarHBondContact O-N 3.04Å; L473-Q475 PolarHBondContact O-N 3.33Å; Q475-E477 VanDerWaalsContact C-N 3.28Å; Q475-E477 PolarHBondContact O-N 3.4Å; Q475-R478 CarbonylContact O-C 3.57Å; Q475-R478 WeakPolarHBondContact O-CA 3.49Å; Q475-R478 WeakPolarHBondContact O-CB 3.21Å; Q475-R478 PolarHBondContact O-N 3.42Å; Q475-R478 VanDerWaalsContact O-N 3.12Å; Q475-G479 PolarHBondContact O-N 3.31Å; Q475-Y480 HydrophobicContact CB-CD1 4.4Å; Q475-Y480 HydrophobicContact CB-CG 4.28Å; Q475-Y480 WeakPolarHBondContact O-CB 3.34Å; Q475-Y480 PolarHBondContact O-N 3.22Å
476	V	96.8	Very high	95.2	Very high	9 Å²	9	73.5 Å²	73.5	6%	0.055	38%	0.383	C	S	.	.	H	α-helix	trans	-61.2	-40	177.9	166	0	0	0	0	111	P432 W447 Y464 V472 R478 G479 R481	P432-V476 HydrophobicContact CB-CG1 4.22Å; P432-V476 HydrophobicContact CG-CG1 4.26Å; W447-V476 HydrophobicContact CH2-CG1 3.5Å; W447-V476 HydrophobicContact CZ2-CG1 3.56Å; W447-V476 HydrophobicContact CZ2-CG2 4.47Å; Y464-V476 HydrophobicContact CE1-CG2 3.86Å; V472-V476 HydrophobicContact CG1-CG2 4.11Å; V472-V476 VanDerWaalsContact O-CB 3.27Å; V472-V476 WeakPolarHBondContact O-CB 3.29Å; V472-V476 WeakPolarHBondContact O-CG2 3.31Å; V472-V476 PolarHBondContact O-N 3.3Å; V476-R478 VanDerWaalsContact C-N 3.32Å; V476-R478 PolarHBondContact O-N 3.48Å; V476-G479 PolarHBondContact O-N 2.88Å; V476-R481 PolarHBondContact O-NH1 3.37Å
477	E	92.9	Very high	94.9	Very high	102 Å²	102	76.5 Å²	76.5	48%	0.477	38%	0.378	S	S	.	.	H	α-helix	trans	-63.4	-37.2	174.9	-173.4	175.9	-161.3	0	0	112.2	L473 Q475 G479	L473-E477 WeakPolarHBondContact O-CB 3.46Å; L473-E477 PolarHBondContact O-N 3.09Å; Q475-E477 VanDerWaalsContact C-N 3.28Å; Q475-E477 PolarHBondContact O-N 3.4Å; E477-G479 PolarHBondContact O-N 3.08Å
478	R	96.4	Very high	94.8	Very high	186 Å²	186	75 Å²	75	70%	0.702	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-1.6	172.7	-71	174.1	-178.6	171.8	4	114.3	E474 Q475 V476	E474-R478 VanDerWaalsContact O-CG 3.31Å; E474-R478 WeakPolarHBondContact O-CG 3.27Å; E474-R478 PolarHBondContact O-N 2.92Å; Q475-R478 CarbonylContact O-C 3.57Å; Q475-R478 WeakPolarHBondContact O-CA 3.49Å; Q475-R478 WeakPolarHBondContact O-CB 3.21Å; Q475-R478 PolarHBondContact O-N 3.42Å; Q475-R478 VanDerWaalsContact O-N 3.12Å; V476-R478 VanDerWaalsContact C-N 3.32Å; V476-R478 PolarHBondContact O-N 3.48Å
479	G	96	Very high	94.7	Very high	49 Å²	49	72.8 Å²	72.8	51%	0.505	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.5	4.8	177.3	0	0	0	0	0	114.7	Q475 V476 E477 R481	Q475-G479 PolarHBondContact O-N 3.31Å; V476-G479 PolarHBondContact O-N 2.88Å; E477-G479 PolarHBondContact O-N 3.08Å; G479-R481 PolarHBondContact O-N 3.12Å
480	Y	98.1	Very high	94.8	Very high	72 Å²	72	74.6 Å²	74.6	28%	0.282	37%	0.371	S	S	.	.			trans	-61.2	137.6	173.4	175.1	-92.7	0	0	0	110.9	Y464 M467 Q475 M482 P483	Y464-Y480 HydrophobicContact CD1-CD1 4.25Å; Y464-Y480 AromaticContact CD1-CE1 3.73Å; Y464-Y480 HydrophobicContact CD1-CE1 3.73Å; Y464-Y480 HydrophobicContact CE1-CD1 4.09Å; Y464-Y480 AromaticContact CE1-CE1 3.86Å; Y464-Y480 HydrophobicContact CE1-CE1 3.86Å; M467-Y480 HydrophobicContact CE-CE1 4.03Å; M467-Y480 HydrophobicContact CE-CE2 4.31Å; M467-Y480 HydrophobicContact SD-CE1 4.46Å; Q475-Y480 HydrophobicContact CB-CD1 4.4Å; Q475-Y480 HydrophobicContact CB-CG 4.28Å; Q475-Y480 WeakPolarHBondContact O-CB 3.34Å; Q475-Y480 PolarHBondContact O-N 3.22Å; Y480-M482 HydrophobicContact CE1-CG 4.27Å; Y480-P483 WeakPolarHBondContact OH-CD 3.37Å
481	R	98.1	Very high	94.8	Very high	48 Å²	48	68.4 Å²	68.4	18%	0.181	36%	0.355	C	S	.	.			trans	-132.5	148.8	169.3	-61.7	-61.8	179.7	-93.1	3.4	108.7	V476 G479 I497 W500	V476-R481 PolarHBondContact O-NH1 3.37Å; G479-R481 PolarHBondContact O-N 3.12Å; R481-I497 HydrophobicContact CB-CD1 3.9Å; R481-I497 HydrophobicContact CG-CD1 4.37Å; R481-W500 HydrophobicContact CB-CE3 4.25Å; R481-W500 VanDerWaalsContact CZ-O 3.29Å; R481-W500 PolarHBondContact NE-O 3.44Å; R481-W500 PolarHBondContact NH2-O 3Å
482	M	97.9	Very high	94.7	Very high	15 Å²	15	64.9 Å²	64.9	7%	0.074	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-61.6	136.6	179.6	-72.1	-177.2	-75.6	0	0	110.6	I451 T454 P463 Y464 Y480 H493 W500	I451-M482 HydrophobicContact CD1-CE 3.52Å; T454-M482 HydrophobicContact CG2-CE 3.83Å; P463-M482 HydrophobicContact CB-CE 4.22Å; P463-M482 HydrophobicContact CB-SD 4.24Å; Y464-M482 HydrophobicContact CD1-CG 3.73Å; Y464-M482 HydrophobicContact CD1-SD 4.14Å; Y464-M482 HydrophobicContact CD2-CE 4.37Å; Y464-M482 HydrophobicContact CD2-SD 4.22Å; Y464-M482 HydrophobicContact CE1-CE 4.32Å; Y464-M482 HydrophobicContact CE1-CG 3.68Å; Y464-M482 HydrophobicContact CE1-SD 4.25Å; Y464-M482 HydrophobicContact CE2-CE 3.94Å; Y464-M482 HydrophobicContact CE2-SD 4.33Å; Y464-M482 HydrophobicContact CG-CG 4.29Å; Y464-M482 HydrophobicContact CG-SD 4.1Å; Y464-M482 PolarHBondContact N-SD 3.41Å; Y480-M482 HydrophobicContact CE1-CG 4.27Å; M482-H493 PolarHBondContact O-NE2 3.13Å; M482-H493 VanDerWaalsContact O-NE2 3.12Å; M482-W500 HydrophobicContact CB-CH2 4.34Å; M482-W500 HydrophobicContact CB-CZ3 4.39Å; M482-W500 HydrophobicContact CE-CH2 3.85Å; M482-W500 HydrophobicContact CE-CZ2 3.84Å
483	P	97.6	Very high	94.8	Very high	92 Å²	92	66.1 Å²	66.1	60%	0.597	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-65.2	162.1	175.9	29.5	-35.7	0	0	0	110.9	Y480 P485	Y480-P483 WeakPolarHBondContact OH-CD 3.37Å; P483-P485 VanDerWaalsContact O-CD 3.31Å; P483-P485 WeakPolarHBondContact O-CD 3.34Å
484	C	97.7	Very high	95	Very high	53 Å²	53	69.1 Å²	69.1	36%	0.358	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-56.5	122.1	175.5	-172.6	0	0	0	0	109.9	C488 H493	C484-C488 PolarHBondContact SG-O 3.36Å; C484-H493 VanDerWaalsContact CA-CD2 3.48Å; C484-H493 WeakPolarHBondContact CA-CD2 3.39Å; C484-H493 HydrophobicContact CB-CB 4.12Å; C484-H493 PolarHBondContact N-NE2 2.76Å; C484-H493 VanDerWaalsContact SG-CB 3.6Å
485	P	95.4	Very high	95.1	Very high	25 Å²	25	66.3 Å²	66.3	16%	0.162	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-61	153.7	175.8	-24	35.2	0	0	0	112	V457 T458 P483 D487 C488	V457-P485 HydrophobicContact CG2-CB 4.06Å; V457-P485 HydrophobicContact CG2-CG 3.83Å; T458-P485 HydrophobicContact CG2-CB 3.77Å; T458-P485 HydrophobicContact CG2-CG 4Å; P483-P485 VanDerWaalsContact O-CD 3.31Å; P483-P485 WeakPolarHBondContact O-CD 3.34Å; P485-D487 PolarHBondContact O-N 3.07Å; P485-C488 HydrophobicContact CB-CB 4Å; P485-C488 HydrophobicContact CG-CB 4.32Å; P485-C488 VanDerWaalsContact O-CB 3.23Å; P485-C488 WeakPolarHBondContact O-CB 3.48Å; P485-C488 PolarHBondContact O-N 2.91Å
486	Q	91.4	Very high	95.2	Very high	161 Å²	161	63 Å²	63	75%	0.752	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	138.4	173.2	-171.5	179.1	-7.9	0	0	110.5	C488	Q486-C488 PolarHBondContact O-N 3.44Å; Q486-C488 VanDerWaalsContact O-N 3.08Å
487	D	87.5	Confident	95.3	Very high	147 Å²	147	65.4 Å²	65.4	79%	0.786	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	9.1	-178.8	-49.1	-43.4	0	0	0	115.1	P485	P485-D487 PolarHBondContact O-N 3.07Å
488	C	93.9	Very high	95.5	Very high	12 Å²	12	64.9 Å²	64.9	8%	0.081	34%	0.338	C	S	.	.			trans	-82.6	127.2	170.5	-177.7	0	0	0	0	109.6	V457 C484 P485 Q486	V457-C488 HydrophobicContact CG2-CB 4.32Å; C484-C488 PolarHBondContact SG-O 3.36Å; P485-C488 HydrophobicContact CB-CB 4Å; P485-C488 HydrophobicContact CG-CB 4.32Å; P485-C488 VanDerWaalsContact O-CB 3.23Å; P485-C488 WeakPolarHBondContact O-CB 3.48Å; P485-C488 PolarHBondContact O-N 2.91Å; Q486-C488 PolarHBondContact O-N 3.44Å; Q486-C488 VanDerWaalsContact O-N 3.08Å
489	P	92.8	Very high	95.6	Very high	37 Å²	37	56 Å²	56	24%	0.24	30%	0.304	C	S	.	.			trans	-62.8	145.7	172.9	-17.2	28.1	0	0	0	111.4	L361 S491 L492 H493 Y520	L361-P489 HydrophobicContact CD1-CG 4.41Å; L361-P489 HydrophobicContact CD2-CG 3.33Å; L361-P489 HydrophobicContact CG-CG 4.49Å; P489-S491 VanDerWaalsContact C-N 3.31Å; P489-S491 PolarHBondContact O-N 3.32Å; P489-L492 PolarHBondContact O-N 2.89Å; P489-H493 PolarHBondContact O-N 2.59Å; P489-H493 VanDerWaalsContact O-N 3.12Å; P489-Y520 WeakPolarHBondContact CB-OH 3.44Å; P489-Y520 WeakPolarHBondContact CG-OH 3.22Å
490	I	93	Very high	95.8	Very high	122 Å²	122	53.8 Å²	53.8	63%	0.626	28%	0.281	S	S	*	.	H	α-helix	trans	-59.6	-42.7	-178.2	-62.8	171.4	0	0	0	111	L492 H493 E494	I490-L492 VanDerWaalsContact C-N 3.29Å; I490-L492 PolarHBondContact O-N 3.28Å; I490-H493 CarbonylContact O-C 3.59Å; I490-H493 PolarHBondContact O-N 3.14Å; I490-H493 VanDerWaalsContact O-N 3.07Å; I490-E494 HydrophobicContact CG2-CG 4.19Å; I490-E494 WeakPolarHBondContact O-CG 3.44Å; I490-E494 PolarHBondContact O-N 2.72Å
491	S	91.4	Very high	95.8	Very high	50 Å²	50	54 Å²	54	35%	0.35	28%	0.283	S	S	.	.	H	α-helix	trans	-60.1	-36.7	179.2	50.2	0	0	0	0	113.3	P489 L495 Y520	P489-S491 VanDerWaalsContact C-N 3.31Å; P489-S491 PolarHBondContact O-N 3.32Å; S491-L495 PolarHBondContact O-N 3.48Å; S491-L495 VanDerWaalsContact O-N 3.11Å; S491-Y520 PolarHBondContact OG-OH 2.89Å
492	L	93	Very high	95.7	Very high	4 Å²	4	59.2 Å²	59.2	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-73.3	-35.3	175.6	-171.2	61.7	0	0	0	111.6	L361 V365 L453 V457 P489 I490 L495 M496 L517 Y520	L361-L492 HydrophobicContact CD1-CD2 4.12Å; V365-L492 HydrophobicContact CG2-CD2 4.27Å; L453-L492 HydrophobicContact CD1-CD1 4.48Å; V457-L492 HydrophobicContact CG1-CD2 3.73Å; P489-L492 PolarHBondContact O-N 2.89Å; I490-L492 VanDerWaalsContact C-N 3.29Å; I490-L492 PolarHBondContact O-N 3.28Å; L492-L495 HydrophobicContact CD1-CD2 4.19Å; L492-L495 WeakPolarHBondContact O-CB 3.37Å; L492-L495 PolarHBondContact O-N 3.12Å; L492-M496 HydrophobicContact CD2-CE 4.48Å; L492-M496 HydrophobicContact CG-CE 4.11Å; L492-M496 WeakPolarHBondContact O-CG 3.43Å; L492-M496 PolarHBondContact O-N 2.9Å; L492-M496 VanDerWaalsContact O-N 3.17Å; L492-L517 HydrophobicContact CD1-CD2 3.86Å; L492-Y520 HydrophobicContact CB-CE2 4.12Å; L492-Y520 HydrophobicContact CD1-CE2 4.4Å
493	H	97.8	Very high	95.7	Very high	30 Å²	30	62.4 Å²	62.4	14%	0.139	32%	0.324	C	S	.	.	H	α-helix	trans	-68	-39	172.6	179.5	-112.9	0	0	0	112.1	M482 C484 P489 I490 L495 M496 I497	M482-H493 PolarHBondContact O-NE2 3.13Å; M482-H493 VanDerWaalsContact O-NE2 3.12Å; C484-H493 VanDerWaalsContact CA-CD2 3.48Å; C484-H493 WeakPolarHBondContact CA-CD2 3.39Å; C484-H493 HydrophobicContact CB-CB 4.12Å; C484-H493 PolarHBondContact N-NE2 2.76Å; C484-H493 VanDerWaalsContact SG-CB 3.6Å; P489-H493 PolarHBondContact O-N 2.59Å; P489-H493 VanDerWaalsContact O-N 3.12Å; I490-H493 CarbonylContact O-C 3.59Å; I490-H493 PolarHBondContact O-N 3.14Å; I490-H493 VanDerWaalsContact O-N 3.07Å; H493-L495 VanDerWaalsContact C-N 3.28Å; H493-L495 PolarHBondContact O-N 3.31Å; H493-M496 WeakPolarHBondContact O-CA 3.35Å; H493-M496 VanDerWaalsContact O-CB 3.31Å; H493-M496 WeakPolarHBondContact O-CB 3.45Å; H493-M496 PolarHBondContact O-N 2.82Å; H493-I497 WeakPolarHBondContact O-CG1 2.91Å; H493-I497 PolarHBondContact O-N 2.85Å
494	E	96.3	Very high	95.7	Very high	105 Å²	105	59.4 Å²	59.4	49%	0.491	31%	0.305	S	S	.	.	H	α-helix	trans	-58	-43.1	172.2	-75.2	174.8	172.3	0	0	110.7	I490 M496 I497 H498	I490-E494 HydrophobicContact CG2-CG 4.19Å; I490-E494 WeakPolarHBondContact O-CG 3.44Å; I490-E494 PolarHBondContact O-N 2.72Å; E494-M496 VanDerWaalsContact C-N 3.31Å; E494-M496 PolarHBondContact O-N 3.09Å; E494-I497 WeakPolarHBondContact O-CB 3.49Å; E494-I497 PolarHBondContact O-N 2.78Å; E494-I497 VanDerWaalsContact O-N 3.13Å; E494-H498 PolarHBondContact O-N 2.9Å; E494-H498 PolarHBondContact O-ND1 2.88Å
495	L	96.6	Very high	95.6	Very high	5 Å²	5	63.6 Å²	63.6	3%	0.026	32%	0.319	C	S	.	.	H	α-helix	trans	-56.3	-44.6	172.6	-167.3	71	0	0	0	111.8	L453 S491 L492 H493 I497 H498 C499 Y512 L513 F516 L517	L453-L495 HydrophobicContact CD1-CD2 3.98Å; L453-L495 HydrophobicContact CD1-CG 4.49Å; S491-L495 PolarHBondContact O-N 3.48Å; S491-L495 VanDerWaalsContact O-N 3.11Å; L492-L495 HydrophobicContact CD1-CD2 4.19Å; L492-L495 WeakPolarHBondContact O-CB 3.37Å; L492-L495 PolarHBondContact O-N 3.12Å; H493-L495 VanDerWaalsContact C-N 3.28Å; H493-L495 PolarHBondContact O-N 3.31Å; L495-I497 VanDerWaalsContact C-N 3.34Å; L495-I497 PolarHBondContact O-N 2.68Å; L495-H498 WeakPolarHBondContact O-CB 3.48Å; L495-H498 PolarHBondContact O-N 2.51Å; L495-C499 PolarHBondContact O-N 3.18Å; L495-C499 PolarHBondContact O-SG 2.71Å; L495-C499 VanDerWaalsContact O-SG 3.39Å; L495-Y512 HydrophobicContact CD1-CE1 4.13Å; L495-L513 HydrophobicContact CD1-CD2 3.6Å; L495-L513 HydrophobicContact CD2-CD2 3.98Å; L495-L513 HydrophobicContact CG-CD2 3.8Å; L495-F516 HydrophobicContact CB-CE1 4.19Å; L495-F516 HydrophobicContact CD1-CD1 3.86Å; L495-F516 HydrophobicContact CD1-CD2 4.48Å; L495-F516 HydrophobicContact CD1-CE1 4.08Å; L495-F516 HydrophobicContact CD1-CG 4.07Å; L495-F516 HydrophobicContact CD1-CZ 4.48Å; L495-F516 HydrophobicContact CD2-CD1 3.57Å; L495-F516 HydrophobicContact CD2-CE1 3.72Å; L495-F516 HydrophobicContact CG-CD1 4.23Å; L495-F516 HydrophobicContact CG-CE1 4.21Å; L495-L517 HydrophobicContact CD2-CD2 3.96Å; L495-L517 HydrophobicContact CD2-CG 4.18Å
496	M	98.4	Very high	95.8	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-60.4	-42.6	175.3	-59.9	165.3	-170.2	0	0	111.8	L453 T454 V457 L492 H493 E494 H498 C499 W500	L453-M496 HydrophobicContact CB-CE 3.64Å; L453-M496 HydrophobicContact CB-CG 3.88Å; L453-M496 HydrophobicContact CB-SD 4.42Å; L453-M496 HydrophobicContact CD1-CG 3.95Å; T454-M496 HydrophobicContact CG2-CE 4.45Å; T454-M496 HydrophobicContact CG2-SD 3.72Å; V457-M496 HydrophobicContact CG1-CE 4.29Å; V457-M496 HydrophobicContact CG2-CE 3.96Å; L492-M496 HydrophobicContact CD2-CE 4.48Å; L492-M496 HydrophobicContact CG-CE 4.11Å; L492-M496 WeakPolarHBondContact O-CG 3.43Å; L492-M496 PolarHBondContact O-N 2.9Å; L492-M496 VanDerWaalsContact O-N 3.17Å; H493-M496 WeakPolarHBondContact O-CA 3.35Å; H493-M496 VanDerWaalsContact O-CB 3.31Å; H493-M496 WeakPolarHBondContact O-CB 3.45Å; H493-M496 PolarHBondContact O-N 2.82Å; E494-M496 VanDerWaalsContact C-N 3.31Å; E494-M496 PolarHBondContact O-N 3.09Å; M496-H498 VanDerWaalsContact C-N 3.32Å; M496-H498 PolarHBondContact O-N 2.95Å; M496-C499 WeakPolarHBondContact O-CB 3.41Å; M496-C499 PolarHBondContact O-N 2.95Å; M496-C499 VanDerWaalsContact O-N 3.17Å; M496-W500 HydrophobicContact CB-CE3 4.25Å; M496-W500 HydrophobicContact CB-CH2 3.67Å; M496-W500 HydrophobicContact CB-CZ2 4Å; M496-W500 HydrophobicContact CB-CZ3 3.82Å; M496-W500 HydrophobicContact CG-CH2 4.34Å; M496-W500 VanDerWaalsContact O-CG 3.31Å; M496-W500 PolarHBondContact O-N 2.87Å; M496-W500 HydrophobicContact SD-CH2 4.27Å
497	I	98.5	Very high	96.1	Very high	58 Å²	58	60.4 Å²	60.4	30%	0.297	30%	0.302	S	S	.	.	H	α-helix	trans	-62.6	-38.3	177	-65.5	-67.9	0	0	0	111.4	R481 H493 E494 L495 W500 K501	R481-I497 HydrophobicContact CB-CD1 3.9Å; R481-I497 HydrophobicContact CG-CD1 4.37Å; H493-I497 WeakPolarHBondContact O-CG1 2.91Å; H493-I497 PolarHBondContact O-N 2.85Å; E494-I497 WeakPolarHBondContact O-CB 3.49Å; E494-I497 PolarHBondContact O-N 2.78Å; E494-I497 VanDerWaalsContact O-N 3.13Å; L495-I497 VanDerWaalsContact C-N 3.34Å; L495-I497 PolarHBondContact O-N 2.68Å; I497-W500 HydrophobicContact CD1-CE3 4.1Å; I497-W500 HydrophobicContact CD1-CZ3 4.28Å; I497-W500 CarbonylContact O-C 3.57Å; I497-W500 PolarHBondContact O-N 2.85Å; I497-W500 VanDerWaalsContact O-N 3.16Å; I497-K501 PolarHBondContact O-N 2.78Å
498	H	98.1	Very high	96.6	Very high	91 Å²	91	54.3 Å²	54.3	42%	0.421	27%	0.27	S	S	.	.	H	α-helix	trans	-64.2	-40.3	173.3	-72.1	86.9	0	0	0	111.8	E494 L495 M496 W500 K501	E494-H498 PolarHBondContact O-N 2.9Å; E494-H498 PolarHBondContact O-ND1 2.88Å; L495-H498 WeakPolarHBondContact O-CB 3.48Å; L495-H498 PolarHBondContact O-N 2.51Å; M496-H498 VanDerWaalsContact C-N 3.32Å; M496-H498 PolarHBondContact O-N 2.95Å; H498-W500 PolarHBondContact O-N 3.48Å; H498-K501 VanDerWaalsContact O-CG 3.3Å; H498-K501 WeakPolarHBondContact O-CG 3.04Å; H498-K501 PolarHBondContact O-N 2.98Å
499	C	98.8	Very high	96.8	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-27.7	172.9	-66.5	0	0	0	0	113	V446 W447 L495 M496 R507	V446-C499 HydrophobicContact CG1-CB 4.08Å; V446-C499 WeakPolarHBondContact O-CB 3.45Å; W447-C499 WeakPolarHBondContact CA-O 3.47Å; L495-C499 PolarHBondContact O-N 3.18Å; L495-C499 PolarHBondContact O-SG 2.71Å; L495-C499 VanDerWaalsContact O-SG 3.39Å; M496-C499 WeakPolarHBondContact O-CB 3.41Å; M496-C499 PolarHBondContact O-N 2.95Å; M496-C499 VanDerWaalsContact O-N 3.17Å; C499-R507 VanDerWaalsContact O-CD 3.26Å; C499-R507 WeakPolarHBondContact O-CD 3.39Å
500	W	98.6	Very high	97.1	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.008	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	22.4	-178.7	-53.1	-37.8	0	0	0	114.6	W447 G450 I451 T454 R481 M482 M496 I497 H498 K502	W447-W500 HydrophobicContact CD2-CB 4.47Å; W447-W500 AromaticContact CD2-CD1 3.67Å; W447-W500 HydrophobicContact CD2-CG 4.39Å; W447-W500 AromaticContact CE2-CD1 3.79Å; W447-W500 HydrophobicContact CE3-CB 4.02Å; W447-W500 HydrophobicContact CE3-CG 4.41Å; W447-W500 AromaticContact CG-CD1 3.95Å; W447-W500 HydrophobicContact CH2-CB 3.96Å; W447-W500 HydrophobicContact CH2-CG 4.44Å; W447-W500 HydrophobicContact CZ2-CB 4.43Å; W447-W500 HydrophobicContact CZ2-CG 4.44Å; W447-W500 HydrophobicContact CZ3-CB 3.76Å; W447-W500 HydrophobicContact CZ3-CG 4.45Å; W447-W500 VanDerWaalsContact CZ3-O 3.29Å; W447-W500 WeakPolarHBondContact CZ3-O 3.48Å; W447-W500 PolarHBondContact O-NE1 3.36Å; G450-W500 VanDerWaalsContact C-CZ2 3.49Å; G450-W500 VanDerWaalsContact O-CZ2 3.27Å; G450-W500 WeakPolarHBondContact O-CZ2 3.41Å; I451-W500 HydrophobicContact CD1-CZ2 3.7Å; I451-W500 HydrophobicContact CG1-CZ2 4.47Å; T454-W500 HydrophobicContact CG2-CH2 3.41Å; T454-W500 VanDerWaalsContact CG2-CH2 3.41Å; T454-W500 HydrophobicContact CG2-CZ2 3.58Å; R481-W500 HydrophobicContact CB-CE3 4.25Å; R481-W500 VanDerWaalsContact CZ-O 3.29Å; R481-W500 PolarHBondContact NE-O 3.44Å; R481-W500 PolarHBondContact NH2-O 3Å; M482-W500 HydrophobicContact CB-CH2 4.34Å; M482-W500 HydrophobicContact CB-CZ3 4.39Å; M482-W500 HydrophobicContact CE-CH2 3.85Å; M482-W500 HydrophobicContact CE-CZ2 3.84Å; M496-W500 HydrophobicContact CB-CE3 4.25Å; M496-W500 HydrophobicContact CB-CH2 3.67Å; M496-W500 HydrophobicContact CB-CZ2 4Å; M496-W500 HydrophobicContact CB-CZ3 3.82Å; M496-W500 HydrophobicContact CG-CH2 4.34Å; M496-W500 VanDerWaalsContact O-CG 3.31Å; M496-W500 PolarHBondContact O-N 2.87Å; M496-W500 HydrophobicContact SD-CH2 4.27Å; I497-W500 HydrophobicContact CD1-CE3 4.1Å; I497-W500 HydrophobicContact CD1-CZ3 4.28Å; I497-W500 CarbonylContact O-C 3.57Å; I497-W500 PolarHBondContact O-N 2.85Å; I497-W500 VanDerWaalsContact O-N 3.16Å; H498-W500 PolarHBondContact O-N 3.48Å; W500-K502 PolarHBondContact O-N 3.08Å
501	K	98.5	Very high	97.2	Very high	77 Å²	77	55.2 Å²	55.2	34%	0.335	27%	0.271	S	S	.	.			trans	-56.3	140.6	169.7	-71.8	-74.8	-173.6	162.8	0	110.5	I497 H498 E506 R507	I497-K501 PolarHBondContact O-N 2.78Å; H498-K501 VanDerWaalsContact O-CG 3.3Å; H498-K501 WeakPolarHBondContact O-CG 3.04Å; H498-K501 PolarHBondContact O-N 2.98Å; K501-E506 HydrophobicContact CB-CB 3.93Å; K501-E506 HydrophobicContact CG-CB 4.1Å; K501-R507 HydrophobicContact CB-CG 4.01Å; K501-R507 PolarHBondContact O-NE 3.19Å; K501-R507 PolarHBondContact O-NH2 3.18Å
502	K	96.5	Very high	97.3	Very high	158 Å²	158	59 Å²	59	69%	0.687	28%	0.279	S	S	*	.	S	Bend	trans	-64.2	-47.4	-177	-178.5	178.1	178.2	176.1	0	110.1	W500 P504	W500-K502 PolarHBondContact O-N 3.08Å; K502-P504 WeakPolarHBondContact O-CD 3.35Å
503	D	97.4	Very high	97.5	Very high	81 Å²	81	58.8 Å²	58.8	43%	0.433	28%	0.278	S	S	.	.	S	Bend	trans	-73.1	121.4	171.7	-170.6	-13.4	0	0	0	109.5	E505 E506	D503-E505 PolarHBondContact O-N 3.01Å; D503-E505 PolarHBondContact OD1-N 3.21Å; D503-E505 VanDerWaalsContact OD1-N 3.07Å; D503-E506 HydrophobicContact CB-CB 4.35Å; D503-E506 HydrophobicContact CB-CG 3.94Å; D503-E506 PolarHBondContact O-N 2.66Å
504	P	97.6	Very high	97.3	Very high	29 Å²	29	59.4 Å²	59.4	19%	0.188	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-57	-33.5	176.2	-24.8	35.4	0	0	0	113.9	E433 K443 K502 E506 R507	E433-P504 HydrophobicContact CG-CG 4.04Å; K443-P504 HydrophobicContact CB-CB 3.75Å; K443-P504 WeakPolarHBondContact CD-O 3.03Å; K443-P504 HydrophobicContact CG-CB 4.31Å; K443-P504 WeakPolarHBondContact CG-O 3.37Å; K502-P504 WeakPolarHBondContact O-CD 3.35Å; P504-E506 VanDerWaalsContact C-N 3.3Å; P504-E506 PolarHBondContact O-N 3.42Å; P504-R507 WeakPolarHBondContact O-CB 3.17Å; P504-R507 WeakPolarHBondContact O-CG 3.41Å; P504-R507 PolarHBondContact O-N 3.16Å
505	E	97.1	Very high	96.8	Very high	141 Å²	141	55.8 Å²	55.8	66%	0.659	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-73.9	-22.6	-175.8	-63.9	-53.6	119.9	0	0	112.8	D503 R507	D503-E505 PolarHBondContact O-N 3.01Å; D503-E505 PolarHBondContact OD1-N 3.21Å; D503-E505 VanDerWaalsContact OD1-N 3.07Å; E505-R507 PolarHBondContact O-N 3.2Å
506	E	97.9	Very high	96.4	Very high	115 Å²	115	58.4 Å²	58.4	54%	0.537	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-77.3	-9.6	173.3	-67.9	-169.8	132.5	0	0	113.2	K501 D503 P504	K501-E506 HydrophobicContact CB-CB 3.93Å; K501-E506 HydrophobicContact CG-CB 4.1Å; D503-E506 HydrophobicContact CB-CB 4.35Å; D503-E506 HydrophobicContact CB-CG 3.94Å; D503-E506 PolarHBondContact O-N 2.66Å; P504-E506 VanDerWaalsContact C-N 3.3Å; P504-E506 PolarHBondContact O-N 3.42Å
507	R	98.6	Very high	96.1	Very high	4 Å²	4	58.6 Å²	58.6	2%	0.015	28%	0.284	C	S	.	.	S	Bend	trans	-76.9	144.2	178.9	-57.5	174.9	-168.1	157	10.4	109.6	E433 K443 V446 C499 K501 P504 E505	E433-R507 IonicContact OE1-CZ 3.13Å; E433-R507 IonicContact OE1-NH1 2.97Å; E433-R507 PolarHBondContact OE1-NH1 3.21Å; E433-R507 IonicContact OE1-NH2 3.42Å; E433-R507 PolarHBondContact OE1-NH2 3.4Å; E433-R507 IonicContact OE2-CZ 3.84Å; E433-R507 IonicContact OE2-NH1 3.73Å; E433-R507 IonicContact OE2-NH2 2.71Å; E433-R507 PolarHBondContact OE2-NH2 3.08Å; K443-R507 HydrophobicContact CD-CB 4.31Å; K443-R507 PolarHBondContact NZ-O 3.39Å; K443-R507 WeakPolarHBondContact O-CD 3.41Å; K443-R507 PolarHBondContact O-NH1 2.91Å; V446-R507 HydrophobicContact CB-CB 4.46Å; V446-R507 HydrophobicContact CG1-CB 3.86Å; C499-R507 VanDerWaalsContact O-CD 3.26Å; C499-R507 WeakPolarHBondContact O-CD 3.39Å; K501-R507 HydrophobicContact CB-CG 4.01Å; K501-R507 PolarHBondContact O-NE 3.19Å; K501-R507 PolarHBondContact O-NH2 3.18Å; P504-R507 WeakPolarHBondContact O-CB 3.17Å; P504-R507 WeakPolarHBondContact O-CG 3.41Å; P504-R507 PolarHBondContact O-N 3.16Å; E505-R507 PolarHBondContact O-N 3.2Å
508	P	98	Very high	95.4	Very high	19 Å²	19	58.8 Å²	58.8	12%	0.123	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-62.7	165.4	179.9	26.7	-34.7	0	0	0	112.5	K443 V446 Y512 L513	K443-P508 PolarHBondContact NZ-O 3.44Å; V446-P508 HydrophobicContact CG1-CG 4.14Å; V446-P508 WeakPolarHBondContact CG2-O 3.48Å; P508-Y512 HydrophobicContact CB-CD1 3.6Å; P508-Y512 HydrophobicContact CB-CE1 4.29Å; P508-Y512 HydrophobicContact CB-CG 4.3Å; P508-L513 HydrophobicContact CB-CD2 4.35Å; P508-L513 HydrophobicContact CB-CG 4.26Å; P508-L513 HydrophobicContact CG-CD1 4.27Å; P508-L513 HydrophobicContact CG-CD2 3.75Å; P508-L513 HydrophobicContact CG-CG 3.98Å
509	T	98.3	Very high	94.7	Very high	52 Å²	52	58.1 Å²	58.1	32%	0.319	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-80.9	161.1	167.2	58.9	0	0	0	0	110.4	E511 Y512 L513	T509-E511 VanDerWaalsContact C-N 3.27Å; T509-E511 PolarHBondContact O-N 3.27Å; T509-Y512 PolarHBondContact O-N 3.04Å; T509-Y512 PolarHBondContact OG1-N 3.29Å; T509-L513 WeakPolarHBondContact O-CG 3.36Å; T509-L513 PolarHBondContact O-N 2.95Å; T509-L513 VanDerWaalsContact O-N 3.08Å
510	F	98.3	Very high	93.9	Very high	0 Å²	0	60 Å²	60	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-69.1	-29.6	173.9	-83.1	-72.1	0	0	0	112.3	M375 A376 E379 L388 I442 D445 V446 F449 Y512 L513 Q514	M375-F510 HydrophobicContact CB-CB 4.23Å; M375-F510 HydrophobicContact CB-CD1 3.32Å; M375-F510 HydrophobicContact CB-CD2 3.78Å; M375-F510 HydrophobicContact CB-CE1 3.4Å; M375-F510 VanDerWaalsContact CB-CE1 3.4Å; M375-F510 HydrophobicContact CB-CE2 3.85Å; M375-F510 HydrophobicContact CB-CG 3.51Å; M375-F510 HydrophobicContact CB-CZ 3.66Å; M375-F510 HydrophobicContact CE-CD2 4.32Å; M375-F510 HydrophobicContact CE-CE2 3.59Å; M375-F510 HydrophobicContact CE-CZ 3.74Å; M375-F510 HydrophobicContact CG-CD1 4.18Å; M375-F510 HydrophobicContact CG-CE1 3.75Å; M375-F510 HydrophobicContact CG-CE2 4.35Å; M375-F510 HydrophobicContact CG-CZ 3.84Å; A376-F510 HydrophobicContact CB-CB 3.88Å; E379-F510 PolarHBondContact OE2-N 3.31Å; L388-F510 HydrophobicContact CD2-CE1 4.47Å; L388-F510 HydrophobicContact CD2-CZ 4.16Å; I442-F510 HydrophobicContact CD1-CD2 3.81Å; I442-F510 HydrophobicContact CD1-CE2 3.71Å; I442-F510 HydrophobicContact CG1-CD2 3.93Å; I442-F510 HydrophobicContact CG1-CE2 4.04Å; D445-F510 HydrophobicContact CB-CE2 3.95Å; D445-F510 HydrophobicContact CB-CZ 4.08Å; V446-F510 HydrophobicContact CG2-CD2 3.88Å; V446-F510 HydrophobicContact CG2-CE2 3.58Å; V446-F510 HydrophobicContact CG2-CZ 3.97Å; F449-F510 HydrophobicContact CB-CE1 3.71Å; F449-F510 HydrophobicContact CB-CZ 4Å; F449-F510 HydrophobicContact CD1-CE1 4.36Å; F449-F510 AromaticContact CD2-CE1 3.94Å; F449-F510 HydrophobicContact CD2-CE1 3.94Å; F449-F510 AromaticContact CG-CE1 3.75Å; F449-F510 HydrophobicContact CG-CE1 3.75Å; F510-Y512 VanDerWaalsContact C-N 3.35Å; F510-Y512 PolarHBondContact O-N 3.27Å; F510-L513 HydrophobicContact CD1-CD1 3.83Å; F510-L513 HydrophobicContact CE1-CD1 4.09Å; F510-L513 HydrophobicContact CG-CD1 4.48Å; F510-L513 PolarHBondContact O-N 3.13Å; F510-Q514 WeakPolarHBondContact O-CB 3.25Å; F510-Q514 PolarHBondContact O-N 2.77Å
511	E	94.7	Very high	92.8	Very high	139 Å²	139	65 Å²	65	65%	0.65	31%	0.312	S	S	*	.	H	α-helix	trans	-57.4	-45.9	170.3	-176.8	175	-148.4	0	0	111.9	T509 Q514 G515	T509-E511 VanDerWaalsContact C-N 3.27Å; T509-E511 PolarHBondContact O-N 3.27Å; E511-Q514 PolarHBondContact O-N 3.45Å; E511-G515 PolarHBondContact O-N 2.99Å; E511-G515 VanDerWaalsContact O-N 3.07Å
512	Y	94.6	Very high	91.3	Very high	129 Å²	129	62.7 Å²	62.7	51%	0.506	31%	0.305	S	S	.	.	H	α-helix	trans	-64.1	-45.4	175.1	174.5	-90.5	0	0	0	111.8	L495 P508 T509 F510 Q514 G515 F516	L495-Y512 HydrophobicContact CD1-CE1 4.13Å; P508-Y512 HydrophobicContact CB-CD1 3.6Å; P508-Y512 HydrophobicContact CB-CE1 4.29Å; P508-Y512 HydrophobicContact CB-CG 4.3Å; T509-Y512 PolarHBondContact O-N 3.04Å; T509-Y512 PolarHBondContact OG1-N 3.29Å; F510-Y512 VanDerWaalsContact C-N 3.35Å; F510-Y512 PolarHBondContact O-N 3.27Å; Y512-Q514 VanDerWaalsContact C-N 3.32Å; Y512-Q514 PolarHBondContact O-N 2.82Å; Y512-G515 PolarHBondContact O-N 2.82Å; Y512-F516 HydrophobicContact CE1-CB 4.34Å; Y512-F516 WeakPolarHBondContact O-CB 3.41Å; Y512-F516 PolarHBondContact O-N 3.46Å
513	L	96.4	Very high	89.3	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.9	-42.1	179.4	-69.5	170.5	0	0	0	111.8	A372 V446 F449 L495 P508 T509 F510 L517	A372-L513 HydrophobicContact CB-CB 4.39Å; V446-L513 HydrophobicContact CG1-CD1 4.11Å; F449-L513 HydrophobicContact CD1-CD1 3.74Å; F449-L513 HydrophobicContact CE1-CB 4.32Å; F449-L513 HydrophobicContact CE1-CD1 4.07Å; F449-L513 HydrophobicContact CE1-CD2 4.35Å; F449-L513 HydrophobicContact CE1-CG 4.49Å; L495-L513 HydrophobicContact CD1-CD2 3.6Å; L495-L513 HydrophobicContact CD2-CD2 3.98Å; L495-L513 HydrophobicContact CG-CD2 3.8Å; P508-L513 HydrophobicContact CB-CD2 4.35Å; P508-L513 HydrophobicContact CB-CG 4.26Å; P508-L513 HydrophobicContact CG-CD1 4.27Å; P508-L513 HydrophobicContact CG-CD2 3.75Å; P508-L513 HydrophobicContact CG-CG 3.98Å; T509-L513 WeakPolarHBondContact O-CG 3.36Å; T509-L513 PolarHBondContact O-N 2.95Å; T509-L513 VanDerWaalsContact O-N 3.08Å; F510-L513 HydrophobicContact CD1-CD1 3.83Å; F510-L513 HydrophobicContact CE1-CD1 4.09Å; F510-L513 HydrophobicContact CG-CD1 4.48Å; F510-L513 PolarHBondContact O-N 3.13Å; L513-L517 WeakPolarHBondContact O-CB 3.45Å; L513-L517 WeakPolarHBondContact O-CD1 3.43Å; L513-L517 VanDerWaalsContact O-CG 3.24Å; L513-L517 WeakPolarHBondContact O-CG 3.41Å; L513-L517 PolarHBondContact O-N 2.92Å
514	Q	93.7	Very high	86.7	Confident	43 Å²	43	62.1 Å²	62.1	20%	0.201	33%	0.327	C	S	.	.	H	α-helix	trans	-58.5	-56	174.6	179.6	-172.2	-5.2	0	0	110.3	A372 A373 F510 E511 Y512 F516 L517 E518	A372-Q514 HydrophobicContact CB-CB 4.07Å; A373-Q514 HydrophobicContact CB-CG 4.09Å; F510-Q514 WeakPolarHBondContact O-CB 3.25Å; F510-Q514 PolarHBondContact O-N 2.77Å; E511-Q514 PolarHBondContact O-N 3.45Å; Y512-Q514 VanDerWaalsContact C-N 3.32Å; Y512-Q514 PolarHBondContact O-N 2.82Å; Q514-F516 VanDerWaalsContact C-N 3.35Å; Q514-F516 PolarHBondContact O-N 2.8Å; Q514-L517 PolarHBondContact O-N 2.83Å; Q514-E518 HydrophobicContact CG-CG 4.3Å; Q514-E518 VanDerWaalsContact CG-OE1 3.29Å; Q514-E518 WeakPolarHBondContact CG-OE1 3.16Å; Q514-E518 PolarHBondContact NE2-OE1 2.67Å; Q514-E518 WeakPolarHBondContact O-CB 3.28Å; Q514-E518 WeakPolarHBondContact O-CG 3.45Å; Q514-E518 PolarHBondContact O-N 3.5Å
515	G	85.7	Confident	84.6	Confident	29 Å²	29	64.6 Å²	64.6	30%	0.299	34%	0.336	S	S	.	.	H	α-helix	trans	-59	-44.2	-178.7	0	0	0	0	0	112.8	E511 Y512 L517 E518 D519	E511-G515 PolarHBondContact O-N 2.99Å; E511-G515 VanDerWaalsContact O-N 3.07Å; Y512-G515 PolarHBondContact O-N 2.82Å; G515-L517 PolarHBondContact O-N 3.25Å; G515-E518 PolarHBondContact O-N 3.19Å; G515-D519 WeakPolarHBondContact O-CB 3.25Å; G515-D519 PolarHBondContact O-N 3.42Å
516	F	89.8	Confident	82.7	Confident	59 Å²	59	61.8 Å²	61.8	26%	0.259	33%	0.33	S	S	.	.	H	α-helix	trans	-59.1	-44	176.9	179.3	-85.7	0	0	0	112.5	L495 Y512 Q514 Y520	L495-F516 HydrophobicContact CB-CE1 4.19Å; L495-F516 HydrophobicContact CD1-CD1 3.86Å; L495-F516 HydrophobicContact CD1-CD2 4.48Å; L495-F516 HydrophobicContact CD1-CE1 4.08Å; L495-F516 HydrophobicContact CD1-CG 4.07Å; L495-F516 HydrophobicContact CD1-CZ 4.48Å; L495-F516 HydrophobicContact CD2-CD1 3.57Å; L495-F516 HydrophobicContact CD2-CE1 3.72Å; L495-F516 HydrophobicContact CG-CD1 4.23Å; L495-F516 HydrophobicContact CG-CE1 4.21Å; Y512-F516 HydrophobicContact CE1-CB 4.34Å; Y512-F516 WeakPolarHBondContact O-CB 3.41Å; Y512-F516 PolarHBondContact O-N 3.46Å; Q514-F516 VanDerWaalsContact C-N 3.35Å; Q514-F516 PolarHBondContact O-N 2.8Å; F516-Y520 HydrophobicContact CD1-CD2 4.23Å; F516-Y520 AromaticContact CE1-CD2 3.54Å; F516-Y520 HydrophobicContact CE1-CD2 3.54Å; F516-Y520 AromaticContact CE1-CE2 3.83Å; F516-Y520 HydrophobicContact CE1-CE2 3.83Å; F516-Y520 HydrophobicContact CZ-CD2 4.05Å; F516-Y520 HydrophobicContact CZ-CE2 4.13Å; F516-Y520 WeakPolarHBondContact O-CA 3.45Å; F516-Y520 PolarHBondContact O-N 3.41Å; F516-Y520 VanDerWaalsContact O-N 3.09Å
517	L	90.5	Very high	81.1	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.021	33%	0.328	C	S	.	.	H	α-helix	trans	-76	-37.1	-177.3	-69.9	166.9	0	0	0	112.4	V365 A368 A369 A372 F449 L492 L495 L513 Q514 G515 D519 Y520	V365-L517 HydrophobicContact CG1-CD2 4.1Å; A368-L517 HydrophobicContact CB-CD1 3.85Å; A368-L517 HydrophobicContact CB-CD2 4.3Å; A369-L517 HydrophobicContact CB-CB 3.78Å; A372-L517 HydrophobicContact CB-CD1 4.18Å; F449-L517 HydrophobicContact CE1-CD1 3.9Å; F449-L517 HydrophobicContact CZ-CD1 3.57Å; L492-L517 HydrophobicContact CD1-CD2 3.86Å; L495-L517 HydrophobicContact CD2-CD2 3.96Å; L495-L517 HydrophobicContact CD2-CG 4.18Å; L513-L517 WeakPolarHBondContact O-CB 3.45Å; L513-L517 WeakPolarHBondContact O-CD1 3.43Å; L513-L517 VanDerWaalsContact O-CG 3.24Å; L513-L517 WeakPolarHBondContact O-CG 3.41Å; L513-L517 PolarHBondContact O-N 2.92Å; Q514-L517 PolarHBondContact O-N 2.83Å; G515-L517 PolarHBondContact O-N 3.25Å; L517-D519 VanDerWaalsContact C-N 3.29Å; L517-D519 PolarHBondContact O-N 3.05Å; L517-Y520 WeakPolarHBondContact O-CB 3.48Å; L517-Y520 PolarHBondContact O-N 3.41Å
518	E	85.1	Confident	79.8	Confident	62 Å²	62	63 Å²	63	29%	0.29	33%	0.334	S	S	.	.	H	α-helix	trans	-61.3	-41.4	173.4	-73.3	178.7	178.5	0	0	110.7	K157 A369 Q514 G515	K157-E518 WeakPolarHBondContact CE-O 3.44Å; K157-E518 HydrophobicContact CG-CB 4.27Å; K157-E518 HydrophobicContact CG-CG 4.24Å; K157-E518 PolarHBondContact NZ-O 3.26Å; A369-E518 HydrophobicContact CB-CG 4.07Å; Q514-E518 HydrophobicContact CG-CG 4.3Å; Q514-E518 VanDerWaalsContact CG-OE1 3.29Å; Q514-E518 WeakPolarHBondContact CG-OE1 3.16Å; Q514-E518 PolarHBondContact NE2-OE1 2.67Å; Q514-E518 WeakPolarHBondContact O-CB 3.28Å; Q514-E518 WeakPolarHBondContact O-CG 3.45Å; Q514-E518 PolarHBondContact O-N 3.5Å; G515-E518 PolarHBondContact O-N 3.19Å
519	D	82.1	Confident	78.8	Confident	78 Å²	78	65 Å²	65	42%	0.417	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	3.6	-177.8	-74.7	-33.4	0	0	0	115.6	G515 L517 F521 T522 A523	G515-D519 WeakPolarHBondContact O-CB 3.25Å; G515-D519 PolarHBondContact O-N 3.42Å; L517-D519 VanDerWaalsContact C-N 3.29Å; L517-D519 PolarHBondContact O-N 3.05Å; D519-F521 PolarHBondContact O-N 3.24Å; D519-T522 VanDerWaalsContact CA-OG1 3.3Å; D519-T522 WeakPolarHBondContact CA-OG1 3.3Å; D519-T522 PolarHBondContact O-N 3.36Å; D519-T522 PolarHBondContact OD1-OG1 2.74Å; D519-A523 PolarHBondContact O-N 3.24Å
520	Y	83.4	Confident	77.2	Confident	40 Å²	40	65.6 Å²	65.6	16%	0.157	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-34.9	-170.4	-170.6	-93.6	0	0	0	114.3	V365 P489 S491 L492 F516 L517	V365-Y520 HydrophobicContact CG1-CD1 4.09Å; V365-Y520 HydrophobicContact CG1-CG 3.95Å; V365-Y520 HydrophobicContact CG2-CD1 4.17Å; V365-Y520 HydrophobicContact CG2-CE1 4.31Å; P489-Y520 WeakPolarHBondContact CB-OH 3.44Å; P489-Y520 WeakPolarHBondContact CG-OH 3.22Å; S491-Y520 PolarHBondContact OG-OH 2.89Å; L492-Y520 HydrophobicContact CB-CE2 4.12Å; L492-Y520 HydrophobicContact CD1-CE2 4.4Å; F516-Y520 HydrophobicContact CD1-CD2 4.23Å; F516-Y520 AromaticContact CE1-CD2 3.54Å; F516-Y520 HydrophobicContact CE1-CD2 3.54Å; F516-Y520 AromaticContact CE1-CE2 3.83Å; F516-Y520 HydrophobicContact CE1-CE2 3.83Å; F516-Y520 HydrophobicContact CZ-CD2 4.05Å; F516-Y520 HydrophobicContact CZ-CE2 4.13Å; F516-Y520 WeakPolarHBondContact O-CA 3.45Å; F516-Y520 PolarHBondContact O-N 3.41Å; F516-Y520 VanDerWaalsContact O-N 3.09Å; L517-Y520 WeakPolarHBondContact O-CB 3.48Å; L517-Y520 PolarHBondContact O-N 3.41Å
521	F	75.2	Confident	75.1	Confident	105 Å²	105	66.7 Å²	66.7	46%	0.461	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-9.5	176.7	-62.5	-74.3	0	0	0	113.9	L361 P362 V365 D519	L361-F521 HydrophobicContact CD2-CE1 4.47Å; L361-F521 HydrophobicContact CD2-CZ 4.03Å; L361-F521 HydrophobicContact CG-CZ 4.13Å; P362-F521 HydrophobicContact CB-CE2 4.05Å; P362-F521 HydrophobicContact CB-CZ 4.34Å; P362-F521 HydrophobicContact CG-CE2 4.23Å; P362-F521 HydrophobicContact CG-CZ 4.03Å; V365-F521 HydrophobicContact CB-CE2 3.97Å; V365-F521 HydrophobicContact CG1-CE2 4.11Å; V365-F521 HydrophobicContact CG2-CE2 4.05Å; V365-F521 HydrophobicContact CG2-CZ 4.31Å; D519-F521 PolarHBondContact O-N 3.24Å
522	T	66.1	Low	72.9	Confident	29 Å²	29	68.5 Å²	68.5	18%	0.178	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-9.5	-172.7	32.1	0	0	0	0	114.6	K157 D519 T524 E525	K157-T522 PolarHBondContact NZ-OG1 2.87Å; D519-T522 VanDerWaalsContact CA-OG1 3.3Å; D519-T522 WeakPolarHBondContact CA-OG1 3.3Å; D519-T522 PolarHBondContact O-N 3.36Å; D519-T522 PolarHBondContact OD1-OG1 2.74Å; T522-T524 PolarHBondContact O-N 2.74Å; T522-E525 PolarHBondContact O-N 3.07Å
523	A	55.2	Low	70.5	Confident	93 Å²	93	69.2 Å²	69.2	77%	0.769	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-4.2	-175	0	0	0	0	0	116.5	D519	D519-A523 PolarHBondContact O-N 3.24Å
524	T	43.1	Very low	68	Low	134 Å²	134	71.9 Å²	71.9	82%	0.822	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-3.4	176.8	55.9	0	0	0	0	114.5	T522	T522-T524 PolarHBondContact O-N 2.74Å
525	E	53	Low	66.7	Low	82 Å²	82	73.3 Å²	73.3	38%	0.383	40%	0.403	S	S	.	.	S	Bend	trans	-111.8	144.4	-176	-62.1	-164.4	179.1	0	0	112.9	K196 T522 Q527	K196-E525 VanDerWaalsContact CE-OE1 3.28Å; K196-E525 WeakPolarHBondContact CE-OE1 3.41Å; K196-E525 IonicContact NZ-OE1 3.87Å; K196-E525 PolarHBondContact NZ-OE1 3.02Å; K196-E525 IonicContact NZ-OE2 2.76Å; K196-E525 PolarHBondContact NZ-OE2 3.47Å; T522-E525 PolarHBondContact O-N 3.07Å; E525-Q527 PolarHBondContact O-N 2.81Å
526	P	58.2	Low	65.8	Low	81 Å²	81	75.6 Å²	75.6	53%	0.526	41%	0.409	S	S	.	.			trans	-62.1	129.8	173.6	25	-31.6	0	0	0	110.2	Y528	P526-Y528 PolarHBondContact O-N 3.38Å; P526-Y528 VanDerWaalsContact O-N 3.15Å
527	Q	63.5	Low	64.4	Low	105 Å²	105	76.6 Å²	76.6	49%	0.491	42%	0.417	S	S	.	.	S	Bend	trans	-59.3	-30.5	-175.8	-157.2	174.9	33.4	0	0	112.2	R156 E525	R156-Q527 PolarHBondContact NH1-O 3.3Å; R156-Q527 PolarHBondContact NH2-O 2.94Å; E525-Q527 PolarHBondContact O-N 2.81Å
528	Y	70.1	Confident	62.9	Low	39 Å²	39	80.8 Å²	80.8	15%	0.153	44%	0.44	C	S	.	.	S	Bend	trans	-133.2	148	173.1	-71.9	-82.1	0	0	0	110	S178 T180 S186 H202 K204 P526	S178-Y528 PolarHBondContact OG-OH 2.79Å; T180-Y528 HydrophobicContact CG2-CE2 4.23Å; T180-Y528 WeakPolarHBondContact OG1-CE2 3.34Å; T180-Y528 PolarHBondContact OG1-OH 3.02Å; S186-Y528 WeakPolarHBondContact OG-CE1 3.42Å; S186-Y528 PolarHBondContact OG-OH 2.78Å; H202-Y528 HydrophobicContact CB-CD1 4.13Å; H202-Y528 HydrophobicContact CB-CE1 4.28Å; K204-Y528 HydrophobicContact CB-CD1 3.77Å; K204-Y528 HydrophobicContact CB-CE1 3.99Å; K204-Y528 HydrophobicContact CB-CG 4.16Å; P526-Y528 PolarHBondContact O-N 3.38Å; P526-Y528 VanDerWaalsContact O-N 3.15Å
529	Q	77.3	Confident	61.5	Low	61 Å²	61	82 Å²	82	29%	0.285	45%	0.45	S	S	.	.			trans	-69.5	133	172	-64.4	-60.1	-31.4	0	0	110.2	K201 H202 Y203	K201-Q529 HydrophobicContact CB-CG 4.48Å; H202-Q529 PolarHBondContact O-N 2.75Å; H202-Q529 VanDerWaalsContact O-N 3.12Å; Y203-Q529 HydrophobicContact CD1-CB 3.81Å; Y203-Q529 HydrophobicContact CD1-CG 4.42Å; Y203-Q529 HydrophobicContact CE1-CB 3.59Å; Y203-Q529 HydrophobicContact CE1-CG 3.9Å
530	P	64.8	Low	60.1	Low	65 Å²	65	82.3 Å²	82.3	42%	0.422	45%	0.452	S	S	.	.			trans	-67.5	135.5	179.2	26.7	-32.5	0	0	0	110.8	E532	P530-E532 VanDerWaalsContact C-N 3.25Å; P530-E532 PolarHBondContact O-N 3.15Å
531	G	54.7	Low	58.5	Low	24 Å²	24	85.3 Å²	85.3	25%	0.247	47%	0.473	C	S	.	.	G	3₁₀ helix	trans	-75.8	-9.7	176.6	0	0	0	0	0	114.5
532	E	48.4	Very low	57.2	Low	176 Å²	176	83.8 Å²	83.8	82%	0.822	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-87	-11.8	-169.2	-65	-172.8	161.9	0	0	114.4	P530	P530-E532 VanDerWaalsContact C-N 3.25Å; P530-E532 PolarHBondContact O-N 3.15Å
533	N	44.4	Very low	56.4	Low	144 Å²	144	88.3 Å²	88.3	77%	0.77	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-106.5	14.1	175	-70.3	-25.1	0	0	0	113.1
534	L	44.5	Very low	56.5	Low	56 Å²	56	87.9 Å²	87.9	29%	0.293	47%	0.474	S	S	.	.			trans	-102.4	0	-177.2	-55.9	179.4	0	0	0	111.9	Y203 I215 R218 G237	Y203-L534 HydrophobicContact CE1-CD1 4.48Å; I215-L534 HydrophobicContact CG2-CD1 4.41Å; R218-L534 PolarHBondContact NH1-O 2.87Å; G237-L534 WeakPolarHBondContact O-CD2 3.48Å

Retrieved 534 of 534 residues in 190.8 ms (Link to these results)

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