A0A093K3W6_STRCA Loading...

Tyrosine-protein kinase

AlphaFold DB (H0ZP43), UniProt , Accession A0A093K3W6, Species STRCA (Struthio camelus australis), Gene n/a, Length 534 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	31.6	Very low	253 Å²	253	158.9 Å²	158.9	100%	1.246	88%	0.882	S	S	*	*				0	115.2	0	-65.6	-178	-127.1	0	0	106.3
2	G	30.3	Very low	31.5	Very low	73 Å²	73	156.8 Å²	156.8	75%	0.753	88%	0.877	S	S	*	*			cis	136.1	111	14.6	0	0	0	0	0	107.8
3	C	29.1	Very low	31.4	Very low	130 Å²	130	160 Å²	160	88%	0.878	88%	0.876	S	S	*	*			trans	76.5	146.2	157.3	-111.1	0	0	0	0	117.3
4	V	33.7	Very low	31.3	Very low	134 Å²	134	160.4 Å²	160.4	81%	0.812	88%	0.875	S	S	*	*			cis	-154.2	149.5	25.2	-175.9	0	0	0	0	111.3
5	Q	33.5	Very low	31.3	Very low	172 Å²	172	158.4 Å²	158.4	80%	0.804	87%	0.87	S	S	*	*			trans	-76	157.5	171.7	-64.3	163.3	-47.8	0	0	114.6
6	C	32	Very low	31.2	Very low	129 Å²	129	159.2 Å²	159.2	87%	0.872	87%	0.873	S	S	*	*			trans	-156.3	100.2	145	-88	0	0	0	0	107.2
7	K	31.9	Very low	31.1	Very low	200 Å²	200	159.7 Å²	159.7	87%	0.87	87%	0.868	S	S	*	*				67	127.1	84.9	-95.4	-168.3	178	-176.4	0	116.3
8	D	29.6	Very low	31.1	Very low	150 Å²	150	163 Å²	163	80%	0.802	87%	0.866	S	S	*	*			trans	-61.5	157.1	-173	-52.6	-72.4	0	0	0	116
9	K	32.4	Very low	31	Very low	215 Å²	215	162.8 Å²	162.8	94%	0.935	87%	0.865	S	S	*	*			trans	-138.5	124.6	147.1	-84.9	-167.9	176.3	179.8	0	111.3
10	E	29	Very low	30.9	Very low	189 Å²	189	158.1 Å²	158.1	88%	0.883	86%	0.856	S	S	*	*			trans	-65.3	154.7	177.2	-72.4	171.3	128	0	0	113.8
11	A	31	Very low	30.7	Very low	103 Å²	103	155.7 Å²	155.7	85%	0.851	85%	0.851	S	S	*	*			trans	-71.9	136.1	173.4	0	0	0	0	0	112.2
12	T	30.4	Very low	30.4	Very low	133 Å²	133	151.1 Å²	151.1	82%	0.816	83%	0.832	S	S	*	*			trans	-106.8	115	166.3	-33.4	0	0	0	0	108.6
13	K	30.4	Very low	30.3	Very low	199 Å²	199	155.1 Å²	155.1	87%	0.865	84%	0.841	S	S	*	*			trans	-73.1	131.2	166.6	-79.7	177.3	173.6	178.2	0	108.8
14	L	30.7	Very low	30.3	Very low	166 Å²	166	157.5 Å²	157.5	87%	0.869	84%	0.839	S	S	*	*			trans	-124.1	125.5	158.5	-81	166	0	0	0	108.4
15	T	30.8	Very low	29.9	Very low	130 Å²	130	156.3 Å²	156.3	80%	0.798	84%	0.837	S	S	*	*			trans	-77.1	138.6	174.1	44.4	0	0	0	0	109.9
16	D	29.6	Very low	29.7	Very low	171 Å²	171	153.5 Å²	153.5	91%	0.914	84%	0.836	S	S	*	*			trans	-128.6	116.1	165.5	-124.3	-6.9	0	0	0	108.8
17	E	30.3	Very low	29.3	Very low	168 Å²	168	150.2 Å²	150.2	79%	0.785	83%	0.825	S	S	*	*			trans	-111.2	130.8	165.2	-77.6	-150.1	133.5	0	0	109.3
18	R	31.1	Very low	29.1	Very low	219 Å²	219	152.2 Å²	152.2	83%	0.826	83%	0.828	S	S	*	*			trans	21.8	133.2	144.8	-57.2	179.6	-167	-177.1	4.6	118.6
19	D	29	Very low	29	Very low	160 Å²	160	155 Å²	155	86%	0.856	83%	0.828	S	S	*	*				173.6	150.2	81.9	-122.1	-14.6	0	0	0	113.3
20	G	27.9	Very low	28.9	Very low	67 Å²	67	154.5 Å²	154.5	69%	0.691	82%	0.822	S	S	*	*			trans	63.3	151.8	151	0	0	0	0	0	120.1
21	S	27.4	Very low	28.7	Very low	108 Å²	108	148.4 Å²	148.4	76%	0.755	81%	0.81	S	S	*	*			cis	-176.8	149.4	-5	19	0	0	0	0	107.2
22	L	27.6	Very low	28.6	Very low	158 Å²	158	150.2 Å²	150.2	83%	0.827	81%	0.81	S	S	*	*			trans	46.6	117.4	146.8	-64.5	158.9	0	0	0	120.8
23	T	29	Very low	28.5	Very low	156 Å²	156	151.6 Å²	151.6	96%	0.957	81%	0.813	S	S	*	*			trans	-146.7	148.9	130	34.9	0	0	0	0	110.9
24	Q	28.8	Very low	28.6	Very low	180 Å²	180	147.5 Å²	147.5	84%	0.841	81%	0.806	S	S	*	*			trans	-118.5	159.4	-159.7	-138.5	179	15.3	0	0	111.1
25	S	26	Very low	28.6	Very low	110 Å²	110	145.9 Å²	145.9	77%	0.769	80%	0.803	S	S	*	*			trans	75.1	143.6	161.8	86.2	0	0	0	0	116.3
26	S	28.3	Very low	28.5	Very low	112 Å²	112	145.4 Å²	145.4	78%	0.783	80%	0.802	S	S	*	*			cis	-156.8	145.4	23.5	-47	0	0	0	0	106.4
27	G	24.1	Very low	28.4	Very low	61 Å²	61	146 Å²	146	63%	0.629	80%	0.799	S	S	*	*			cis	100.1	91.1	41.8	0	0	0	0	0	110.7
28	Y	27.9	Very low	28.1	Very low	241 Å²	241	147.1 Å²	147.1	95%	0.945	80%	0.804	S	S	*	*			trans	-153.1	118.1	152.4	-84.2	-70.9	0	0	0	111.2
29	R	28.1	Very low	28	Very low	208 Å²	208	146.7 Å²	146.7	79%	0.785	80%	0.804	S	S	*	*			trans	-88.4	162.2	159.5	-61.9	176.5	171.1	173.3	-6.4	107.2
30	Y	28.6	Very low	27.9	Very low	206 Å²	206	144 Å²	144	81%	0.808	80%	0.796	S	S	*	*			cis	-176.6	155.5	46.1	-123.2	-72.9	0	0	0	110.4
31	G	25.9	Very low	27.6	Very low	61 Å²	61	146.4 Å²	146.4	63%	0.629	80%	0.802	S	S	*	*			trans	103	137.9	146.2	0	0	0	0	0	116.6
32	T	28	Very low	27.6	Very low	140 Å²	140	150.1 Å²	150.1	86%	0.859	81%	0.805	S	S	*	*			cis	-169.4	137.9	5	26.1	0	0	0	0	107.3
33	D	28.8	Very low	27.4	Very low	163 Å²	163	145.9 Å²	145.9	87%	0.872	80%	0.799	S	S	*	*			trans	-68.7	156	165.7	-87.5	-41.1	0	0	0	112.1
34	P	32.9	Very low	27.1	Very low	112 Å²	112	145.1 Å²	145.1	73%	0.727	79%	0.794	S	S	*	*			trans	-131.5	118.6	134.3	32.7	-18.4	0	0	0	113
35	T	31.1	Very low	27	Very low	133 Å²	133	142.7 Å²	142.7	82%	0.816	79%	0.791	S	S	*	*			trans	34.8	149	141.4	36.6	0	0	0	0	123.8
36	P	28	Very low	26.9	Very low	119 Å²	119	142.8 Å²	142.8	77%	0.773	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-95.4	148.8	-154.3	37.9	-33.3	0	0	0	114.5
37	Q	27.5	Very low	26.8	Very low	183 Å²	183	145 Å²	145	86%	0.855	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-98.6	128.3	165.9	-79.3	-174.5	-15	0	0	111.3
38	H	24.8	Very low	26.8	Very low	192 Å²	192	146.6 Å²	146.6	89%	0.889	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-52.3	128.5	173.9	-92.5	-66	0	0	0	113.5
39	Y	28	Very low	26.7	Very low	211 Å²	211	141.9 Å²	141.9	83%	0.827	78%	0.784	S	S	*	*			trans	-115.8	141.1	152.4	-81.3	-86.5	0	0	0	109.1
40	P	27	Very low	26.5	Very low	104 Å²	104	141.9 Å²	141.9	68%	0.675	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-73.3	133.4	-177.1	28.3	-31.1	0	0	0	111.4	F42	P40-F42 PolarHBondContact O-N 2.76Å
41	S	22.8	Very low	26.3	Very low	116 Å²	116	139 Å²	139	81%	0.811	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-69.5	118.6	171.5	-177.8	0	0	0	0	109.9
42	F	25.6	Very low	26.2	Very low	187 Å²	187	142.5 Å²	142.5	82%	0.82	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-98.1	119.7	158.2	-78.4	-81	0	0	0	107.9	P40	P40-F42 PolarHBondContact O-N 2.76Å
43	G	24.5	Very low	26.1	Very low	68 Å²	68	145.8 Å²	145.8	70%	0.701	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-61.8	130.9	-174.4	0	0	0	0	0	112.8	T45	G43-T45 PolarHBondContact O-N 3.19Å
44	V	23.2	Very low	25.8	Very low	141 Å²	141	146.4 Å²	146.4	86%	0.855	79%	0.788	S	S	*	*			trans	-76.3	102.3	167.2	179.5	0	0	0	0	107.4
45	T	24.9	Very low	25.4	Very low	128 Å²	128	145.7 Å²	145.7	79%	0.785	79%	0.791	S	S	*	*			trans	-81.6	120.8	163	45.3	0	0	0	0	109	G43 I47	G43-T45 PolarHBondContact O-N 3.19Å; T45-I47 PolarHBondContact O-N 3.13Å
46	S	25.8	Very low	25	Very low	112 Å²	112	146 Å²	146	78%	0.783	79%	0.793	S	S	*	*			trans	-44.8	125	177.9	-35.8	0	0	0	0	113.2
47	I	25.6	Very low	25	Very low	160 Å²	160	144.2 Å²	144.2	82%	0.821	80%	0.797	S	S	*	*			trans	-80.7	125.7	171.7	-60.3	173.5	0	0	0	108.3	T45	T45-I47 PolarHBondContact O-N 3.13Å
48	P	24.7	Very low	24.9	Very low	93 Å²	93	139.6 Å²	139.6	60%	0.604	80%	0.798	S	S	*	*			trans	-67.5	134.6	176.5	-16.7	29.5	0	0	0	112.3	Y50	P48-Y50 HydrophobicContact CB-CD2 4.25Å; P48-Y50 HydrophobicContact CB-CE2 3.97Å; P48-Y50 PolarHBondContact O-N 3.08Å
49	N	24	Very low	25	Very low	143 Å²	143	139.7 Å²	139.7	77%	0.765	80%	0.799	S	S	*	*			trans	-76.1	109.1	177.1	-167.5	0	0	0	0	110.2
50	Y	25.6	Very low	24.9	Very low	207 Å²	207	133 Å²	133	81%	0.812	80%	0.795	S	S	*	*			trans	-106.7	58.5	176.7	-83.9	-82.8	0	0	0	111.7	P48	P48-Y50 HydrophobicContact CB-CD2 4.25Å; P48-Y50 HydrophobicContact CB-CE2 3.97Å; P48-Y50 PolarHBondContact O-N 3.08Å
51	N	23.3	Very low	24.7	Very low	145 Å²	145	136.6 Å²	136.6	78%	0.775	81%	0.807	S	S	*	*			trans	-94.7	83.6	161.4	-89.3	-11.2	0	0	0	109.4
52	N	24	Very low	25.1	Very low	135 Å²	135	136.8 Å²	136.8	72%	0.722	80%	0.804	S	S	*	*			trans	-169.3	102.2	154.7	-124.6	-6.2	0	0	0	111.5
53	F	25.5	Very low	25.5	Very low	210 Å²	210	133.4 Å²	133.4	92%	0.921	80%	0.798	S	S	*	*			trans	-143.7	118.6	149.5	-96.5	-76.4	0	0	0	110.8
54	H	22.9	Very low	26.2	Very low	176 Å²	176	134.7 Å²	134.7	82%	0.815	79%	0.785	S	S	*	*			trans	-58.3	143.6	165.5	-95.7	-88.2	0	0	0	111.2
55	A	24.7	Very low	26.5	Very low	96 Å²	96	131.6 Å²	131.6	79%	0.793	78%	0.781	S	S	*	*			trans	-67.3	131.3	175.9	0	0	0	0	0	112.8
56	T	23.1	Very low	26.5	Very low	140 Å²	140	129.3 Å²	129.3	86%	0.859	78%	0.783	S	S	*	*			trans	-147.7	112.6	153.4	47.1	0	0	0	0	110.5
57	G	27.2	Very low	26.7	Very low	82 Å²	82	130.2 Å²	130.2	85%	0.845	78%	0.783	S	S	*	*			trans	51.2	92.5	151.3	0	0	0	0	0	119.5
58	G	25.3	Very low	26.7	Very low	86 Å²	86	130 Å²	130	89%	0.887	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-83.8	116.9	170.1	0	0	0	0	0	113
59	Q	26.8	Very low	27	Very low	193 Å²	193	131.3 Å²	131.3	90%	0.902	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-77.1	142.1	159.1	-73.1	-178.5	-30.6	0	0	109.6
60	G	25.8	Very low	27.2	Very low	72 Å²	72	129.2 Å²	129.2	74%	0.742	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-60.7	142.1	-178	0	0	0	0	0	113.6	T62	G60-T62 PolarHBondContact O-N 3.01Å
61	L	24.2	Very low	27.3	Very low	178 Å²	178	125.1 Å²	125.1	93%	0.932	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-65.8	123.9	171.2	-83.8	96.7	0	0	0	110.3
62	T	30.7	Very low	27.9	Very low	121 Å²	121	127.2 Å²	127.2	74%	0.742	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-88.7	144.5	165.7	50.1	0	0	0	0	110.6	G60 F64	G60-T62 PolarHBondContact O-N 3.01Å; T62-F64 PolarHBondContact O-N 3.17Å
63	V	34.4	Very low	28.2	Very low	115 Å²	115	127.8 Å²	127.8	70%	0.697	81%	0.806	S	S	*	*	S	Bend	trans	-68.9	-14.7	-173.6	168.4	0	0	0	0	113.8
64	F	38.2	Very low	28.4	Very low	96 Å²	96	121.7 Å²	121.7	42%	0.421	80%	0.803	S	S	.	*	S	Bend	trans	-111.6	119.2	177.9	-72.7	-87.1	0	0	0	110.9	T62 G66 W120	T62-F64 PolarHBondContact O-N 3.17Å; F64-G66 PolarHBondContact O-N 2.98Å; F64-W120 HydrophobicContact CE2-CH2 4.04Å
65	G	29	Very low	28.8	Very low	75 Å²	75	119.4 Å²	119.4	77%	0.773	80%	0.802	S	S	*	*			trans	-57.4	134.7	168.4	0	0	0	0	0	110.2	V67	G65-V67 PolarHBondContact O-N 3.5Å
66	G	25.6	Very low	29.1	Very low	80 Å²	80	123.3 Å²	123.3	83%	0.825	81%	0.809	S	S	*	*			trans	-48	130.8	-169.4	0	0	0	0	0	114.8	F64 N68	F64-G66 PolarHBondContact O-N 2.98Å; G66-N68 PolarHBondContact O-N 3.13Å
67	V	31.3	Very low	29.3	Very low	132 Å²	132	127.8 Å²	127.8	80%	0.8	81%	0.81	S	S	*	*			trans	-79.6	112	172	-176.8	0	0	0	0	108	G65 S69	G65-V67 PolarHBondContact O-N 3.5Å; V67-S69 PolarHBondContact O-N 3.44Å
68	N	25.6	Very low	29.4	Very low	156 Å²	156	130.4 Å²	130.4	83%	0.834	81%	0.809	S	S	*	*			trans	-74	107.3	166	-105.6	0.8	0	0	0	108.5	G66 S70	G66-N68 PolarHBondContact O-N 3.13Å; N68-S70 PolarHBondContact O-N 2.73Å; N68-S70 VanDerWaalsContact O-N 3.1Å
69	S	29.1	Very low	29.7	Very low	120 Å²	120	138.8 Å²	138.8	84%	0.839	81%	0.814	S	S	*	*			trans	-78.4	83.9	174.1	39.3	0	0	0	0	110.5	V67	V67-S69 PolarHBondContact O-N 3.44Å
70	S	29.1	Very low	30	Very low	99 Å²	99	133.6 Å²	133.6	69%	0.692	81%	0.813	S	S	*	*			trans	-152.5	88.6	164.4	69.1	0	0	0	0	112.8	N68	N68-S70 PolarHBondContact O-N 2.73Å; N68-S70 VanDerWaalsContact O-N 3.1Å
71	S	28.5	Very low	30.4	Very low	120 Å²	120	133.4 Å²	133.4	84%	0.839	81%	0.811	S	S	*	*			trans	-173.2	119.4	143.1	48.7	0	0	0	0	110.8
72	H	35.1	Very low	31.2	Very low	189 Å²	189	131.3 Å²	131.3	88%	0.875	81%	0.805	S	S	*	*			trans	-63.8	127.5	170	-82.4	-69.8	0	0	0	111.4
73	T	30.7	Very low	32.3	Very low	147 Å²	147	129.1 Å²	129.1	90%	0.902	81%	0.807	S	S	*	*			trans	-173.6	125.3	131.3	34.8	0	0	0	0	111
74	G	29.5	Very low	34.2	Very low	83 Å²	83	127.4 Å²	127.4	86%	0.856	80%	0.797	S	S	*	*			trans	100.2	37.1	147.8	0	0	0	0	0	120.9
75	T	31.9	Very low	36.3	Very low	128 Å²	128	127.2 Å²	127.2	79%	0.785	80%	0.803	S	S	*	*			trans	-84.4	121.3	168.4	23.2	0	0	0	0	112	R77	T75-R77 PolarHBondContact O-N 3.24Å
76	L	30.1	Very low	39.4	Very low	178 Å²	178	126.7 Å²	126.7	93%	0.932	78%	0.782	S	S	*	*			trans	-61.4	106.4	160.7	-105	131.5	0	0	0	108.2	T78	L76-T78 PolarHBondContact O-N 2.85Å
77	R	27.6	Very low	42.7	Very low	234 Å²	234	124.3 Å²	124.3	88%	0.883	75%	0.749	S	S	*	*			trans	-78.4	103.5	179.5	-74.7	-178.8	168.5	-172.2	-3.5	110.4	T75	T75-R77 PolarHBondContact O-N 3.24Å
78	T	29.7	Very low	45.8	Very low	137 Å²	137	119 Å²	119	84%	0.84	72%	0.717	S	S	*	*			trans	-86.8	140.9	148.4	33.6	0	0	0	0	109.5	L76 G80	L76-T78 PolarHBondContact O-N 2.85Å; T78-G80 PolarHBondContact O-N 3.02Å
79	R	31.4	Very low	49.1	Very low	262 Å²	262	111.8 Å²	111.8	99%	0.989	68%	0.679	S	S	*	*	S	Bend	trans	-70.9	113.5	-164.8	-144.3	177.3	-175.1	-176.6	0.4	110.4
80	G	33.8	Very low	52.1	Low	84 Å²	84	107.8 Å²	107.8	87%	0.866	65%	0.648	S	S	*	*	S	Bend	trans	85.5	89.3	163.2	0	0	0	0	0	115.7	T78	T78-G80 PolarHBondContact O-N 3.02Å
81	G	32.5	Very low	55.2	Low	68 Å²	68	104.8 Å²	104.8	70%	0.701	62%	0.622	S	S	*	*			trans	176.7	126.8	167.3	0	0	0	0	0	109.9	G83	G81-G83 PolarHBondContact O-N 2.84Å
82	T	42.2	Very low	58.3	Low	133 Å²	133	103.6 Å²	103.6	82%	0.816	61%	0.606	S	S	*	*			trans	-48.8	121.1	163.3	41.4	0	0	0	0	108.1	V84	T82-V84 PolarHBondContact O-N 2.74Å
83	G	53.5	Low	61.1	Low	75 Å²	75	95.2 Å²	95.2	77%	0.773	57%	0.567	S	S	*	*			trans	-54.7	111.7	-175.4	0	0	0	0	0	110.5	G81 T85	G81-G83 PolarHBondContact O-N 2.84Å; G83-T85 PolarHBondContact O-N 2.8Å
84	V	73.4	Confident	64.2	Low	80 Å²	80	95 Å²	95	49%	0.485	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-74	118	174.4	-178.6	0	0	0	0	106.9	T82 L86 Q110	T82-V84 PolarHBondContact O-N 2.74Å; V84-L86 HydrophobicContact CG1-CD2 4.39Å; V84-L86 PolarHBondContact O-N 3.1Å; V84-Q110 HydrophobicContact CG1-CG 3.7Å
85	T	82.4	Confident	67.2	Low	91 Å²	91	92.1 Å²	92.1	56%	0.558	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-67.9	119.7	174.5	-58.4	0	0	0	0	108.2	G83 F87 P140	G83-T85 PolarHBondContact O-N 2.8Å; T85-F87 HydrophobicContact CG2-CD2 4.36Å; T85-F87 HydrophobicContact CG2-CE2 3.79Å; T85-F87 HydrophobicContact CG2-CZ 4.4Å; T85-P140 HydrophobicContact CG2-CB 4.12Å
86	L	93.9	Very high	70	Confident	65 Å²	65	87.7 Å²	87.7	34%	0.34	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	147	176.7	-61.9	-175.5	0	0	0	110.3	V84 L125 P140 V141	V84-L86 HydrophobicContact CG1-CD2 4.39Å; V84-L86 PolarHBondContact O-N 3.1Å; L86-L125 HydrophobicContact CD1-CD1 4.05Å; L86-L125 HydrophobicContact CD2-CD1 3.83Å; L86-P140 WeakPolarHBondContact O-CA 3.2Å; L86-V141 HydrophobicContact CB-CG2 3.82Å; L86-V141 WeakPolarHBondContact O-CG2 3.49Å; L86-V141 PolarHBondContact O-N 3.2Å
87	F	95.6	Very high	72.9	Confident	29 Å²	29	81 Å²	81	13%	0.127	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	154.7	177.3	-75.4	-107.9	0	0	0	110.5	T85 K108 F109 I111 W120 V138 A139 P140	T85-F87 HydrophobicContact CG2-CD2 4.36Å; T85-F87 HydrophobicContact CG2-CE2 3.79Å; T85-F87 HydrophobicContact CG2-CZ 4.4Å; F87-K108 CarbonylContact O-C 3.47Å; F87-K108 WeakPolarHBondContact O-CA 3.48Å; F87-F109 HydrophobicContact CB-CB 4.49Å; F87-F109 PolarHBondContact N-O 3.07Å; F87-F109 PolarHBondContact O-N 3.46Å; F87-I111 HydrophobicContact CB-CD1 4.42Å; F87-I111 HydrophobicContact CB-CG1 4.41Å; F87-I111 HydrophobicContact CD1-CG1 4.44Å; F87-I111 HydrophobicContact CD2-CB 4.48Å; F87-I111 HydrophobicContact CD2-CD1 4.25Å; F87-I111 HydrophobicContact CD2-CG1 3.37Å; F87-I111 HydrophobicContact CE2-CB 4.46Å; F87-I111 HydrophobicContact CE2-CG1 3.62Å; F87-I111 HydrophobicContact CG-CD1 4.24Å; F87-I111 HydrophobicContact CG-CG1 3.83Å; F87-I111 HydrophobicContact CZ-CG1 4.26Å; F87-W120 HydrophobicContact CD1-CZ3 4.27Å; F87-W120 HydrophobicContact CE1-CH2 4.41Å; F87-W120 AromaticContact CE1-CZ3 3.75Å; F87-W120 HydrophobicContact CE1-CZ3 3.75Å; F87-W120 HydrophobicContact CZ-CZ3 4.26Å; F87-V138 HydrophobicContact CB-CB 4.26Å; F87-V138 HydrophobicContact CD1-CB 4.24Å; F87-V138 HydrophobicContact CD1-CG2 4.01Å; F87-A139 CarbonylContact C-O 3.57Å; F87-A139 WeakPolarHBondContact CA-O 3.43Å; F87-A139 VanDerWaalsContact CD1-C 3.42Å; F87-P140 HydrophobicContact CD1-CG 4.26Å; F87-P140 HydrophobicContact CE1-CB 4.45Å; F87-P140 HydrophobicContact CE1-CG 3.69Å; F87-P140 HydrophobicContact CZ-CG 3.95Å
88	V	95.8	Very high	75.9	Confident	22 Å²	22	79.4 Å²	79.4	13%	0.133	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	140.3	176.2	62.7	0	0	0	0	110.4	E107 V138 A139 V141 A146	V88-E107 CarbonylContact C-O 3.56Å; V88-E107 VanDerWaalsContact CA-O 3.28Å; V88-E107 WeakPolarHBondContact CA-O 3.33Å; V88-V138 VanDerWaalsContact O-CA 3.26Å; V88-V138 WeakPolarHBondContact O-CA 3.34Å; V88-A139 PolarHBondContact N-O 3.42Å; V88-A139 PolarHBondContact O-N 3.3Å; V88-V141 HydrophobicContact CB-CG2 4.11Å; V88-A146 HydrophobicContact CG1-CB 3.67Å
89	A	95.6	Very high	78.9	Confident	3 Å²	3	78.2 Å²	78.2	3%	0.025	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	126.4	172.3	0	0	0	0	0	111.3	F103 H104 G106 E107 F109	A89-F103 HydrophobicContact CB-CD2 3.53Å; A89-F103 HydrophobicContact CB-CE2 3.75Å; A89-H104 WeakPolarHBondContact CB-O 3.07Å; A89-G106 PolarHBondContact O-N 3.47Å; A89-E107 HydrophobicContact CB-CB 4.44Å; A89-E107 PolarHBondContact N-O 3.16Å; A89-F109 HydrophobicContact CB-CE2 3.83Å; A89-F109 HydrophobicContact CB-CZ 4.45Å
90	L	92.4	Very high	81.8	Confident	37 Å²	37	66.4 Å²	66.4	19%	0.194	41%	0.407	C	S	.	.	S	Bend	trans	-85.5	-24.7	175.7	-56.7	179.7	0	0	0	112.2	K105 Y137 A139 Q145	L90-K105 WeakPolarHBondContact O-CD 3.33Å; L90-K105 WeakPolarHBondContact O-CE 3.45Å; L90-K105 WeakPolarHBondContact O-CG 3.25Å; L90-Y137 WeakPolarHBondContact CB-O 3.48Å; L90-Y137 PolarHBondContact N-O 2.82Å; L90-A139 HydrophobicContact CD1-CB 4.15Å; L90-A139 HydrophobicContact CD2-CB 3.93Å; L90-A139 HydrophobicContact CG-CB 4.28Å; L90-Q145 WeakPolarHBondContact CD2-O 3.33Å
91	Y	93.2	Very high	84.7	Confident	35 Å²	35	62.6 Å²	62.6	14%	0.137	37%	0.367	C	S	.	.	S	Bend	trans	-141.6	163.9	-177.2	-43	-83	0	0	0	110.4	F103 Y137 N248 T250 P251	Y91-F103 WeakPolarHBondContact O-CE2 3.45Å; Y91-Y137 HydrophobicContact CD2-CD1 4.02Å; Y91-Y137 HydrophobicContact CD2-CG 4.02Å; Y91-Y137 HydrophobicContact CG-CD1 4.39Å; Y91-N248 HydrophobicContact CE1-CB 4.4Å; Y91-N248 PolarHBondContact OH-ND2 3.27Å; Y91-T250 HydrophobicContact CD1-CG2 4.44Å; Y91-T250 HydrophobicContact CG-CG2 4.21Å; Y91-P251 HydrophobicContact CD2-CG 4.03Å; Y91-P251 HydrophobicContact CE2-CG 3.58Å
92	D	94.1	Very high	87.8	Confident	96 Å²	96	62.3 Å²	62.3	51%	0.513	35%	0.354	S	S	.	.			trans	-71.9	144.3	166.5	-59.1	-43.4	0	0	0	110.4	H104 K105 Y137	D92-H104 VanDerWaalsContact OD1-CA 3.26Å; D92-H104 WeakPolarHBondContact OD1-CA 3.16Å; D92-H104 IonicContact OD1-ND1 3.69Å; D92-K105 PolarHBondContact OD1-N 3.32Å; D92-Y137 WeakPolarHBondContact O-CE1 3.39Å
93	Y	94.8	Very high	90.3	Very high	12 Å²	12	56.2 Å²	56.2	5%	0.047	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-138.5	131.1	173.9	179.1	-102	0	0	0	110.5	D100 L101 S102 F103 W119 P134 Y137 T253	Y93-D100 HydrophobicContact CE1-CB 4.21Å; Y93-D100 PolarHBondContact OH-OD2 3.47Å; Y93-L101 VanDerWaalsContact CD1-O 3.28Å; Y93-L101 WeakPolarHBondContact CD1-O 3.45Å; Y93-S102 WeakPolarHBondContact O-CA 3.44Å; Y93-F103 VanDerWaalsContact CB-CE1 3.49Å; Y93-F103 HydrophobicContact CD1-CD1 4.07Å; Y93-F103 AromaticContact CD1-CE1 3.57Å; Y93-F103 HydrophobicContact CD1-CE1 3.57Å; Y93-F103 HydrophobicContact CD1-CZ 4.15Å; Y93-F103 HydrophobicContact CG-CD1 4.45Å; 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 2.85Å; Y93-F103 PolarHBondContact O-N 3.12Å; Y93-W119 HydrophobicContact CE1-CZ3 4.45Å; Y93-W119 HydrophobicContact CE2-CH2 4.14Å; Y93-W119 HydrophobicContact CE2-CZ3 4.42Å; Y93-W119 AromaticContact CZ-CH2 3.87Å; Y93-W119 AromaticContact CZ-CZ3 3.84Å; Y93-W119 WeakPolarHBondContact OH-CH2 3.2Å; Y93-W119 WeakPolarHBondContact OH-CZ3 3.28Å; Y93-P134 HydrophobicContact CD2-CG 3.77Å; Y93-P134 HydrophobicContact CE2-CG 3.93Å; Y93-P134 HydrophobicContact CG-CG 4.16Å; Y93-Y137 HydrophobicContact CD2-CD1 4.41Å; Y93-Y137 HydrophobicContact CD2-CE1 4.03Å; Y93-T253 HydrophobicContact CE2-CG2 4.09Å
94	E	94.1	Very high	92.4	Very high	142 Å²	142	59.2 Å²	59.2	66%	0.664	31%	0.31	S	S	*	.			trans	-104.5	127.2	174	-171	177.6	-177.7	0	0	108.6
95	A	92.9	Very high	93.3	Very high	23 Å²	23	60.2 Å²	60.2	19%	0.19	31%	0.308	C	S	.	.			trans	-56.4	137.7	178.8	0	0	0	0	0	111.3	D100 S102 N290	A95-D100 HydrophobicContact CB-CB 3.67Å; A95-S102 WeakPolarHBondContact CB-OG 3.35Å; A95-S102 PolarHBondContact N-OG 3.14Å; A95-N290 PolarHBondContact O-ND2 3.02Å; A95-N290 VanDerWaalsContact O-ND2 3.09Å
96	R	92.1	Very high	93.9	Very high	35 Å²	35	58 Å²	58	13%	0.132	30%	0.303	C	S	.	.	S	Bend	trans	-111.3	-13	-179.4	-54.7	171	179.8	171.3	1	112.8	D100 T253 L256 W287 N288 T291	R96-D100 PolarHBondContact N-OD2 2.8Å; R96-T253 PolarHBondContact NH1-OG1 2.87Å; R96-T253 PolarHBondContact NH2-OG1 3.12Å; R96-L256 WeakPolarHBondContact CD-O 3.37Å; R96-L256 PolarHBondContact NH1-O 3.46Å; R96-W287 HydrophobicContact CB-CE3 4.39Å; R96-W287 HydrophobicContact CB-CH2 4.33Å; R96-W287 HydrophobicContact CB-CZ3 3.58Å; R96-W287 HydrophobicContact CG-CZ3 4.45Å; R96-N288 PolarHBondContact O-ND2 3.38Å; R96-N288 VanDerWaalsContact O-ND2 3.12Å; R96-T291 VanDerWaalsContact CD-OG1 3.27Å; R96-T291 WeakPolarHBondContact CD-OG1 3.31Å; R96-T291 WeakPolarHBondContact CG-OG1 3.36Å
97	T	90.6	Very high	94	Very high	37 Å²	37	55.9 Å²	55.9	23%	0.227	29%	0.291	C	S	.	.	S	Bend	trans	-133.4	167.8	174	79.4	0	0	0	0	109.2	D99 D100 A257 W287	T97-D99 PolarHBondContact O-N 3.46Å; T97-D99 PolarHBondContact OG1-N 3.24Å; T97-D100 PolarHBondContact N-OD2 2.91Å; T97-D100 PolarHBondContact O-N 3.38Å; T97-D100 VanDerWaalsContact OG1-CG 3.23Å; T97-D100 PolarHBondContact OG1-N 3.2Å; T97-D100 PolarHBondContact OG1-OD1 3.23Å; T97-A257 HydrophobicContact CG2-CB 3.57Å; T97-W287 HydrophobicContact CG2-CH2 3.63Å; T97-W287 HydrophobicContact CG2-CZ2 4.32Å; T97-W287 HydrophobicContact CG2-CZ3 4.48Å
98	E	90.6	Very high	94.1	Very high	201 Å²	201	59.1 Å²	59.1	94%	0.939	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-20.7	174.3	-62	-177.7	176.7	0	0	112.6
99	D	91.9	Very high	94.1	Very high	112 Å²	112	58 Å²	58	60%	0.599	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-12	179.8	-61.5	-43.8	0	0	0	112.6	T97 G131 Y132	T97-D99 PolarHBondContact O-N 3.46Å; T97-D99 PolarHBondContact OG1-N 3.24Å; D99-G131 CarbonylContact O-C 3.51Å; D99-G131 VanDerWaalsContact O-CA 3.28Å; D99-G131 WeakPolarHBondContact O-CA 3.17Å; D99-Y132 HydrophobicContact CB-CD2 3.98Å; D99-Y132 HydrophobicContact CB-CE2 4.33Å; D99-Y132 PolarHBondContact O-N 2.74Å
100	D	92.9	Very high	94.1	Very high	14 Å²	14	60.7 Å²	60.7	8%	0.075	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-81.4	148.3	178.3	-68.7	6.2	0	0	0	111.1	Y93 A95 R96 T97 Y132	Y93-D100 HydrophobicContact CE1-CB 4.21Å; Y93-D100 PolarHBondContact OH-OD2 3.47Å; A95-D100 HydrophobicContact CB-CB 3.67Å; R96-D100 PolarHBondContact N-OD2 2.8Å; T97-D100 PolarHBondContact N-OD2 2.91Å; T97-D100 PolarHBondContact O-N 3.38Å; T97-D100 VanDerWaalsContact OG1-CG 3.23Å; T97-D100 PolarHBondContact OG1-N 3.2Å; T97-D100 PolarHBondContact OG1-OD1 3.23Å; D100-Y132 WeakPolarHBondContact CA-O 3.39Å
101	L	94.9	Very high	94.2	Very high	5 Å²	5	60.3 Å²	60.3	3%	0.026	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-102.1	121.6	174	-177.1	64.2	0	0	0	110.4	Y93 F103 F109 E129 Y132 I133	Y93-L101 VanDerWaalsContact CD1-O 3.28Å; Y93-L101 WeakPolarHBondContact CD1-O 3.45Å; L101-F103 VanDerWaalsContact O-CD1 3.25Å; L101-F103 WeakPolarHBondContact O-CD1 2.93Å; L101-F109 HydrophobicContact CD2-CD1 4.15Å; L101-F109 HydrophobicContact CD2-CE1 3.88Å; L101-E129 HydrophobicContact CD1-CB 3.8Å; L101-Y132 PolarHBondContact N-O 3.18Å; L101-I133 HydrophobicContact CB-CG2 3.89Å; L101-I133 HydrophobicContact CD2-CG2 4.22Å; L101-I133 HydrophobicContact CG-CG2 4.47Å
102	S	96.1	Very high	94.1	Very high	62 Å²	62	62.5 Å²	62.5	43%	0.434	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-75.1	145.3	170.7	-62.8	0	0	0	0	110.7	Y93 A95	Y93-S102 WeakPolarHBondContact O-CA 3.44Å; A95-S102 WeakPolarHBondContact CB-OG 3.35Å; A95-S102 PolarHBondContact N-OG 3.14Å
103	F	96.3	Very high	93.9	Very high	5 Å²	5	61.1 Å²	61.1	2%	0.022	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-157.3	161	177.8	54.5	-95.8	0	0	0	114	A89 Y91 Y93 L101 E107 F109 I133 P134 Y137	A89-F103 HydrophobicContact CB-CD2 3.53Å; A89-F103 HydrophobicContact CB-CE2 3.75Å; Y91-F103 WeakPolarHBondContact O-CE2 3.45Å; Y93-F103 VanDerWaalsContact CB-CE1 3.49Å; Y93-F103 HydrophobicContact CD1-CD1 4.07Å; Y93-F103 AromaticContact CD1-CE1 3.57Å; Y93-F103 HydrophobicContact CD1-CE1 3.57Å; Y93-F103 HydrophobicContact CD1-CZ 4.15Å; Y93-F103 HydrophobicContact CG-CD1 4.45Å; 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 2.85Å; Y93-F103 PolarHBondContact O-N 3.12Å; L101-F103 VanDerWaalsContact O-CD1 3.25Å; L101-F103 WeakPolarHBondContact O-CD1 2.93Å; F103-E107 WeakPolarHBondContact CA-OE2 3.24Å; F103-E107 HydrophobicContact CB-CB 4.47Å; F103-E107 VanDerWaalsContact CB-OE2 3.3Å; F103-E107 WeakPolarHBondContact CB-OE2 3.44Å; F103-F109 HydrophobicContact CB-CE1 4.1Å; F103-F109 HydrophobicContact CB-CZ 3.49Å; F103-F109 VanDerWaalsContact CB-CZ 3.49Å; F103-F109 HydrophobicContact CD1-CE1 4.28Å; F103-F109 AromaticContact CD1-CZ 3.92Å; F103-F109 HydrophobicContact CD1-CZ 3.92Å; F103-F109 HydrophobicContact CD2-CE2 4.48Å; F103-F109 HydrophobicContact CD2-CZ 4.06Å; F103-F109 HydrophobicContact CG-CE1 4.3Å; F103-F109 HydrophobicContact CG-CE2 4.4Å; F103-F109 AromaticContact CG-CZ 3.57Å; F103-F109 HydrophobicContact CG-CZ 3.57Å; F103-I133 HydrophobicContact CD1-CG2 3.85Å; F103-I133 HydrophobicContact CE1-CB 3.77Å; F103-I133 HydrophobicContact CE1-CG2 3.51Å; F103-I133 HydrophobicContact CZ-CB 4.44Å; F103-P134 HydrophobicContact CZ-CG 4.39Å; F103-Y137 HydrophobicContact CE2-CD1 4.23Å; F103-Y137 HydrophobicContact CZ-CD1 4.17Å; F103-Y137 HydrophobicContact CZ-CG 4.43Å
104	H	96.1	Very high	93.5	Very high	137 Å²	137	64 Å²	64	63%	0.634	34%	0.337	S	S	*	.			trans	-104.4	152.9	174.9	-65.2	-61.5	0	0	0	112.3	A89 D92 G106 E107	A89-H104 WeakPolarHBondContact CB-O 3.07Å; D92-H104 VanDerWaalsContact OD1-CA 3.26Å; D92-H104 WeakPolarHBondContact OD1-CA 3.16Å; D92-H104 IonicContact OD1-ND1 3.69Å; H104-G106 PolarHBondContact O-N 3.25Å; H104-E107 PolarHBondContact N-OE2 3.48Å; H104-E107 VanDerWaalsContact N-OE2 3.16Å; H104-E107 WeakPolarHBondContact O-CB 3.31Å; H104-E107 PolarHBondContact O-N 3.26Å
105	K	94.1	Very high	92.8	Very high	102 Å²	102	61.5 Å²	61.5	44%	0.443	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	132.7	173.2	-179	177.4	176.2	-165.5	0	110.5	L90 D92 E107 E148	L90-K105 WeakPolarHBondContact O-CD 3.33Å; L90-K105 WeakPolarHBondContact O-CE 3.45Å; L90-K105 WeakPolarHBondContact O-CG 3.25Å; D92-K105 PolarHBondContact OD1-N 3.32Å; K105-E107 VanDerWaalsContact C-N 3.34Å; K105-E148 WeakPolarHBondContact CE-OE1 3.45Å; K105-E148 VanDerWaalsContact NZ-CD 3.33Å; K105-E148 IonicContact NZ-OE1 2.78Å; K105-E148 PolarHBondContact NZ-OE1 3.19Å; K105-E148 IonicContact NZ-OE2 2.7Å
106	G	93.7	Very high	91.4	Very high	45 Å²	45	68.3 Å²	68.3	46%	0.464	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	-8.7	-177.8	0	0	0	0	0	114.9	A89 H104	A89-G106 PolarHBondContact O-N 3.47Å; H104-G106 PolarHBondContact O-N 3.25Å
107	E	96.4	Very high	90.6	Very high	19 Å²	19	69.3 Å²	69.3	9%	0.089	38%	0.384	C	S	.	.			trans	-64.6	147.9	174.1	-171.3	165.3	175.4	0	0	111.8	V88 A89 F103 H104 K105 F109 S124	V88-E107 CarbonylContact C-O 3.56Å; V88-E107 VanDerWaalsContact CA-O 3.28Å; V88-E107 WeakPolarHBondContact CA-O 3.33Å; A89-E107 HydrophobicContact CB-CB 4.44Å; A89-E107 PolarHBondContact N-O 3.16Å; F103-E107 WeakPolarHBondContact CA-OE2 3.24Å; F103-E107 HydrophobicContact CB-CB 4.47Å; F103-E107 VanDerWaalsContact CB-OE2 3.3Å; F103-E107 WeakPolarHBondContact CB-OE2 3.44Å; H104-E107 PolarHBondContact N-OE2 3.48Å; H104-E107 VanDerWaalsContact N-OE2 3.16Å; H104-E107 WeakPolarHBondContact O-CB 3.31Å; H104-E107 PolarHBondContact O-N 3.26Å; K105-E107 VanDerWaalsContact C-N 3.34Å; E107-F109 HydrophobicContact CB-CE2 4.18Å; E107-F109 HydrophobicContact CB-CZ 4.01Å; E107-F109 HydrophobicContact CG-CE1 4.33Å; E107-F109 HydrophobicContact CG-CE2 4.29Å; E107-F109 HydrophobicContact CG-CZ 3.82Å; E107-F109 WeakPolarHBondContact O-CE2 3.28Å; E107-S124 WeakPolarHBondContact OE1-CB 3.39Å; E107-S124 PolarHBondContact OE1-OG 3.48Å
108	K	96.8	Very high	90.5	Very high	97 Å²	97	69.9 Å²	69.9	42%	0.422	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	143.7	-174.7	-65	-177.3	-178.5	-178.9	0	112.5	F87 L125 V141	F87-K108 CarbonylContact O-C 3.47Å; F87-K108 WeakPolarHBondContact O-CA 3.48Å; K108-L125 HydrophobicContact CB-CD1 4.1Å; K108-L125 WeakPolarHBondContact O-CB 3.41Å; K108-L125 PolarHBondContact O-N 3.03Å; K108-V141 HydrophobicContact CD-CG2 4.39Å; K108-V141 HydrophobicContact CG-CG2 4.49Å
109	F	95.9	Very high	90.6	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	149.4	-175.2	-53.6	-86.5	0	0	0	112.6	F87 A89 L101 F103 E107 A122 R123 I133 V138	F87-F109 HydrophobicContact CB-CB 4.49Å; F87-F109 PolarHBondContact N-O 3.07Å; F87-F109 PolarHBondContact O-N 3.46Å; A89-F109 HydrophobicContact CB-CE2 3.83Å; A89-F109 HydrophobicContact CB-CZ 4.45Å; L101-F109 HydrophobicContact CD2-CD1 4.15Å; L101-F109 HydrophobicContact CD2-CE1 3.88Å; F103-F109 HydrophobicContact CB-CE1 4.1Å; F103-F109 HydrophobicContact CB-CZ 3.49Å; F103-F109 VanDerWaalsContact CB-CZ 3.49Å; F103-F109 HydrophobicContact CD1-CE1 4.28Å; F103-F109 AromaticContact CD1-CZ 3.92Å; F103-F109 HydrophobicContact CD1-CZ 3.92Å; F103-F109 HydrophobicContact CD2-CE2 4.48Å; F103-F109 HydrophobicContact CD2-CZ 4.06Å; F103-F109 HydrophobicContact CG-CE1 4.3Å; F103-F109 HydrophobicContact CG-CE2 4.4Å; F103-F109 AromaticContact CG-CZ 3.57Å; F103-F109 HydrophobicContact CG-CZ 3.57Å; E107-F109 HydrophobicContact CB-CE2 4.18Å; E107-F109 HydrophobicContact CB-CZ 4.01Å; E107-F109 HydrophobicContact CG-CE1 4.33Å; E107-F109 HydrophobicContact CG-CE2 4.29Å; E107-F109 HydrophobicContact CG-CZ 3.82Å; E107-F109 WeakPolarHBondContact O-CE2 3.28Å; F109-A122 HydrophobicContact CB-CB 4.23Å; F109-A122 HydrophobicContact CD1-CB 4.23Å; F109-A122 HydrophobicContact CG-CB 4.47Å; F109-R123 WeakPolarHBondContact CA-O 3.44Å; F109-I133 HydrophobicContact CG-CD1 4.35Å; F109-V138 HydrophobicContact CD2-CG1 4.08Å; F109-V138 HydrophobicContact CE2-CG1 4.21Å
110	Q	95.8	Very high	90.7	Very high	59 Å²	59	57.1 Å²	57.1	28%	0.276	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.1	155.7	175.2	174.3	19.4	0	0	108.5	V84 L112 A122 R123 L125	V84-Q110 HydrophobicContact CG1-CG 3.7Å; Q110-L112 HydrophobicContact CG-CD2 4.17Å; Q110-L112 PolarHBondContact O-N 3.44Å; Q110-A122 WeakPolarHBondContact O-CA 3.38Å; Q110-R123 PolarHBondContact N-O 3.06Å; Q110-R123 PolarHBondContact O-N 2.92Å; Q110-L125 HydrophobicContact CB-CD2 4.29Å
111	I	94.3	Very high	90.8	Very high	28 Å²	28	59.5 Å²	59.5	14%	0.144	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	119.4	173.4	-54.8	-57.5	0	0	0	108.7	F87 W120 A122 I133	F87-I111 HydrophobicContact CB-CD1 4.42Å; F87-I111 HydrophobicContact CB-CG1 4.41Å; F87-I111 HydrophobicContact CD1-CG1 4.44Å; F87-I111 HydrophobicContact CD2-CB 4.48Å; F87-I111 HydrophobicContact CD2-CD1 4.25Å; F87-I111 HydrophobicContact CD2-CG1 3.37Å; F87-I111 HydrophobicContact CE2-CB 4.46Å; F87-I111 HydrophobicContact CE2-CG1 3.62Å; F87-I111 HydrophobicContact CG-CD1 4.24Å; F87-I111 HydrophobicContact CG-CG1 3.83Å; F87-I111 HydrophobicContact CZ-CG1 4.26Å; I111-W120 HydrophobicContact CD1-CE3 4.06Å; I111-W120 HydrophobicContact CG1-CE3 4.34Å; I111-W120 HydrophobicContact CG2-CB 4.35Å; I111-A122 HydrophobicContact CD1-CB 3.85Å; I111-I133 HydrophobicContact CD1-CD1 3.97Å
112	L	92.1	Very high	90.8	Very high	82 Å²	82	59.3 Å²	59.3	43%	0.429	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-42.1	178.7	-57.6	-177.2	0	0	0	110.6	Q110 E121 R123 T130	Q110-L112 HydrophobicContact CG-CD2 4.17Å; Q110-L112 PolarHBondContact O-N 3.44Å; L112-E121 HydrophobicContact CB-CB 4.5Å; L112-E121 HydrophobicContact CB-CG 4.33Å; L112-E121 HydrophobicContact CD1-CG 4.38Å; L112-E121 PolarHBondContact N-O 3.46Å; L112-R123 HydrophobicContact CD1-CB 4.23Å; L112-R123 HydrophobicContact CD2-CB 4.33Å; L112-R123 HydrophobicContact CG-CB 4.29Å; L112-T130 HydrophobicContact CD1-CG2 3.46Å; L112-T130 VanDerWaalsContact CD1-CG2 3.46Å
113	N	89.1	Confident	90.9	Very high	66 Å²	66	61.9 Å²	61.9	35%	0.353	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	124.9	178.6	-166.5	-7.7	0	0	0	111.6	S115 W120 E121	N113-S115 VanDerWaalsContact OD1-CB 3.26Å; N113-S115 WeakPolarHBondContact OD1-CB 3.43Å; N113-S115 PolarHBondContact OD1-N 3.37Å; N113-S115 PolarHBondContact OD1-OG 2.83Å; N113-W120 WeakPolarHBondContact O-CA 3.45Å; N113-E121 HydrophobicContact CB-CB 3.88Å; N113-E121 PolarHBondContact N-O 2.67Å; N113-E121 VanDerWaalsContact N-O 3.15Å; N113-E121 PolarHBondContact O-N 3.12Å
114	S	86.7	Confident	90.9	Very high	73 Å²	73	61.7 Å²	61.7	51%	0.51	33%	0.33	S	S	.	.			trans	-126.3	13.9	174.6	53.9	0	0	0	0	112.3	E116	S114-E116 VanDerWaalsContact C-N 3.26Å; S114-E116 PolarHBondContact O-N 3.5Å
115	S	79.3	Confident	90.9	Very high	90 Å²	90	59.2 Å²	59.2	63%	0.629	32%	0.321	S	S	*	.	S	Bend	trans	-63.3	-30.8	-167.7	63.4	0	0	0	0	113.1	N113	N113-S115 VanDerWaalsContact OD1-CB 3.26Å; N113-S115 WeakPolarHBondContact OD1-CB 3.43Å; N113-S115 PolarHBondContact OD1-N 3.37Å; N113-S115 PolarHBondContact OD1-OG 2.83Å
116	E	64.8	Low	90.9	Very high	166 Å²	166	59.4 Å²	59.4	78%	0.776	33%	0.33	S	S	*	.	S	Bend	trans	-145.7	129.3	-178	-63.8	-172.4	176.6	0	0	112.6	S114	S114-E116 VanDerWaalsContact C-N 3.26Å; S114-E116 PolarHBondContact O-N 3.5Å
117	G	74.3	Confident	90.9	Very high	56 Å²	56	60.9 Å²	60.9	58%	0.577	33%	0.331	S	S	*	.	S	Bend	trans	94.1	-169.9	157.8	0	0	0	0	0	116.7	W119 W120	G117-W119 VanDerWaalsContact C-N 3.34Å; G117-W120 PolarHBondContact O-NE1 3.43Å
118	D	88.9	Confident	90.8	Very high	49 Å²	49	61.5 Å²	61.5	26%	0.262	34%	0.342	S	S	.	.	S	Bend	trans	-88	-3.9	-175.1	-59.4	-64.8	0	0	0	112.8	S135 V254 K319	D118-S135 WeakPolarHBondContact O-CB 3.33Å; D118-S135 PolarHBondContact O-N 3.01Å; D118-S135 PolarHBondContact O-OG 2.93Å; D118-V254 HydrophobicContact CB-CB 3.53Å; D118-V254 HydrophobicContact CB-CG1 4.08Å; D118-V254 HydrophobicContact CB-CG2 3.99Å; D118-V254 VanDerWaalsContact CG-CB 3.47Å; D118-V254 WeakPolarHBondContact OD2-CG1 3.1Å; D118-K319 IonicContact OD2-NZ 3.88Å; D118-K319 PolarHBondContact OD2-NZ 3.2Å
119	W	92.4	Very high	90.8	Very high	17 Å²	17	62.6 Å²	62.6	6%	0.064	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.3	-179.5	-67.8	83.3	0	0	0	110.4	Y93 G117 I133 P134 T253 V254 K258	Y93-W119 HydrophobicContact CE1-CZ3 4.45Å; Y93-W119 HydrophobicContact CE2-CH2 4.14Å; Y93-W119 HydrophobicContact CE2-CZ3 4.42Å; Y93-W119 AromaticContact CZ-CH2 3.87Å; Y93-W119 AromaticContact CZ-CZ3 3.84Å; Y93-W119 WeakPolarHBondContact OH-CH2 3.2Å; Y93-W119 WeakPolarHBondContact OH-CZ3 3.28Å; G117-W119 VanDerWaalsContact C-N 3.34Å; W119-I133 CarbonylContact C-O 3.51Å; W119-I133 WeakPolarHBondContact CA-O 3.31Å; W119-P134 HydrophobicContact CE3-CB 4.39Å; W119-P134 HydrophobicContact CH2-CB 4.27Å; W119-P134 HydrophobicContact CH2-CG 4.5Å; W119-P134 HydrophobicContact CZ3-CB 4.19Å; W119-P134 HydrophobicContact CZ3-CG 4.3Å; W119-T253 HydrophobicContact CH2-CG2 4.11Å; W119-T253 HydrophobicContact CZ2-CG2 4.15Å; W119-V254 PolarHBondContact NE1-O 2.63Å; W119-K258 HydrophobicContact CB-CB 4.03Å; W119-K258 HydrophobicContact CG-CB 4.19Å
120	W	94.7	Very high	90.8	Very high	28 Å²	28	65.9 Å²	65.9	11%	0.106	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	144.1	-176.4	-63.7	-14.7	0	0	0	111.1	F64 F87 I111 N113 G117 Y132 I133 V138	F64-W120 HydrophobicContact CE2-CH2 4.04Å; F87-W120 HydrophobicContact CD1-CZ3 4.27Å; F87-W120 HydrophobicContact CE1-CH2 4.41Å; F87-W120 AromaticContact CE1-CZ3 3.75Å; F87-W120 HydrophobicContact CE1-CZ3 3.75Å; F87-W120 HydrophobicContact CZ-CZ3 4.26Å; I111-W120 HydrophobicContact CD1-CE3 4.06Å; I111-W120 HydrophobicContact CG1-CE3 4.34Å; I111-W120 HydrophobicContact CG2-CB 4.35Å; N113-W120 WeakPolarHBondContact O-CA 3.45Å; G117-W120 PolarHBondContact O-NE1 3.43Å; W120-Y132 CarbonylContact O-C 3.6Å; W120-Y132 WeakPolarHBondContact O-CA 3.41Å; W120-I133 HydrophobicContact CB-CG1 4.41Å; W120-I133 PolarHBondContact N-O 3.32Å; W120-I133 WeakPolarHBondContact O-CG1 3.41Å; W120-I133 PolarHBondContact O-N 3.27Å; W120-V138 HydrophobicContact CE3-CG2 4.14Å; W120-V138 HydrophobicContact CZ3-CG2 4.04Å
121	E	94.8	Very high	90.8	Very high	64 Å²	64	63.4 Å²	63.4	30%	0.299	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	123.2	172	-168.6	-178.7	-173.9	0	0	108.6	L112 N113 T130 Y132	L112-E121 HydrophobicContact CB-CB 4.5Å; L112-E121 HydrophobicContact CB-CG 4.33Å; L112-E121 HydrophobicContact CD1-CG 4.38Å; L112-E121 PolarHBondContact N-O 3.46Å; N113-E121 HydrophobicContact CB-CB 3.88Å; N113-E121 PolarHBondContact N-O 2.67Å; N113-E121 VanDerWaalsContact N-O 3.15Å; N113-E121 PolarHBondContact O-N 3.12Å; E121-T130 HydrophobicContact CG-CG2 4.13Å; E121-Y132 HydrophobicContact CB-CD1 4.24Å; E121-Y132 HydrophobicContact CB-CE1 3.95Å; E121-Y132 HydrophobicContact CG-CE1 4.49Å
122	A	95.4	Very high	90.9	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	150.9	-174	0	0	0	0	0	111.4	F109 Q110 I111 T130 G131 I133	F109-A122 HydrophobicContact CB-CB 4.23Å; F109-A122 HydrophobicContact CD1-CB 4.23Å; F109-A122 HydrophobicContact CG-CB 4.47Å; Q110-A122 WeakPolarHBondContact O-CA 3.38Å; I111-A122 HydrophobicContact CD1-CB 3.85Å; A122-T130 VanDerWaalsContact O-CA 3.3Å; A122-T130 WeakPolarHBondContact O-CA 3.41Å; A122-G131 PolarHBondContact N-O 3.42Å; A122-G131 PolarHBondContact O-N 3.33Å; A122-I133 HydrophobicContact CB-CD1 3.44Å; A122-I133 VanDerWaalsContact CB-CD1 3.44Å; A122-I133 HydrophobicContact CB-CG1 3.69Å; A122-I133 HydrophobicContact CB-CG2 4.21Å
123	R	96.6	Very high	91	Very high	116 Å²	116	60.6 Å²	60.6	44%	0.438	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.9	170.8	-174.1	177.9	-175.7	-167.2	-0.5	109.7	F109 Q110 L112 L125 G128 E129	F109-R123 WeakPolarHBondContact CA-O 3.44Å; Q110-R123 PolarHBondContact N-O 3.06Å; Q110-R123 PolarHBondContact O-N 2.92Å; L112-R123 HydrophobicContact CD1-CB 4.23Å; L112-R123 HydrophobicContact CD2-CB 4.33Å; L112-R123 HydrophobicContact CG-CB 4.29Å; R123-L125 PolarHBondContact O-N 3.29Å; R123-G128 PolarHBondContact NE-O 3.18Å; R123-G128 VanDerWaalsContact NE-O 3.14Å; R123-E129 CarbonylContact C-O 3.49Å; R123-E129 VanDerWaalsContact CA-O 3.29Å; R123-E129 WeakPolarHBondContact CA-O 3.35Å; R123-E129 WeakPolarHBondContact CG-O 3.37Å
124	S	96.9	Very high	91.3	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.007	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	132.6	171.5	167.7	0	0	0	0	109.9	E107 T126 T127 G128 E129	E107-S124 WeakPolarHBondContact OE1-CB 3.39Å; E107-S124 PolarHBondContact OE1-OG 3.48Å; S124-T126 VanDerWaalsContact C-N 3.29Å; S124-T126 PolarHBondContact OG-N 3.42Å; S124-T127 VanDerWaalsContact CB-OG1 3.3Å; S124-T127 WeakPolarHBondContact CB-OG1 3.33Å; S124-T127 PolarHBondContact OG-N 3.27Å; S124-T127 PolarHBondContact OG-OG1 3.45Å; S124-G128 WeakPolarHBondContact O-CA 3.42Å; S124-G128 PolarHBondContact O-N 3.3Å; S124-E129 PolarHBondContact N-O 3.28Å
125	L	95.4	Very high	91.6	Very high	85 Å²	85	54.7 Å²	54.7	45%	0.445	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-13.6	172	-59.6	-174.2	0	0	0	112.6	L86 K108 Q110 R123	L86-L125 HydrophobicContact CD1-CD1 4.05Å; L86-L125 HydrophobicContact CD2-CD1 3.83Å; K108-L125 HydrophobicContact CB-CD1 4.1Å; K108-L125 WeakPolarHBondContact O-CB 3.41Å; K108-L125 PolarHBondContact O-N 3.03Å; Q110-L125 HydrophobicContact CB-CD2 4.29Å; R123-L125 PolarHBondContact O-N 3.29Å
126	T	94.6	Very high	92.2	Very high	106 Å²	106	53 Å²	53	65%	0.65	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-50.5	179.4	-55.2	0	0	0	0	110.9	S124	S124-T126 VanDerWaalsContact C-N 3.29Å; S124-T126 PolarHBondContact OG-N 3.42Å
127	T	94.6	Very high	93.6	Very high	76 Å²	76	45.7 Å²	45.7	47%	0.466	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-23.7	-177.6	68.5	0	0	0	0	112.6	S124 E129	S124-T127 VanDerWaalsContact CB-OG1 3.3Å; S124-T127 WeakPolarHBondContact CB-OG1 3.33Å; S124-T127 PolarHBondContact OG-N 3.27Å; S124-T127 PolarHBondContact OG-OG1 3.45Å; T127-E129 PolarHBondContact O-N 2.94Å; T127-E129 WeakPolarHBondContact OG1-CB 3.43Å; T127-E129 PolarHBondContact OG1-N 3.19Å
128	G	94.6	Very high	94.6	Very high	32 Å²	32	43.3 Å²	43.3	33%	0.33	23%	0.229	S	C	.	.			trans	80.8	-6.6	-174.4	0	0	0	0	0	114.4	R123 S124	R123-G128 PolarHBondContact NE-O 3.18Å; R123-G128 VanDerWaalsContact NE-O 3.14Å; S124-G128 WeakPolarHBondContact O-CA 3.42Å; S124-G128 PolarHBondContact O-N 3.3Å
129	E	96.4	Very high	94.8	Very high	120 Å²	120	41 Å²	41	56%	0.561	22%	0.217	S	C	*	.			trans	-71.7	160	179.3	-63.4	179.5	156.6	0	0	111.9	L101 R123 S124 T127	L101-E129 HydrophobicContact CD1-CB 3.8Å; R123-E129 CarbonylContact C-O 3.49Å; R123-E129 VanDerWaalsContact CA-O 3.29Å; R123-E129 WeakPolarHBondContact CA-O 3.35Å; R123-E129 WeakPolarHBondContact CG-O 3.37Å; S124-E129 PolarHBondContact N-O 3.28Å; T127-E129 PolarHBondContact O-N 2.94Å; T127-E129 WeakPolarHBondContact OG1-CB 3.43Å; T127-E129 PolarHBondContact OG1-N 3.19Å
130	T	96.2	Very high	94.9	Very high	69 Å²	69	41.9 Å²	41.9	42%	0.423	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	141.3	-179.5	-58.6	0	0	0	0	109.4	L112 E121 A122	L112-T130 HydrophobicContact CD1-CG2 3.46Å; L112-T130 VanDerWaalsContact CD1-CG2 3.46Å; E121-T130 HydrophobicContact CG-CG2 4.13Å; A122-T130 VanDerWaalsContact O-CA 3.3Å; A122-T130 WeakPolarHBondContact O-CA 3.41Å
131	G	95.3	Very high	94.7	Very high	8 Å²	8	42.4 Å²	42.4	8%	0.082	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.8	-176.4	175.5	0	0	0	0	0	111.2	D99 A122	D99-G131 CarbonylContact O-C 3.51Å; D99-G131 VanDerWaalsContact O-CA 3.28Å; D99-G131 WeakPolarHBondContact O-CA 3.17Å; A122-G131 PolarHBondContact N-O 3.42Å; A122-G131 PolarHBondContact O-N 3.33Å
132	Y	95.1	Very high	94.4	Very high	51 Å²	51	47.2 Å²	47.2	20%	0.2	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	138.8	176.4	-67.5	-73.5	0	0	0	111.8	D99 D100 L101 W120 E121 K258	D99-Y132 HydrophobicContact CB-CD2 3.98Å; D99-Y132 HydrophobicContact CB-CE2 4.33Å; D99-Y132 PolarHBondContact O-N 2.74Å; D100-Y132 WeakPolarHBondContact CA-O 3.39Å; L101-Y132 PolarHBondContact N-O 3.18Å; W120-Y132 CarbonylContact O-C 3.6Å; W120-Y132 WeakPolarHBondContact O-CA 3.41Å; E121-Y132 HydrophobicContact CB-CD1 4.24Å; E121-Y132 HydrophobicContact CB-CE1 3.95Å; E121-Y132 HydrophobicContact CG-CE1 4.49Å; Y132-K258 HydrophobicContact CD1-CD 3.64Å; Y132-K258 HydrophobicContact CD2-CD 4.2Å; Y132-K258 HydrophobicContact CE1-CD 3.26Å; Y132-K258 VanDerWaalsContact CE1-NZ 3.32Å; Y132-K258 HydrophobicContact CE2-CD 3.87Å; Y132-K258 HydrophobicContact CG-CB 4.4Å; Y132-K258 HydrophobicContact CG-CD 4.1Å; Y132-K258 VanDerWaalsContact CZ-NZ 3.3Å; Y132-K258 PolarHBondContact OH-NZ 3.31Å
133	I	95.9	Very high	94.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	147.9	174.4	62.8	168.3	0	0	0	110.4	L101 F103 F109 I111 W119 W120 A122 S135 V138	L101-I133 HydrophobicContact CB-CG2 3.89Å; L101-I133 HydrophobicContact CD2-CG2 4.22Å; L101-I133 HydrophobicContact CG-CG2 4.47Å; F103-I133 HydrophobicContact CD1-CG2 3.85Å; F103-I133 HydrophobicContact CE1-CB 3.77Å; F103-I133 HydrophobicContact CE1-CG2 3.51Å; F103-I133 HydrophobicContact CZ-CB 4.44Å; F109-I133 HydrophobicContact CG-CD1 4.35Å; I111-I133 HydrophobicContact CD1-CD1 3.97Å; W119-I133 CarbonylContact C-O 3.51Å; W119-I133 WeakPolarHBondContact CA-O 3.31Å; W120-I133 HydrophobicContact CB-CG1 4.41Å; W120-I133 PolarHBondContact N-O 3.32Å; W120-I133 WeakPolarHBondContact O-CG1 3.41Å; W120-I133 PolarHBondContact O-N 3.27Å; A122-I133 HydrophobicContact CB-CD1 3.44Å; A122-I133 VanDerWaalsContact CB-CD1 3.44Å; A122-I133 HydrophobicContact CB-CG1 3.69Å; A122-I133 HydrophobicContact CB-CG2 4.21Å; I133-S135 PolarHBondContact O-N 2.86Å; I133-V138 HydrophobicContact CD1-CG1 3.77Å; I133-V138 HydrophobicContact CD1-CG2 4.1Å
134	P	94.9	Very high	93.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	123.8	173.1	24.8	-29.1	0	0	0	110.5	Y93 F103 W119 N136 Y137 T253	Y93-P134 HydrophobicContact CD2-CG 3.77Å; Y93-P134 HydrophobicContact CE2-CG 3.93Å; Y93-P134 HydrophobicContact CG-CG 4.16Å; F103-P134 HydrophobicContact CZ-CG 4.39Å; W119-P134 HydrophobicContact CE3-CB 4.39Å; W119-P134 HydrophobicContact CH2-CB 4.27Å; W119-P134 HydrophobicContact CH2-CG 4.5Å; W119-P134 HydrophobicContact CZ3-CB 4.19Å; W119-P134 HydrophobicContact CZ3-CG 4.3Å; P134-N136 PolarHBondContact O-N 2.68Å; P134-Y137 HydrophobicContact CB-CD2 3.78Å; P134-Y137 HydrophobicContact CB-CE2 4.26Å; P134-Y137 HydrophobicContact CB-CG 4.26Å; P134-Y137 HydrophobicContact CG-CD1 4.11Å; P134-Y137 HydrophobicContact CG-CD2 3.58Å; P134-Y137 HydrophobicContact CG-CE2 4.06Å; P134-Y137 HydrophobicContact CG-CG 3.6Å; P134-Y137 WeakPolarHBondContact O-CB 3.28Å; P134-Y137 PolarHBondContact O-N 2.84Å; P134-T253 HydrophobicContact CB-CG2 3.8Å; P134-T253 HydrophobicContact CG-CG2 4.02Å
135	S	93.4	Very high	93.5	Very high	15 Å²	15	46.9 Å²	46.9	11%	0.105	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-61.5	-29.7	-175.6	59.6	0	0	0	0	113.7	D118 I133 Y137 V138	D118-S135 WeakPolarHBondContact O-CB 3.33Å; D118-S135 PolarHBondContact O-N 3.01Å; D118-S135 PolarHBondContact O-OG 2.93Å; I133-S135 PolarHBondContact O-N 2.86Å; S135-Y137 PolarHBondContact O-N 3.46Å; S135-V138 PolarHBondContact O-N 3.5Å
136	N	91.8	Very high	93.3	Very high	55 Å²	55	44 Å²	44	29%	0.294	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-78	0.5	178.2	67.1	-41.1	0	0	0	114.2	P134 Q252	P134-N136 PolarHBondContact O-N 2.68Å; N136-Q252 PolarHBondContact ND2-O 3.21Å
137	Y	94.3	Very high	93.2	Very high	12 Å²	12	41.6 Å²	41.6	5%	0.047	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-100.1	-4.3	176.3	-80.7	-128.8	0	0	0	113	L90 Y91 D92 Y93 F103 P134 S135 T250 P251 T253	L90-Y137 WeakPolarHBondContact CB-O 3.48Å; L90-Y137 PolarHBondContact N-O 2.82Å; Y91-Y137 HydrophobicContact CD2-CD1 4.02Å; Y91-Y137 HydrophobicContact CD2-CG 4.02Å; Y91-Y137 HydrophobicContact CG-CD1 4.39Å; D92-Y137 WeakPolarHBondContact O-CE1 3.39Å; Y93-Y137 HydrophobicContact CD2-CD1 4.41Å; Y93-Y137 HydrophobicContact CD2-CE1 4.03Å; F103-Y137 HydrophobicContact CE2-CD1 4.23Å; F103-Y137 HydrophobicContact CZ-CD1 4.17Å; F103-Y137 HydrophobicContact CZ-CG 4.43Å; P134-Y137 HydrophobicContact CB-CD2 3.78Å; P134-Y137 HydrophobicContact CB-CE2 4.26Å; P134-Y137 HydrophobicContact CB-CG 4.26Å; P134-Y137 HydrophobicContact CG-CD1 4.11Å; P134-Y137 HydrophobicContact CG-CD2 3.58Å; P134-Y137 HydrophobicContact CG-CE2 4.06Å; P134-Y137 HydrophobicContact CG-CG 3.6Å; P134-Y137 WeakPolarHBondContact O-CB 3.28Å; P134-Y137 PolarHBondContact O-N 2.84Å; S135-Y137 PolarHBondContact O-N 3.46Å; Y137-T250 HydrophobicContact CE1-CG2 3.8Å; Y137-T250 WeakPolarHBondContact OH-CG2 3.37Å; Y137-P251 HydrophobicContact CD2-CG 4.25Å; Y137-P251 HydrophobicContact CE2-CG 3.96Å; Y137-P251 PolarHBondContact OH-O 2.87Å; Y137-T253 HydrophobicContact CE2-CG2 3.79Å
138	V	94.1	Very high	93.1	Very high	6 Å²	6	43.1 Å²	43.1	4%	0.036	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	151.1	-176.7	-66.9	0	0	0	0	112	F87 V88 F109 W120 I133 S135	F87-V138 HydrophobicContact CB-CB 4.26Å; F87-V138 HydrophobicContact CD1-CB 4.24Å; F87-V138 HydrophobicContact CD1-CG2 4.01Å; V88-V138 VanDerWaalsContact O-CA 3.26Å; V88-V138 WeakPolarHBondContact O-CA 3.34Å; F109-V138 HydrophobicContact CD2-CG1 4.08Å; F109-V138 HydrophobicContact CE2-CG1 4.21Å; W120-V138 HydrophobicContact CE3-CG2 4.14Å; W120-V138 HydrophobicContact CZ3-CG2 4.04Å; I133-V138 HydrophobicContact CD1-CG1 3.77Å; I133-V138 HydrophobicContact CD1-CG2 4.1Å; S135-V138 PolarHBondContact O-N 3.5Å
139	A	93.8	Very high	93	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.008	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	153.1	171.8	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 3.43Å; F87-A139 VanDerWaalsContact CD1-C 3.42Å; V88-A139 PolarHBondContact N-O 3.42Å; V88-A139 PolarHBondContact O-N 3.3Å; L90-A139 HydrophobicContact CD1-CB 4.15Å; L90-A139 HydrophobicContact CD2-CB 3.93Å; L90-A139 HydrophobicContact CG-CB 4.28Å; A139-V141 PolarHBondContact O-N 2.9Å; A139-Q145 VanDerWaalsContact CB-C 3.43Å; A139-Q145 HydrophobicContact CB-CB 3.55Å; A139-Q145 WeakPolarHBondContact CB-O 3.44Å; A139-A146 HydrophobicContact CB-CB 4.26Å
140	P	94.1	Very high	92.9	Very high	34 Å²	34	37.3 Å²	37.3	22%	0.221	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	135.7	169.6	-18.7	28.6	0	0	0	110.8	T85 L86 F87 D142 S143	T85-P140 HydrophobicContact CG2-CB 4.12Å; L86-P140 WeakPolarHBondContact O-CA 3.2Å; F87-P140 HydrophobicContact CD1-CG 4.26Å; F87-P140 HydrophobicContact CE1-CB 4.45Å; F87-P140 HydrophobicContact CE1-CG 3.69Å; F87-P140 HydrophobicContact CZ-CG 3.95Å; P140-D142 VanDerWaalsContact C-N 3.27Å; P140-D142 PolarHBondContact O-N 3.38Å; P140-S143 WeakPolarHBondContact CD-OG 3.41Å; P140-S143 WeakPolarHBondContact O-CB 3.39Å; P140-S143 PolarHBondContact O-N 3.02Å; P140-S143 PolarHBondContact O-OG 2.88Å
141	V	91.4	Very high	92.8	Very high	40 Å²	40	35 Å²	35	24%	0.242	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-40	-171.6	171.9	0	0	0	0	113	L86 V88 K108 A139 S143	L86-V141 HydrophobicContact CB-CG2 3.82Å; L86-V141 WeakPolarHBondContact O-CG2 3.49Å; L86-V141 PolarHBondContact O-N 3.2Å; V88-V141 HydrophobicContact CB-CG2 4.11Å; K108-V141 HydrophobicContact CD-CG2 4.39Å; K108-V141 HydrophobicContact CG-CG2 4.49Å; A139-V141 PolarHBondContact O-N 2.9Å; V141-S143 VanDerWaalsContact C-N 3.33Å
142	D	87.3	Confident	92.6	Very high	164 Å²	164	35.5 Å²	35.5	88%	0.877	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.6	13	-175.8	-55.6	-42.6	0	0	0	113	P140	P140-D142 VanDerWaalsContact C-N 3.27Å; P140-D142 PolarHBondContact O-N 3.38Å
143	S	90.4	Very high	92.3	Very high	20 Å²	20	41 Å²	41	14%	0.14	21%	0.213	C	C	.	.	S	Bend	trans	-97.2	156.3	-178.1	75.7	0	0	0	0	112	P140 V141 Q145 A146	P140-S143 WeakPolarHBondContact CD-OG 3.41Å; P140-S143 WeakPolarHBondContact O-CB 3.39Å; P140-S143 PolarHBondContact O-N 3.02Å; P140-S143 PolarHBondContact O-OG 2.88Å; V141-S143 VanDerWaalsContact C-N 3.33Å; S143-Q145 VanDerWaalsContact CB-OE1 3.22Å; S143-Q145 PolarHBondContact O-N 2.8Å; S143-Q145 PolarHBondContact OG-N 3.19Å; S143-Q145 PolarHBondContact OG-OE1 3.03Å; S143-A146 WeakPolarHBondContact O-CB 3.49Å; S143-A146 PolarHBondContact O-N 2.93Å
144	I	89.5	Confident	92	Very high	26 Å²	26	42.7 Å²	42.7	13%	0.133	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-60.9	-25.2	172.5	-172.8	160.6	0	0	0	112.6	A146 E147 W149 Y150 Y185 L224	I144-A146 PolarHBondContact O-N 2.78Å; I144-E147 HydrophobicContact CG1-CG 4.47Å; I144-E147 VanDerWaalsContact O-CB 3.29Å; I144-E147 WeakPolarHBondContact O-CB 3.48Å; I144-E147 PolarHBondContact O-N 3.06Å; I144-W149 HydrophobicContact CD1-CH2 3.87Å; I144-W149 HydrophobicContact CD1-CZ3 4.04Å; I144-W149 HydrophobicContact CG1-CH2 4.01Å; I144-W149 HydrophobicContact CG1-CZ3 4.26Å; I144-Y150 HydrophobicContact CD1-CD2 3.76Å; I144-Y150 HydrophobicContact CD1-CE2 3.97Å; I144-Y150 HydrophobicContact CD1-CG 4.28Å; I144-Y150 HydrophobicContact CG1-CD1 4.16Å; I144-Y150 HydrophobicContact CG1-CD2 3.7Å; I144-Y150 HydrophobicContact CG1-CE2 4.14Å; I144-Y150 HydrophobicContact CG1-CG 3.7Å; I144-Y150 HydrophobicContact CG2-CD1 4.45Å; I144-Y150 HydrophobicContact CG2-CE1 4.16Å; I144-Y150 WeakPolarHBondContact O-CB 3.44Å; I144-Y185 HydrophobicContact CD1-CE1 4.3Å; I144-L224 HydrophobicContact CD1-CB 4.15Å; I144-L224 HydrophobicContact CD1-CD1 3.16Å; I144-L224 HydrophobicContact CD1-CG 4.24Å
145	Q	90.2	Very high	91.8	Very high	64 Å²	64	43.2 Å²	43.2	30%	0.299	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-65	-19.8	176.9	-67.6	75.6	10.7	0	0	112.8	L90 A139 S143 E147 Y150	L90-Q145 WeakPolarHBondContact CD2-O 3.33Å; A139-Q145 VanDerWaalsContact CB-C 3.43Å; A139-Q145 HydrophobicContact CB-CB 3.55Å; A139-Q145 WeakPolarHBondContact CB-O 3.44Å; S143-Q145 VanDerWaalsContact CB-OE1 3.22Å; S143-Q145 PolarHBondContact O-N 2.8Å; S143-Q145 PolarHBondContact OG-N 3.19Å; S143-Q145 PolarHBondContact OG-OE1 3.03Å; Q145-E147 VanDerWaalsContact C-N 3.32Å; Q145-Y150 HydrophobicContact CG-CD1 4.44Å; Q145-Y150 HydrophobicContact CG-CE1 4.06Å
146	A	91.9	Very high	91.7	Very high	24 Å²	24	44.4 Å²	44.4	20%	0.198	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-79.6	-14.4	174.3	0	0	0	0	0	113.4	V88 A139 S143 I144	V88-A146 HydrophobicContact CG1-CB 3.67Å; A139-A146 HydrophobicContact CB-CB 4.26Å; S143-A146 WeakPolarHBondContact O-CB 3.49Å; S143-A146 PolarHBondContact O-N 2.93Å; I144-A146 PolarHBondContact O-N 2.78Å
147	E	92.6	Very high	91.4	Very high	56 Å²	56	43.1 Å²	43.1	26%	0.262	22%	0.222	S	C	.	.			trans	-76	127.2	-178.2	-62.8	-69.6	160.1	0	0	111	I144 Q145 W149 Y150 Q225	I144-E147 HydrophobicContact CG1-CG 4.47Å; I144-E147 VanDerWaalsContact O-CB 3.29Å; I144-E147 WeakPolarHBondContact O-CB 3.48Å; I144-E147 PolarHBondContact O-N 3.06Å; Q145-E147 VanDerWaalsContact C-N 3.32Å; E147-W149 HydrophobicContact CB-CD2 4Å; E147-W149 HydrophobicContact CB-CE3 4.46Å; E147-W149 HydrophobicContact CB-CG 4.47Å; E147-W149 HydrophobicContact CB-CH2 4.17Å; E147-W149 HydrophobicContact CB-CZ2 3.67Å; E147-W149 HydrophobicContact CG-CH2 4.08Å; E147-W149 HydrophobicContact CG-CZ2 3.51Å; E147-W149 PolarHBondContact O-N 3.44Å; E147-W149 VanDerWaalsContact O-N 3.15Å; E147-W149 PolarHBondContact OE2-NE1 3.46Å; E147-Y150 WeakPolarHBondContact O-CB 3.17Å; E147-Y150 PolarHBondContact O-N 3.35Å; E147-Q225 VanDerWaalsContact OE1-CG 3.28Å; E147-Q225 WeakPolarHBondContact OE1-CG 3.38Å; E147-Q225 PolarHBondContact OE1-NE2 3.5Å
148	E	91.4	Very high	91.1	Very high	108 Å²	108	44.4 Å²	44.4	51%	0.505	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-27.3	-176.3	-59.3	-165.4	151.1	0	0	113.6	K105 Y150 F151 I245	K105-E148 WeakPolarHBondContact CE-OE1 3.45Å; K105-E148 VanDerWaalsContact NZ-CD 3.33Å; K105-E148 IonicContact NZ-OE1 2.78Å; K105-E148 PolarHBondContact NZ-OE1 3.19Å; K105-E148 IonicContact NZ-OE2 2.7Å; E148-Y150 VanDerWaalsContact C-N 3.29Å; E148-F151 WeakPolarHBondContact O-CE2 3.21Å; E148-I245 HydrophobicContact CB-CD1 3.91Å; E148-I245 WeakPolarHBondContact O-CG2 3.35Å
149	W	94	Very high	91	Very high	15 Å²	15	44.1 Å²	44.1	6%	0.057	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-3.2	178.5	50.6	-97.5	0	0	0	113.2	I144 E147 F151 F173 I175 L224 Q225 V228 I245	I144-W149 HydrophobicContact CD1-CH2 3.87Å; I144-W149 HydrophobicContact CD1-CZ3 4.04Å; I144-W149 HydrophobicContact CG1-CH2 4.01Å; I144-W149 HydrophobicContact CG1-CZ3 4.26Å; E147-W149 HydrophobicContact CB-CD2 4Å; E147-W149 HydrophobicContact CB-CE3 4.46Å; E147-W149 HydrophobicContact CB-CG 4.47Å; E147-W149 HydrophobicContact CB-CH2 4.17Å; E147-W149 HydrophobicContact CB-CZ2 3.67Å; E147-W149 HydrophobicContact CG-CH2 4.08Å; E147-W149 HydrophobicContact CG-CZ2 3.51Å; E147-W149 PolarHBondContact O-N 3.44Å; E147-W149 VanDerWaalsContact O-N 3.15Å; E147-W149 PolarHBondContact OE2-NE1 3.46Å; W149-F151 WeakPolarHBondContact O-CD2 3.3Å; W149-F173 HydrophobicContact CB-CE2 3.69Å; W149-F173 HydrophobicContact CB-CZ 4.01Å; W149-F173 HydrophobicContact CG-CE2 4.21Å; W149-I175 HydrophobicContact CE3-CB 3.67Å; W149-I175 HydrophobicContact CE3-CD1 3.64Å; W149-I175 HydrophobicContact CE3-CG1 3.8Å; W149-I175 HydrophobicContact CH2-CD1 4.36Å; W149-I175 HydrophobicContact CZ3-CB 3.77Å; W149-I175 HydrophobicContact CZ3-CD1 3.51Å; W149-I175 HydrophobicContact CZ3-CG1 4.01Å; W149-I175 HydrophobicContact CZ3-CG2 4.12Å; W149-I175 PolarHBondContact O-N 3.15Å; W149-L224 HydrophobicContact CH2-CB 3.61Å; W149-L224 HydrophobicContact CZ2-CB 4.47Å; W149-L224 HydrophobicContact CZ3-CB 4.32Å; W149-Q225 HydrophobicContact CZ2-CG 4.14Å; W149-V228 HydrophobicContact CD2-CG2 3.91Å; W149-V228 HydrophobicContact CE3-CG2 4.11Å; W149-V228 HydrophobicContact CG-CG1 4.49Å; W149-V228 HydrophobicContact CG-CG2 4.46Å; W149-V228 HydrophobicContact CH2-CG2 4.36Å; W149-V228 HydrophobicContact CZ2-CG2 4.14Å; W149-V228 HydrophobicContact CZ3-CG2 4.35Å; W149-I245 HydrophobicContact CB-CD1 4.06Å; W149-I245 HydrophobicContact CB-CG1 4.12Å; W149-I245 HydrophobicContact CB-CG2 4.03Å
150	Y	94.4	Very high	91	Very high	16 Å²	16	45.5 Å²	45.5	6%	0.063	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-99	120.6	-179.8	-175.8	-105.7	0	0	0	112.4	I144 Q145 E147 E148 G152 I175 E177 Y185	I144-Y150 HydrophobicContact CD1-CD2 3.76Å; I144-Y150 HydrophobicContact CD1-CE2 3.97Å; I144-Y150 HydrophobicContact CD1-CG 4.28Å; I144-Y150 HydrophobicContact CG1-CD1 4.16Å; I144-Y150 HydrophobicContact CG1-CD2 3.7Å; I144-Y150 HydrophobicContact CG1-CE2 4.14Å; I144-Y150 HydrophobicContact CG1-CG 3.7Å; I144-Y150 HydrophobicContact CG2-CD1 4.45Å; I144-Y150 HydrophobicContact CG2-CE1 4.16Å; I144-Y150 WeakPolarHBondContact O-CB 3.44Å; Q145-Y150 HydrophobicContact CG-CD1 4.44Å; Q145-Y150 HydrophobicContact CG-CE1 4.06Å; E147-Y150 WeakPolarHBondContact O-CB 3.17Å; E147-Y150 PolarHBondContact O-N 3.35Å; E148-Y150 VanDerWaalsContact C-N 3.29Å; Y150-G152 VanDerWaalsContact CE1-CA 3.43Å; Y150-I175 CarbonylContact C-O 3.49Å; Y150-I175 WeakPolarHBondContact CA-O 3.26Å; Y150-I175 HydrophobicContact CD2-CG2 4.17Å; Y150-E177 VanDerWaalsContact OH-CG 3.31Å; Y150-E177 WeakPolarHBondContact OH-CG 3.36Å; Y150-E177 PolarHBondContact OH-OE1 2.97Å; Y150-Y185 AromaticContact CE2-CD1 3.78Å; Y150-Y185 HydrophobicContact CE2-CD1 3.78Å; Y150-Y185 AromaticContact CE2-CE1 3.6Å; Y150-Y185 HydrophobicContact CE2-CE1 3.6Å
151	F	92.6	Very high	90.7	Very high	21 Å²	21	46.1 Å²	46.1	9%	0.092	23%	0.232	C	C	.	.			trans	-109.4	14.9	-172.8	-74.3	-110.5	0	0	0	112.4	E148 W149 K153 L154 Q162 L174 I175 I245 A246 N248	E148-F151 WeakPolarHBondContact O-CE2 3.21Å; W149-F151 WeakPolarHBondContact O-CD2 3.3Å; F151-K153 PolarHBondContact O-N 2.75Å; F151-L154 HydrophobicContact CB-CB 3.93Å; F151-L154 HydrophobicContact CB-CD2 3.84Å; F151-L154 HydrophobicContact CD1-CD2 3.91Å; F151-L154 HydrophobicContact CG-CD2 4.16Å; F151-L154 WeakPolarHBondContact O-CB 3.08Å; F151-L154 PolarHBondContact O-N 3.32Å; F151-Q162 VanDerWaalsContact CE1-NE2 3.35Å; F151-L174 HydrophobicContact CD1-CD2 4.31Å; F151-L174 HydrophobicContact CD2-CB 3.43Å; F151-L174 VanDerWaalsContact CD2-CB 3.43Å; F151-L174 HydrophobicContact CD2-CD2 4.42Å; F151-L174 HydrophobicContact CD2-CG 4.36Å; F151-L174 HydrophobicContact CE1-CD2 4.5Å; F151-L174 HydrophobicContact CE2-CB 3.59Å; F151-L174 HydrophobicContact CG-CB 4.06Å; F151-L174 HydrophobicContact CG-CD2 4.28Å; F151-L174 HydrophobicContact CZ-CB 4.33Å; F151-I175 PolarHBondContact N-O 2.78Å; F151-I245 HydrophobicContact CE2-CG2 4.3Å; F151-A246 HydrophobicContact CZ-CB 4Å; F151-A246 WeakPolarHBondContact CZ-O 3.35Å; F151-N248 HydrophobicContact CE1-CB 3.7Å; F151-N248 HydrophobicContact CZ-CB 3.84Å
152	G	91.6	Very high	90.6	Very high	17 Å²	17	45.2 Å²	45.2	18%	0.175	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	-130.3	175.4	0	0	0	0	0	112.9	Y150 L154 R176 E177	Y150-G152 VanDerWaalsContact CE1-CA 3.43Å; G152-L154 PolarHBondContact O-N 3.07Å; G152-L154 VanDerWaalsContact O-N 3.17Å; G152-R176 CarbonylContact O-C 3.3Å; G152-R176 WeakPolarHBondContact O-CA 3.49Å; G152-E177 PolarHBondContact O-N 3.32Å
153	K	89.6	Confident	90.8	Very high	166 Å²	166	37.4 Å²	37.4	72%	0.722	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.3	21.4	-176.7	-67.1	179.4	-179.9	174.4	0	114.4	F151 G155 E177	F151-K153 PolarHBondContact O-N 2.75Å; K153-G155 PolarHBondContact O-N 2.76Å; K153-E177 VanDerWaalsContact CG-CD 3.48Å; K153-E177 HydrophobicContact CG-CG 4.41Å; K153-E177 WeakPolarHBondContact CG-OE1 3.39Å; K153-E177 WeakPolarHBondContact CG-OE2 3.45Å
154	L	89.6	Confident	90.8	Very high	37 Å²	37	39.8 Å²	39.8	19%	0.194	19%	0.194	C	C	.	.			trans	-55.3	126.1	176.5	-171.9	70.1	0	0	0	110.3	F151 G152 D158 A159 L174 R176	F151-L154 HydrophobicContact CB-CB 3.93Å; F151-L154 HydrophobicContact CB-CD2 3.84Å; F151-L154 HydrophobicContact CD1-CD2 3.91Å; F151-L154 HydrophobicContact CG-CD2 4.16Å; F151-L154 WeakPolarHBondContact O-CB 3.08Å; F151-L154 PolarHBondContact O-N 3.32Å; G152-L154 PolarHBondContact O-N 3.07Å; G152-L154 VanDerWaalsContact O-N 3.17Å; L154-D158 HydrophobicContact CD1-CB 3.51Å; L154-D158 HydrophobicContact CG-CB 4.08Å; L154-A159 HydrophobicContact CD2-CB 3.76Å; L154-A159 HydrophobicContact CG-CB 4.25Å; L154-L174 HydrophobicContact CD2-CD1 4.24Å; L154-L174 HydrophobicContact CD2-CD2 3.91Å; L154-R176 HydrophobicContact CB-CB 4.28Å; L154-R176 WeakPolarHBondContact O-CD 3.37Å
155	G	89.9	Confident	90.6	Very high	11 Å²	11	41.1 Å²	41.1	11%	0.113	21%	0.206	C	C	.	.			trans	-68.7	157.9	178.7	0	0	0	0	0	112.1	K153 K157 D158 A159 E179	K153-G155 PolarHBondContact O-N 2.76Å; G155-K157 VanDerWaalsContact C-N 3.31Å; G155-K157 PolarHBondContact O-N 2.97Å; G155-D158 PolarHBondContact O-N 2.85Å; G155-A159 WeakPolarHBondContact O-CB 3.44Å; G155-A159 PolarHBondContact O-N 2.92Å; G155-E179 WeakPolarHBondContact CA-OE1 3.47Å
156	R	90.4	Very high	90.2	Very high	39 Å²	39	48.3 Å²	48.3	15%	0.147	24%	0.237	C	C	.	.	H	α-helix	trans	-54	-48.1	179.2	177.5	176.5	177.3	174.1	3.7	112	A159 E160 R176 E179 H202 Q527	R156-A159 WeakPolarHBondContact O-CB 3.4Å; R156-A159 PolarHBondContact O-N 2.73Å; R156-E160 IonicContact CZ-OE1 3.99Å; R156-E160 IonicContact NE-OE1 3.83Å; R156-E160 PolarHBondContact NE-OE1 3.07Å; R156-E160 IonicContact NH2-OE1 3.24Å; R156-E160 WeakPolarHBondContact O-CG 3.31Å; R156-E160 PolarHBondContact O-N 3.5Å; R156-R176 VanDerWaalsContact CA-CZ 3.47Å; R156-R176 VanDerWaalsContact CB-NH2 3.3Å; R156-E179 WeakPolarHBondContact CB-OE2 3.33Å; R156-E179 VanDerWaalsContact N-CD 3.25Å; R156-E179 PolarHBondContact N-OE1 3.23Å; R156-E179 PolarHBondContact N-OE2 3.06Å; R156-H202 PolarHBondContact NE-CD2 3.33Å; R156-H202 VanDerWaalsContact NE-CD2 3.32Å; R156-H202 PolarHBondContact NE-NE2 3.33Å; R156-Q527 VanDerWaalsContact NH1-CB 3.34Å; R156-Q527 PolarHBondContact NH1-O 2.72Å; R156-Q527 PolarHBondContact NH2-O 2.83Å
157	K	86.8	Confident	89.9	Confident	29 Å²	29	50.1 Å²	50.1	13%	0.126	26%	0.258	C	S	.	.	H	α-helix	trans	-70.6	-36.6	-177.1	-65.2	-68.7	171.1	179.3	0	112.4	G155 A159 E160 R161 E518	G155-K157 VanDerWaalsContact C-N 3.31Å; G155-K157 PolarHBondContact O-N 2.97Å; K157-A159 VanDerWaalsContact C-N 3.32Å; K157-E160 WeakPolarHBondContact CD-OE2 3.47Å; K157-E160 IonicContact NZ-OE1 3.07Å; K157-E160 IonicContact NZ-OE2 3.78Å; K157-E160 PolarHBondContact NZ-OE2 2.91Å; K157-E160 PolarHBondContact O-N 3.37Å; K157-R161 WeakPolarHBondContact O-CG 3.34Å; K157-R161 PolarHBondContact O-N 2.64Å; K157-E518 WeakPolarHBondContact CE-O 3.43Å; K157-E518 HydrophobicContact CG-CB 4.19Å; K157-E518 HydrophobicContact CG-CG 4.14Å; K157-E518 PolarHBondContact NZ-O 2.89Å
158	D	88.6	Confident	89.8	Confident	38 Å²	38	48.2 Å²	48.2	20%	0.203	25%	0.249	C	C	.	.	H	α-helix	trans	-64.8	-38.5	172.9	-60.9	-54.3	0	0	0	110.9	L154 G155 R161 Q162 K322	L154-D158 HydrophobicContact CD1-CB 3.51Å; L154-D158 HydrophobicContact CG-CB 4.08Å; G155-D158 PolarHBondContact O-N 2.85Å; D158-R161 PolarHBondContact O-N 2.9Å; D158-R161 IonicContact OD1-CZ 2.73Å; D158-R161 IonicContact OD1-NH1 2.64Å; D158-R161 PolarHBondContact OD1-NH1 3.4Å; D158-R161 IonicContact OD1-NH2 2.97Å; D158-R161 PolarHBondContact OD1-NH2 3.04Å; D158-Q162 WeakPolarHBondContact O-CB 3.47Å; D158-Q162 PolarHBondContact O-N 3.34Å; D158-K322 IonicContact OD1-NZ 2.76Å; D158-K322 PolarHBondContact OD1-NZ 2.92Å
159	A	91.9	Very high	89.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-42.5	172.5	0	0	0	0	0	112.9	L154 G155 R156 K157 R161 Q162 L163 L174	L154-A159 HydrophobicContact CD2-CB 3.76Å; L154-A159 HydrophobicContact CG-CB 4.25Å; G155-A159 WeakPolarHBondContact O-CB 3.44Å; G155-A159 PolarHBondContact O-N 2.92Å; R156-A159 WeakPolarHBondContact O-CB 3.4Å; R156-A159 PolarHBondContact O-N 2.73Å; K157-A159 VanDerWaalsContact C-N 3.32Å; A159-R161 VanDerWaalsContact C-N 3.35Å; A159-R161 PolarHBondContact O-N 3.06Å; A159-Q162 PolarHBondContact O-N 3.49Å; A159-L163 WeakPolarHBondContact O-CB 3.36Å; A159-L163 VanDerWaalsContact O-CG 3.3Å; A159-L163 WeakPolarHBondContact O-CG 3.37Å; A159-L163 PolarHBondContact O-N 3.23Å; A159-L174 HydrophobicContact CB-CD1 3.92Å; A159-L174 HydrophobicContact CB-CD2 4.13Å
160	E	92.1	Very high	90	Very high	31 Å²	31	50.3 Å²	50.3	15%	0.145	26%	0.26	C	S	.	.	H	α-helix	trans	-57.7	-47.3	174.5	-72.2	174.2	-167.7	0	0	110.7	R156 K157 Q162 L163 L164 V200 H202	R156-E160 IonicContact CZ-OE1 3.99Å; R156-E160 IonicContact NE-OE1 3.83Å; R156-E160 PolarHBondContact NE-OE1 3.07Å; R156-E160 IonicContact NH2-OE1 3.24Å; R156-E160 WeakPolarHBondContact O-CG 3.31Å; R156-E160 PolarHBondContact O-N 3.5Å; K157-E160 WeakPolarHBondContact CD-OE2 3.47Å; K157-E160 IonicContact NZ-OE1 3.07Å; K157-E160 IonicContact NZ-OE2 3.78Å; K157-E160 PolarHBondContact NZ-OE2 2.91Å; K157-E160 PolarHBondContact O-N 3.37Å; E160-Q162 PolarHBondContact O-N 3.27Å; E160-L163 PolarHBondContact O-N 3.4Å; E160-L164 VanDerWaalsContact O-CB 3.28Å; E160-L164 WeakPolarHBondContact O-CB 3.37Å; E160-L164 VanDerWaalsContact O-CG 3.23Å; E160-L164 WeakPolarHBondContact O-CG 3.5Å; E160-L164 PolarHBondContact O-N 2.88Å; E160-V200 HydrophobicContact CG-CB 4.06Å; E160-V200 HydrophobicContact CG-CG1 4.3Å; E160-V200 HydrophobicContact CG-CG2 4.42Å; E160-H202 IonicContact OE1-NE2 2.74Å; E160-H202 PolarHBondContact OE1-NE2 3.49Å; E160-H202 VanDerWaalsContact OE1-NE2 3.11Å
161	R	88	Confident	90.1	Very high	46 Å²	46	49.5 Å²	49.5	17%	0.174	26%	0.257	C	S	.	.	H	α-helix	trans	-61.3	-42.6	177.2	-73.4	-171.4	-115.8	107	9.8	113	K157 D158 A159 S165 D366	K157-R161 WeakPolarHBondContact O-CG 3.34Å; K157-R161 PolarHBondContact O-N 2.64Å; D158-R161 PolarHBondContact O-N 2.9Å; D158-R161 IonicContact OD1-CZ 2.73Å; D158-R161 IonicContact OD1-NH1 2.64Å; D158-R161 PolarHBondContact OD1-NH1 3.4Å; D158-R161 IonicContact OD1-NH2 2.97Å; D158-R161 PolarHBondContact OD1-NH2 3.04Å; A159-R161 VanDerWaalsContact C-N 3.35Å; A159-R161 PolarHBondContact O-N 3.06Å; R161-S165 PolarHBondContact O-N 3.32Å; R161-S165 PolarHBondContact O-OG 2.83Å; R161-D366 WeakPolarHBondContact CD-OD1 3.44Å; R161-D366 VanDerWaalsContact CD-OD2 3.25Å; R161-D366 WeakPolarHBondContact CD-OD2 3.29Å; R161-D366 IonicContact CZ-OD1 3.68Å; R161-D366 IonicContact NE-OD1 2.75Å; R161-D366 PolarHBondContact NE-OD1 3.12Å; R161-D366 IonicContact NE-OD2 3.13Å; R161-D366 PolarHBondContact NE-OD2 2.94Å
162	Q	89.9	Confident	90.3	Very high	21 Å²	21	48.5 Å²	48.5	10%	0.098	25%	0.253	C	S	.	.	H	α-helix	trans	-66.3	-42.5	179.8	-169.7	160.7	30.1	0	0	111.8	F151 D158 A159 E160 S165 N168 A246 T247	F151-Q162 VanDerWaalsContact CE1-NE2 3.35Å; D158-Q162 WeakPolarHBondContact O-CB 3.47Å; D158-Q162 PolarHBondContact O-N 3.34Å; A159-Q162 PolarHBondContact O-N 3.49Å; E160-Q162 PolarHBondContact O-N 3.27Å; Q162-S165 VanDerWaalsContact O-CB 3.3Å; Q162-S165 WeakPolarHBondContact O-CB 3.43Å; Q162-S165 PolarHBondContact O-N 3.05Å; Q162-S165 PolarHBondContact O-OG 3.11Å; Q162-N168 PolarHBondContact O-ND2 2.9Å; Q162-A246 HydrophobicContact CG-CB 4.36Å; Q162-T247 PolarHBondContact NE2-O 3.48Å
163	L	92.6	Very high	90.6	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-70.9	-39.3	179.2	-71.3	171.4	0	0	0	112.4	A159 E160 S165 N168 T172 L174 R190 V200 A246	A159-L163 WeakPolarHBondContact O-CB 3.36Å; A159-L163 VanDerWaalsContact O-CG 3.3Å; A159-L163 WeakPolarHBondContact O-CG 3.37Å; A159-L163 PolarHBondContact O-N 3.23Å; E160-L163 PolarHBondContact O-N 3.4Å; L163-S165 PolarHBondContact O-N 3.18Å; L163-N168 WeakPolarHBondContact O-CB 3.21Å; L163-N168 PolarHBondContact O-ND2 2.78Å; L163-T172 HydrophobicContact CD2-CG2 3.8Å; L163-T172 WeakPolarHBondContact CD2-O 3.46Å; L163-L174 HydrophobicContact CD1-CD2 4.27Å; L163-L174 HydrophobicContact CD1-CG 4.25Å; L163-L174 HydrophobicContact CD2-CD2 4.2Å; L163-L174 HydrophobicContact CD2-CG 4.42Å; L163-L174 HydrophobicContact CG-CD2 3.99Å; L163-L174 HydrophobicContact CG-CG 4.4Å; L163-R190 HydrophobicContact CB-CB 4.41Å; L163-R190 WeakPolarHBondContact O-CD 3.37Å; L163-R190 PolarHBondContact O-NH1 2.75Å; L163-V200 HydrophobicContact CB-CG2 3.78Å; L163-V200 HydrophobicContact CD1-CG1 3.59Å; L163-V200 HydrophobicContact CD1-CG2 4.13Å; L163-A246 HydrophobicContact CD2-CB 3.78Å
164	L	90.4	Very high	91	Very high	70 Å²	70	40.1 Å²	40.1	37%	0.366	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	1.6	178.2	-64.3	173.4	0	0	0	113.8	E160 D198 V200	E160-L164 VanDerWaalsContact O-CB 3.28Å; E160-L164 WeakPolarHBondContact O-CB 3.37Å; E160-L164 VanDerWaalsContact O-CG 3.23Å; E160-L164 WeakPolarHBondContact O-CG 3.5Å; E160-L164 PolarHBondContact O-N 2.88Å; L164-D198 HydrophobicContact CD2-CB 3.93Å; L164-V200 HydrophobicContact CD1-CG2 4.3Å; L164-V200 HydrophobicContact CD2-CG2 4.01Å; L164-V200 HydrophobicContact CG-CG2 3.82Å
165	S	85.3	Confident	91.3	Very high	55 Å²	55	38.4 Å²	38.4	39%	0.385	20%	0.203	S	C	.	.	S	Bend	trans	-58	146.6	173.5	-69.9	0	0	0	0	111.6	R161 Q162 L163 G167 N168 R190	R161-S165 PolarHBondContact O-N 3.32Å; R161-S165 PolarHBondContact O-OG 2.83Å; Q162-S165 VanDerWaalsContact O-CB 3.3Å; Q162-S165 WeakPolarHBondContact O-CB 3.43Å; Q162-S165 PolarHBondContact O-N 3.05Å; Q162-S165 PolarHBondContact O-OG 3.11Å; L163-S165 PolarHBondContact O-N 3.18Å; S165-G167 PolarHBondContact O-N 2.9Å; S165-N168 PolarHBondContact O-N 3.04Å; S165-R190 PolarHBondContact O-NH1 3.1Å
166	F	81.7	Confident	91.6	Very high	215 Å²	215	37.9 Å²	37.9	94%	0.943	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	136.5	-178.2	-178.8	-95.5	0	0	0	110.9
167	G	84.4	Confident	91.8	Very high	62 Å²	62	39.3 Å²	39.3	64%	0.639	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.2	-15.3	178.8	0	0	0	0	0	115.2	S165 P169	S165-G167 PolarHBondContact O-N 2.9Å; G167-P169 WeakPolarHBondContact O-CD 3.41Å
168	N	90.8	Very high	92	Very high	16 Å²	16	38.4 Å²	38.4	9%	0.086	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-72	124.6	174.3	-72.1	-23.4	0	0	0	110.9	Q162 L163 S165 T172 R190	Q162-N168 PolarHBondContact O-ND2 2.9Å; L163-N168 WeakPolarHBondContact O-CB 3.21Å; L163-N168 PolarHBondContact O-ND2 2.78Å; S165-N168 PolarHBondContact O-N 3.04Å; N168-T172 HydrophobicContact CB-CG2 4.11Å; N168-R190 PolarHBondContact O-NE 2.99Å; N168-R190 PolarHBondContact O-NH1 3.35Å
169	P	94.1	Very high	91.9	Very high	63 Å²	63	42 Å²	42	41%	0.409	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-74	168	174.3	30.4	-36.1	0	0	0	112.8	G167 T172 V244	G167-P169 WeakPolarHBondContact O-CD 3.41Å; P169-T172 VanDerWaalsContact CD-OG1 3.26Å; P169-T172 WeakPolarHBondContact CD-OG1 3.43Å; P169-T172 WeakPolarHBondContact O-CB 3.48Å; P169-T172 PolarHBondContact O-N 2.98Å; P169-T172 PolarHBondContact O-OG1 2.92Å; P169-V244 HydrophobicContact CG-CB 4.31Å; P169-V244 HydrophobicContact CG-CG2 3.86Å
170	R	95.3	Very high	91.5	Very high	103 Å²	103	45.6 Å²	45.6	39%	0.389	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	139	167.3	-171.1	-179.2	-176.3	-172.3	0.8	110.1	T172 D191 C239 F240 T243	R170-T172 VanDerWaalsContact C-N 3.34Å; R170-D191 IonicContact CZ-OD1 3.35Å; R170-D191 IonicContact NE-OD1 2.7Å; R170-D191 PolarHBondContact NE-OD1 3.2Å; R170-D191 IonicContact NH2-OD1 3.67Å; R170-D191 PolarHBondContact NH2-OD1 2.98Å; R170-C239 PolarHBondContact NH2-O 3.5Å; R170-F240 HydrophobicContact CG-CD1 4.1Å; R170-F240 HydrophobicContact CG-CD2 4.12Å; R170-F240 HydrophobicContact CG-CE1 4.34Å; R170-F240 HydrophobicContact CG-CE2 4.36Å; R170-F240 HydrophobicContact CG-CG 3.98Å; R170-F240 HydrophobicContact CG-CZ 4.48Å; R170-T243 PolarHBondContact O-OG1 2.72Å; R170-T243 VanDerWaalsContact O-OG1 3.06Å
171	G	96	Very high	91.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	-2.3	-175.1	0	0	0	0	0	114.7	F173 R190 N241 T243	G171-F173 PolarHBondContact O-N 2.79Å; G171-R190 PolarHBondContact N-O 2.91Å; G171-N241 WeakPolarHBondContact CA-O 3.12Å; G171-T243 WeakPolarHBondContact CA-OG1 3.24Å; G171-T243 PolarHBondContact O-N 3.38Å; G171-T243 PolarHBondContact O-OG1 3.3Å
172	T	97.6	Very high	90.9	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.285	C	S	.	.			trans	-59	134.8	169.6	-61.6	0	0	0	0	109.8	L163 N168 P169 R170 I189 R190 T243 V244 A246	L163-T172 HydrophobicContact CD2-CG2 3.8Å; L163-T172 WeakPolarHBondContact CD2-O 3.46Å; N168-T172 HydrophobicContact CB-CG2 4.11Å; P169-T172 VanDerWaalsContact CD-OG1 3.26Å; P169-T172 WeakPolarHBondContact CD-OG1 3.43Å; P169-T172 WeakPolarHBondContact O-CB 3.48Å; P169-T172 PolarHBondContact O-N 2.98Å; P169-T172 PolarHBondContact O-OG1 2.92Å; R170-T172 VanDerWaalsContact C-N 3.34Å; T172-I189 CarbonylContact O-C 3.54Å; T172-I189 WeakPolarHBondContact O-CA 3.46Å; T172-R190 PolarHBondContact O-N 3.41Å; T172-T243 PolarHBondContact N-OG1 3.3Å; T172-V244 CarbonylContact C-O 3.56Å; T172-V244 WeakPolarHBondContact CA-O 3.44Å; T172-V244 WeakPolarHBondContact CG2-O 3.44Å; T172-A246 HydrophobicContact CG2-CB 4.06Å
173	F	97.9	Very high	90.6	Very high	7 Å²	7	56.5 Å²	56.5	3%	0.031	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	164.5	-170.9	78.6	-77.4	0	0	0	114	W149 G171 L187 S188 I189 V228 L242 V244 I245 A246	W149-F173 HydrophobicContact CB-CE2 3.69Å; W149-F173 HydrophobicContact CB-CZ 4.01Å; W149-F173 HydrophobicContact CG-CE2 4.21Å; G171-F173 PolarHBondContact O-N 2.79Å; F173-L187 HydrophobicContact CB-CD1 4.25Å; F173-L187 HydrophobicContact CD2-CD1 3.81Å; F173-L187 HydrophobicContact CG-CD1 4.45Å; F173-S188 WeakPolarHBondContact CA-O 3.3Å; F173-S188 WeakPolarHBondContact CB-O 3.44Å; F173-I189 HydrophobicContact CB-CG1 4.24Å; F173-V228 HydrophobicContact CE2-CG1 3.81Å; F173-V228 HydrophobicContact CE2-CG2 4.28Å; F173-V228 HydrophobicContact CZ-CG1 3.7Å; F173-L242 HydrophobicContact CB-CD2 3.74Å; F173-L242 HydrophobicContact CD1-CB 3.65Å; F173-L242 HydrophobicContact CD1-CD2 4.19Å; F173-L242 HydrophobicContact CD1-CG 4.33Å; F173-L242 HydrophobicContact CD2-CB 4.48Å; F173-L242 HydrophobicContact CD2-CD1 3.94Å; F173-L242 HydrophobicContact CD2-CD2 4.1Å; F173-L242 HydrophobicContact CD2-CG 4.39Å; F173-L242 HydrophobicContact CE1-CB 3.73Å; F173-L242 HydrophobicContact CE2-CD1 3.92Å; F173-L242 HydrophobicContact CG-CB 4.05Å; F173-L242 HydrophobicContact CG-CD1 4.27Å; F173-L242 HydrophobicContact CG-CD2 3.74Å; F173-L242 HydrophobicContact CG-CG 4.22Å; F173-L242 HydrophobicContact CZ-CB 4.18Å; F173-L242 HydrophobicContact CZ-CD1 4.24Å; F173-V244 VanDerWaalsContact CD1-O 3.3Å; F173-V244 WeakPolarHBondContact CD1-O 3.39Å; F173-V244 PolarHBondContact N-O 2.81Å; F173-I245 HydrophobicContact CE1-CG1 4.01Å; F173-I245 HydrophobicContact CZ-CG1 4Å; F173-A246 PolarHBondContact O-N 2.97Å
174	L	97.3	Very high	90.5	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	158.2	167.7	59.7	84.9	0	0	0	110.6	F151 L154 A159 L163 R176 S188 A246	F151-L174 HydrophobicContact CD1-CD2 4.31Å; F151-L174 HydrophobicContact CD2-CB 3.43Å; F151-L174 VanDerWaalsContact CD2-CB 3.43Å; F151-L174 HydrophobicContact CD2-CD2 4.42Å; F151-L174 HydrophobicContact CD2-CG 4.36Å; F151-L174 HydrophobicContact CE1-CD2 4.5Å; F151-L174 HydrophobicContact CE2-CB 3.59Å; F151-L174 HydrophobicContact CG-CB 4.06Å; F151-L174 HydrophobicContact CG-CD2 4.28Å; F151-L174 HydrophobicContact CZ-CB 4.33Å; L154-L174 HydrophobicContact CD2-CD1 4.24Å; L154-L174 HydrophobicContact CD2-CD2 3.91Å; A159-L174 HydrophobicContact CB-CD1 3.92Å; A159-L174 HydrophobicContact CB-CD2 4.13Å; L163-L174 HydrophobicContact CD1-CD2 4.27Å; L163-L174 HydrophobicContact CD1-CG 4.25Å; L163-L174 HydrophobicContact CD2-CD2 4.2Å; L163-L174 HydrophobicContact CD2-CG 4.42Å; L163-L174 HydrophobicContact CG-CD2 3.99Å; L163-L174 HydrophobicContact CG-CG 4.4Å; L174-R176 HydrophobicContact CD1-CB 4.21Å; L174-R176 HydrophobicContact CD1-CG 4.19Å; L174-S188 PolarHBondContact N-O 3.24Å; L174-S188 PolarHBondContact O-N 2.9Å; L174-A246 HydrophobicContact CB-CB 4.21Å; L174-A246 HydrophobicContact CD2-CB 3.92Å
175	I	96.9	Very high	90.7	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	138.8	168.2	-62.3	-176.4	0	0	0	109.1	W149 Y150 F151 Y185 S186 L187 I205 V228	W149-I175 HydrophobicContact CE3-CB 3.67Å; W149-I175 HydrophobicContact CE3-CD1 3.64Å; W149-I175 HydrophobicContact CE3-CG1 3.8Å; W149-I175 HydrophobicContact CH2-CD1 4.36Å; W149-I175 HydrophobicContact CZ3-CB 3.77Å; W149-I175 HydrophobicContact CZ3-CD1 3.51Å; W149-I175 HydrophobicContact CZ3-CG1 4.01Å; W149-I175 HydrophobicContact CZ3-CG2 4.12Å; W149-I175 PolarHBondContact O-N 3.15Å; Y150-I175 CarbonylContact C-O 3.49Å; Y150-I175 WeakPolarHBondContact CA-O 3.26Å; Y150-I175 HydrophobicContact CD2-CG2 4.17Å; F151-I175 PolarHBondContact N-O 2.78Å; I175-Y185 HydrophobicContact CG2-CD1 4.38Å; I175-Y185 HydrophobicContact CG2-CG 4.48Å; I175-S186 WeakPolarHBondContact CA-O 3.4Å; I175-L187 HydrophobicContact CD1-CD1 4.37Å; I175-L187 HydrophobicContact CG1-CB 4.44Å; I175-L187 HydrophobicContact CG1-CD1 3.83Å; I175-I205 HydrophobicContact CD1-CD1 3.79Å; I175-I205 HydrophobicContact CG1-CD1 4.19Å; I175-I205 HydrophobicContact CG2-CD1 4.05Å; I175-V228 HydrophobicContact CD1-CG2 3.54Å
176	R	95.6	Very high	91.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	164.8	-179.7	61.3	-169.1	-177.5	81.6	-1.5	110.4	G152 L154 R156 L174 E179 Y185 S186 S188	G152-R176 CarbonylContact O-C 3.3Å; G152-R176 WeakPolarHBondContact O-CA 3.49Å; L154-R176 HydrophobicContact CB-CB 4.28Å; L154-R176 WeakPolarHBondContact O-CD 3.37Å; R156-R176 VanDerWaalsContact CA-CZ 3.47Å; R156-R176 VanDerWaalsContact CB-NH2 3.3Å; L174-R176 HydrophobicContact CD1-CB 4.21Å; L174-R176 HydrophobicContact CD1-CG 4.19Å; R176-E179 IonicContact CZ-OE2 3.51Å; R176-E179 IonicContact NH1-OE2 3.7Å; R176-E179 PolarHBondContact NH1-OE2 3.26Å; R176-E179 IonicContact NH2-OE2 3.71Å; R176-Y185 CarbonylContact O-C 3.51Å; R176-Y185 WeakPolarHBondContact O-CA 3.4Å; R176-S186 PolarHBondContact N-O 3.44Å; R176-S186 PolarHBondContact O-N 3.27Å; R176-S188 PolarHBondContact NE-OG 2.84Å
177	E	94.6	Very high	92	Very high	70 Å²	70	42.5 Å²	42.5	33%	0.327	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	144.4	169.2	-66.9	-176.7	-154.1	0	0	110.2	Y150 G152 K153 E179	Y150-E177 VanDerWaalsContact OH-CG 3.31Å; Y150-E177 WeakPolarHBondContact OH-CG 3.36Å; Y150-E177 PolarHBondContact OH-OE1 2.97Å; G152-E177 PolarHBondContact O-N 3.32Å; K153-E177 VanDerWaalsContact CG-CD 3.48Å; K153-E177 HydrophobicContact CG-CG 4.41Å; K153-E177 WeakPolarHBondContact CG-OE1 3.39Å; K153-E177 WeakPolarHBondContact CG-OE2 3.45Å; E177-E179 PolarHBondContact O-N 3.17Å
178	S	91	Very high	92.6	Very high	10 Å²	10	39.5 Å²	39.5	7%	0.07	21%	0.208	C	C	.	.			trans	-79.1	121.4	175.4	-176.7	0	0	0	0	110.4	T180 T181 A184 Y528	S178-T180 VanDerWaalsContact C-N 3.26Å; S178-T180 PolarHBondContact O-N 3.42Å; S178-T180 PolarHBondContact OG-OG1 2.66Å; S178-T181 PolarHBondContact OG-N 3.35Å; S178-A184 VanDerWaalsContact CB-O 3.31Å; S178-A184 WeakPolarHBondContact CB-O 3.15Å; S178-A184 PolarHBondContact N-O 2.98Å; S178-Y528 PolarHBondContact OG-OH 3.44Å
179	E	86.7	Confident	92.9	Very high	114 Å²	114	38.8 Å²	38.8	53%	0.533	20%	0.204	S	C	.	.	S	Bend	trans	-67.9	-28.2	175	-68.5	152.9	124.1	0	0	112.4	G155 R156 R176 E177	G155-E179 WeakPolarHBondContact CA-OE1 3.47Å; R156-E179 WeakPolarHBondContact CB-OE2 3.33Å; R156-E179 VanDerWaalsContact N-CD 3.25Å; R156-E179 PolarHBondContact N-OE1 3.23Å; R156-E179 PolarHBondContact N-OE2 3.06Å; R176-E179 IonicContact CZ-OE2 3.51Å; R176-E179 IonicContact NH1-OE2 3.7Å; R176-E179 PolarHBondContact NH1-OE2 3.26Å; R176-E179 IonicContact NH2-OE2 3.71Å; E177-E179 PolarHBondContact O-N 3.17Å
180	T	84.1	Confident	93	Very high	74 Å²	74	37 Å²	37	45%	0.454	19%	0.19	S	C	.	.	S	Bend	trans	-91.5	-14.3	-175.9	60.1	0	0	0	0	113.3	S178 Y528	S178-T180 VanDerWaalsContact C-N 3.26Å; S178-T180 PolarHBondContact O-N 3.42Å; S178-T180 PolarHBondContact OG-OG1 2.66Å; T180-Y528 HydrophobicContact CG2-CE2 4.16Å; T180-Y528 WeakPolarHBondContact OG1-CE2 3.47Å; T180-Y528 PolarHBondContact OG1-OH 3.43Å
181	T	83.1	Confident	93	Very high	54 Å²	54	32.2 Å²	32.2	33%	0.331	17%	0.172	S	C	.	.	S	Bend	trans	-148.2	108.1	-176.6	-63.3	0	0	0	0	111.2	S178 G183 A184 K204	S178-T181 PolarHBondContact OG-N 3.35Å; T181-G183 PolarHBondContact O-N 2.93Å; T181-A184 HydrophobicContact CG2-CB 3.77Å; T181-A184 WeakPolarHBondContact O-CB 3Å; T181-A184 PolarHBondContact O-N 2.8Å; T181-K204 WeakPolarHBondContact OG1-CE 3.39Å; T181-K204 PolarHBondContact OG1-NZ 3.32Å
182	K	84.3	Confident	92.9	Very high	215 Å²	215	37.5 Å²	37.5	94%	0.935	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	127.8	179.4	-169.4	176.3	-177.4	179.1	0	111	A184	K182-A184 VanDerWaalsContact C-N 3.27Å; K182-A184 PolarHBondContact O-N 3.26Å
183	G	83.6	Confident	92.5	Very high	58 Å²	58	39.7 Å²	39.7	60%	0.598	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	80	-1.3	179.4	0	0	0	0	0	115.3	T181	T181-G183 PolarHBondContact O-N 2.93Å
184	A	89.8	Confident	92.1	Very high	8 Å²	8	46.2 Å²	46.2	7%	0.066	24%	0.239	C	C	.	.			trans	-94.6	166.1	168.8	0	0	0	0	0	111	S178 T181 K182	S178-A184 VanDerWaalsContact CB-O 3.31Å; S178-A184 WeakPolarHBondContact CB-O 3.15Å; S178-A184 PolarHBondContact N-O 2.98Å; T181-A184 HydrophobicContact CG2-CB 3.77Å; T181-A184 WeakPolarHBondContact O-CB 3Å; T181-A184 PolarHBondContact O-N 2.8Å; K182-A184 VanDerWaalsContact C-N 3.27Å; K182-A184 PolarHBondContact O-N 3.26Å
185	Y	95	Very high	91.4	Very high	38 Å²	38	54.7 Å²	54.7	15%	0.149	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	164.9	178.1	-58	-85.2	0	0	0	111	I144 Y150 I175 R176 I205 Y213 L224	I144-Y185 HydrophobicContact CD1-CE1 4.3Å; Y150-Y185 AromaticContact CE2-CD1 3.78Å; Y150-Y185 HydrophobicContact CE2-CD1 3.78Å; Y150-Y185 AromaticContact CE2-CE1 3.6Å; Y150-Y185 HydrophobicContact CE2-CE1 3.6Å; I175-Y185 HydrophobicContact CG2-CD1 4.38Å; I175-Y185 HydrophobicContact CG2-CG 4.48Å; R176-Y185 CarbonylContact O-C 3.51Å; R176-Y185 WeakPolarHBondContact O-CA 3.4Å; Y185-I205 PolarHBondContact N-O 3.08Å; Y185-I205 VanDerWaalsContact N-O 3.12Å; Y185-I205 PolarHBondContact O-N 3.49Å; Y185-Y213 HydrophobicContact CD2-CD1 4.38Å; Y185-Y213 HydrophobicContact CD2-CE1 4.02Å; Y185-Y213 AromaticContact CE2-CE1 3.74Å; Y185-Y213 HydrophobicContact CE2-CE1 3.74Å; Y185-L224 HydrophobicContact CD1-CD1 4.36Å; Y185-L224 HydrophobicContact CD2-CD1 3.65Å; Y185-L224 HydrophobicContact CE1-CD1 4.38Å; Y185-L224 HydrophobicContact CE2-CD1 3.68Å; Y185-L224 HydrophobicContact CG-CD1 3.99Å
186	S	96.8	Very high	90.7	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	125.6	174	-59.1	0	0	0	0	109.7	I175 R176 Y203 Y528	I175-S186 WeakPolarHBondContact CA-O 3.4Å; R176-S186 PolarHBondContact N-O 3.44Å; R176-S186 PolarHBondContact O-N 3.27Å; S186-Y203 CarbonylContact C-O 3.54Å; S186-Y203 WeakPolarHBondContact CA-O 3.2Å; S186-Y528 WeakPolarHBondContact OG-CE1 3.5Å; S186-Y528 PolarHBondContact OG-OH 3.2Å
187	L	97.3	Very high	90.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	125.3	168	173.5	62.9	0	0	0	108.4	F173 I175 I189 H202 Y203 I205 I215 L238 L242	F173-L187 HydrophobicContact CB-CD1 4.25Å; F173-L187 HydrophobicContact CD2-CD1 3.81Å; F173-L187 HydrophobicContact CG-CD1 4.45Å; I175-L187 HydrophobicContact CD1-CD1 4.37Å; I175-L187 HydrophobicContact CG1-CB 4.44Å; I175-L187 HydrophobicContact CG1-CD1 3.83Å; L187-I189 HydrophobicContact CD1-CG1 4.21Å; L187-I189 HydrophobicContact CD2-CD1 3.93Å; L187-I189 HydrophobicContact CD2-CG1 4.36Å; L187-I189 HydrophobicContact CG-CD1 4.04Å; L187-I189 HydrophobicContact CG-CG1 3.91Å; L187-H202 CarbonylContact O-C 3.59Å; L187-H202 WeakPolarHBondContact O-CA 3.33Å; L187-Y203 PolarHBondContact N-O 3.13Å; L187-Y203 PolarHBondContact O-N 2.91Å; L187-I205 HydrophobicContact CB-CD1 3.89Å; L187-I205 HydrophobicContact CB-CG1 4.2Å; L187-I215 HydrophobicContact CB-CD1 4.42Å; L187-I215 HydrophobicContact CD2-CD1 3.66Å; L187-L238 HydrophobicContact CD2-CD1 3.88Å; L187-L242 HydrophobicContact CD1-CD1 4.34Å; L187-L242 HydrophobicContact CD1-CD2 4.06Å; L187-L242 HydrophobicContact CD2-CD2 4.21Å
188	S	97.7	Very high	90.1	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129.3	178.9	-50.3	0	0	0	0	109.1	F173 L174 R176 K201 H202	F173-S188 WeakPolarHBondContact CA-O 3.3Å; F173-S188 WeakPolarHBondContact CB-O 3.44Å; L174-S188 PolarHBondContact N-O 3.24Å; L174-S188 PolarHBondContact O-N 2.9Å; R176-S188 PolarHBondContact NE-OG 2.84Å; S188-K201 WeakPolarHBondContact CA-O 3.26Å; S188-H202 WeakPolarHBondContact CB-ND1 3.44Å; S188-H202 PolarHBondContact OG-ND1 2.96Å
189	I	97.3	Very high	90.1	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	130.7	-172.4	-48.7	175.7	0	0	0	109.6	T172 F173 L187 V200 K201 Y203 L238 L242	T172-I189 CarbonylContact O-C 3.54Å; T172-I189 WeakPolarHBondContact O-CA 3.46Å; F173-I189 HydrophobicContact CB-CG1 4.24Å; L187-I189 HydrophobicContact CD1-CG1 4.21Å; L187-I189 HydrophobicContact CD2-CD1 3.93Å; L187-I189 HydrophobicContact CD2-CG1 4.36Å; L187-I189 HydrophobicContact CG-CD1 4.04Å; L187-I189 HydrophobicContact CG-CG1 3.91Å; I189-V200 WeakPolarHBondContact O-CA 3.38Å; I189-K201 PolarHBondContact N-O 2.91Å; I189-K201 PolarHBondContact O-N 3.33Å; I189-Y203 HydrophobicContact CD1-CD2 4Å; I189-Y203 HydrophobicContact CD1-CE2 3.76Å; I189-Y203 HydrophobicContact CG1-CD2 4.45Å; I189-Y203 HydrophobicContact CG1-CE2 4.34Å; I189-L238 HydrophobicContact CD1-CB 4.41Å; I189-L238 HydrophobicContact CD1-CD1 3.85Å; I189-L242 HydrophobicContact CD1-CD2 3.56Å; I189-L242 HydrophobicContact CG1-CD2 3.89Å
190	R	96.1	Very high	90.4	Very high	26 Å²	26	57.6 Å²	57.6	10%	0.098	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	127.2	168.8	-177.7	179.2	179.5	154.1	-11.4	110	L163 S165 N168 G171 T172 D198	L163-R190 HydrophobicContact CB-CB 4.41Å; L163-R190 WeakPolarHBondContact O-CD 3.37Å; L163-R190 PolarHBondContact O-NH1 2.75Å; S165-R190 PolarHBondContact O-NH1 3.1Å; N168-R190 PolarHBondContact O-NE 2.99Å; N168-R190 PolarHBondContact O-NH1 3.35Å; G171-R190 PolarHBondContact N-O 2.91Å; T172-R190 PolarHBondContact O-N 3.41Å; R190-D198 IonicContact CZ-OD1 2.82Å; R190-D198 IonicContact NE-OD1 3.74Å; R190-D198 PolarHBondContact NE-OD1 3.5Å; R190-D198 VanDerWaalsContact NE-OD1 3.1Å; R190-D198 IonicContact NH2-OD1 3.68Å; R190-D198 PolarHBondContact NH2-OD1 3.49Å; R190-D198 IonicContact NH2-OD2 3.61Å; R190-D198 PolarHBondContact NH2-OD2 3.42Å
191	D	94.9	Very high	90.9	Very high	3 Å²	3	56.1 Å²	56.1	2%	0.016	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	169.2	177.5	-161.3	19.8	0	0	0	110.6	R170 H199 K201 C239	R170-D191 IonicContact CZ-OD1 3.35Å; R170-D191 IonicContact NE-OD1 2.7Å; R170-D191 PolarHBondContact NE-OD1 3.2Å; R170-D191 IonicContact NH2-OD1 3.67Å; R170-D191 PolarHBondContact NH2-OD1 2.98Å; D191-H199 PolarHBondContact N-O 2.89Å; D191-H199 PolarHBondContact O-N 2.91Å; D191-H199 VanDerWaalsContact O-O 3.05Å; D191-H199 IonicContact OD2-NE2 2.73Å; D191-K201 HydrophobicContact CB-CD 4.38Å; D191-K201 WeakPolarHBondContact OD2-CE 3.28Å; D191-K201 IonicContact OD2-NZ 3.13Å; D191-K201 PolarHBondContact OD2-NZ 3.29Å; D191-C239 VanDerWaalsContact OD2-CB 3.28Å; D191-C239 WeakPolarHBondContact OD2-CB 3.42Å
192	W	92.9	Very high	91.4	Very high	110 Å²	110	53.8 Å²	53.8	42%	0.417	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	138	176.6	179.4	96	0	0	0	110.3	D194 G197	W192-D194 WeakPolarHBondContact CH2-OD1 3.33Å; W192-G197 WeakPolarHBondContact CA-O 3.43Å; W192-G197 VanDerWaalsContact CD1-C 3.44Å
193	D	90.1	Very high	91.9	Very high	46 Å²	46	43.8 Å²	43.8	25%	0.246	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	163	169.2	71.5	56.9	0	0	0	112.2	M195 K196 G197 H199	D193-M195 PolarHBondContact O-N 3.22Å; D193-M195 WeakPolarHBondContact OD1-CA 3.36Å; D193-M195 WeakPolarHBondContact OD1-CB 3.39Å; D193-M195 PolarHBondContact OD1-N 3.2Å; D193-K196 WeakPolarHBondContact OD1-CB 3.45Å; D193-K196 PolarHBondContact OD1-N 3.44Å; D193-G197 PolarHBondContact N-O 3.02Å; D193-G197 VanDerWaalsContact O-CA 3.24Å; D193-G197 WeakPolarHBondContact O-CA 3.12Å; D193-G197 PolarHBondContact O-N 2.91Å; D193-H199 IonicContact OD2-CE1 2.83Å; D193-H199 PolarHBondContact OD2-CE1 3.15Å; D193-H199 IonicContact OD2-ND1 3.47Å; D193-H199 IonicContact OD2-NE2 3.71Å
194	D	88.3	Confident	92.4	Very high	145 Å²	145	43 Å²	43	78%	0.775	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-24.2	-176	-68	-52.6	0	0	0	114	W192	W192-D194 WeakPolarHBondContact CH2-OD1 3.33Å
195	M	83.9	Confident	92.6	Very high	177 Å²	177	42.7 Å²	42.7	87%	0.872	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	-41.3	-174.1	-69.5	-68.1	-63.1	0	0	111.9	D193	D193-M195 PolarHBondContact O-N 3.22Å; D193-M195 WeakPolarHBondContact OD1-CA 3.36Å; D193-M195 WeakPolarHBondContact OD1-CB 3.39Å; D193-M195 PolarHBondContact OD1-N 3.2Å
196	K	80.8	Confident	92.2	Very high	105 Å²	105	47.1 Å²	47.1	46%	0.457	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-20	-173	-60	-175.5	-175.3	-174.4	0	112.9	D193 E525	D193-K196 WeakPolarHBondContact OD1-CB 3.45Å; D193-K196 PolarHBondContact OD1-N 3.44Å; K196-E525 WeakPolarHBondContact CE-OE1 3.48Å; K196-E525 IonicContact NZ-OE1 2.71Å; K196-E525 PolarHBondContact NZ-OE1 2.87Å; K196-E525 IonicContact NZ-OE2 2.7Å; K196-E525 PolarHBondContact NZ-OE2 2.79Å
197	G	88.5	Confident	91.8	Very high	23 Å²	23	52.8 Å²	52.8	24%	0.237	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	68.2	-147.5	-167	0	0	0	0	0	111.5	W192 D193 H199	W192-G197 WeakPolarHBondContact CA-O 3.43Å; W192-G197 VanDerWaalsContact CD1-C 3.44Å; D193-G197 PolarHBondContact N-O 3.02Å; D193-G197 VanDerWaalsContact O-CA 3.24Å; D193-G197 WeakPolarHBondContact O-CA 3.12Å; D193-G197 PolarHBondContact O-N 2.91Å; G197-H199 PolarHBondContact O-N 3.38Å; G197-H199 PolarHBondContact O-ND1 3.1Å
198	D	89.8	Confident	91.3	Very high	83 Å²	83	54.7 Å²	54.7	44%	0.444	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	126.7	176.6	-73.8	-72.4	0	0	0	111.3	L164 R190	L164-D198 HydrophobicContact CD2-CB 3.93Å; R190-D198 IonicContact CZ-OD1 2.82Å; R190-D198 IonicContact NE-OD1 3.74Å; R190-D198 PolarHBondContact NE-OD1 3.5Å; R190-D198 VanDerWaalsContact NE-OD1 3.1Å; R190-D198 IonicContact NH2-OD1 3.68Å; R190-D198 PolarHBondContact NH2-OD1 3.49Å; R190-D198 IonicContact NH2-OD2 3.61Å; R190-D198 PolarHBondContact NH2-OD2 3.42Å
199	H	90.8	Very high	90.6	Very high	25 Å²	25	63.3 Å²	63.3	12%	0.116	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	177.7	177.6	63.1	-80	0	0	0	110.7	D191 D193 G197 K201	D191-H199 PolarHBondContact N-O 2.89Å; D191-H199 PolarHBondContact O-N 2.91Å; D191-H199 VanDerWaalsContact O-O 3.05Å; D191-H199 IonicContact OD2-NE2 2.73Å; D193-H199 IonicContact OD2-CE1 2.83Å; D193-H199 PolarHBondContact OD2-CE1 3.15Å; D193-H199 IonicContact OD2-ND1 3.47Å; D193-H199 IonicContact OD2-NE2 3.71Å; G197-H199 PolarHBondContact O-N 3.38Å; G197-H199 PolarHBondContact O-ND1 3.1Å; H199-K201 WeakPolarHBondContact NE2-CE 3.33Å
200	V	93.9	Very high	90	Very high	19 Å²	19	69.7 Å²	69.7	12%	0.115	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	135	179.6	177	0	0	0	0	109.7	E160 L163 L164 I189	E160-V200 HydrophobicContact CG-CB 4.06Å; E160-V200 HydrophobicContact CG-CG1 4.3Å; E160-V200 HydrophobicContact CG-CG2 4.42Å; L163-V200 HydrophobicContact CB-CG2 3.78Å; L163-V200 HydrophobicContact CD1-CG1 3.59Å; L163-V200 HydrophobicContact CD1-CG2 4.13Å; L164-V200 HydrophobicContact CD1-CG2 4.3Å; L164-V200 HydrophobicContact CD2-CG2 4.01Å; L164-V200 HydrophobicContact CG-CG2 3.82Å; I189-V200 WeakPolarHBondContact O-CA 3.38Å
201	K	93.8	Very high	89.2	Confident	44 Å²	44	70.1 Å²	70.1	19%	0.191	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	139.1	173.3	-76.2	174.1	176.5	160.3	0	110.3	S188 I189 D191 H199 Y203 C239 Q529	S188-K201 WeakPolarHBondContact CA-O 3.26Å; I189-K201 PolarHBondContact N-O 2.91Å; I189-K201 PolarHBondContact O-N 3.33Å; D191-K201 HydrophobicContact CB-CD 4.38Å; D191-K201 WeakPolarHBondContact OD2-CE 3.28Å; D191-K201 IonicContact OD2-NZ 3.13Å; D191-K201 PolarHBondContact OD2-NZ 3.29Å; H199-K201 WeakPolarHBondContact NE2-CE 3.33Å; K201-Y203 HydrophobicContact CB-CE2 3.86Å; K201-C239 HydrophobicContact CD-CB 3.43Å; K201-C239 VanDerWaalsContact CD-CB 3.43Å; K201-Q529 HydrophobicContact CB-CG 4.31Å; K201-Q529 HydrophobicContact CG-CG 4.38Å
202	H	94.8	Very high	89	Confident	4 Å²	4	70.3 Å²	70.3	2%	0.019	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	130.5	178.9	-53.9	-82	0	0	0	110.8	R156 E160 L187 S188 Y528 Q529	R156-H202 PolarHBondContact NE-CD2 3.33Å; R156-H202 VanDerWaalsContact NE-CD2 3.32Å; R156-H202 PolarHBondContact NE-NE2 3.33Å; E160-H202 IonicContact OE1-NE2 2.74Å; E160-H202 PolarHBondContact OE1-NE2 3.49Å; E160-H202 VanDerWaalsContact OE1-NE2 3.11Å; L187-H202 CarbonylContact O-C 3.59Å; L187-H202 WeakPolarHBondContact O-CA 3.33Å; S188-H202 WeakPolarHBondContact CB-ND1 3.44Å; S188-H202 PolarHBondContact OG-ND1 2.96Å; H202-Y528 HydrophobicContact CB-CD1 4.08Å; H202-Y528 HydrophobicContact CB-CE1 4.21Å; H202-Q529 PolarHBondContact O-N 2.65Å
203	Y	94.3	Very high	89.1	Confident	5 Å²	5	66.6 Å²	66.6	2%	0.02	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.5	176.7	-57.8	-93.2	0	0	0	108.6	S186 L187 I189 K201 I205 I215 L238 C239 Q529 L534	S186-Y203 CarbonylContact C-O 3.54Å; S186-Y203 WeakPolarHBondContact CA-O 3.2Å; L187-Y203 PolarHBondContact N-O 3.13Å; L187-Y203 PolarHBondContact O-N 2.91Å; I189-Y203 HydrophobicContact CD1-CD2 4Å; I189-Y203 HydrophobicContact CD1-CE2 3.76Å; I189-Y203 HydrophobicContact CG1-CD2 4.45Å; I189-Y203 HydrophobicContact CG1-CE2 4.34Å; K201-Y203 HydrophobicContact CB-CE2 3.86Å; Y203-I205 PolarHBondContact O-N 3.46Å; Y203-I215 HydrophobicContact CD1-CG2 4.2Å; Y203-I215 HydrophobicContact CG-CG2 4.48Å; Y203-L238 HydrophobicContact CD1-CD2 3.52Å; Y203-L238 HydrophobicContact CD2-CD2 3.92Å; Y203-L238 HydrophobicContact CE1-CD2 3.58Å; Y203-L238 HydrophobicContact CE2-CD2 3.99Å; Y203-L238 HydrophobicContact CG-CD2 3.7Å; Y203-C239 WeakPolarHBondContact OH-CB 3.32Å; Y203-C239 PolarHBondContact OH-N 3.43Å; Y203-C239 PolarHBondContact OH-SG 3.03Å; Y203-Q529 HydrophobicContact CD1-CB 3.81Å; Y203-Q529 HydrophobicContact CD1-CG 4.44Å; Y203-Q529 HydrophobicContact CE1-CB 3.56Å; Y203-Q529 HydrophobicContact CE1-CG 3.92Å; Y203-L534 HydrophobicContact CD1-CD1 4.12Å; Y203-L534 HydrophobicContact CE1-CD1 4.08Å
204	K	93	Very high	89.1	Confident	43 Å²	43	66.3 Å²	66.3	19%	0.187	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	122.4	178.3	-170.4	171.2	-174.8	170.9	0	109.1	T181 R206 Y528	T181-K204 WeakPolarHBondContact OG1-CE 3.39Å; T181-K204 PolarHBondContact OG1-NZ 3.32Å; K204-R206 HydrophobicContact CG-CG 4.42Å; K204-Y528 HydrophobicContact CB-CD1 3.75Å; K204-Y528 HydrophobicContact CB-CE1 3.93Å; K204-Y528 HydrophobicContact CB-CG 4.24Å; K204-Y528 HydrophobicContact CG-CE1 4.48Å
205	I	93.9	Very high	89.2	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	115.8	172.1	-55.3	159.4	0	0	0	107.6	I175 Y185 L187 Y203 Y213 Y214 I215 L224 L227	I175-I205 HydrophobicContact CD1-CD1 3.79Å; I175-I205 HydrophobicContact CG1-CD1 4.19Å; I175-I205 HydrophobicContact CG2-CD1 4.05Å; Y185-I205 PolarHBondContact N-O 3.08Å; Y185-I205 VanDerWaalsContact N-O 3.12Å; Y185-I205 PolarHBondContact O-N 3.49Å; L187-I205 HydrophobicContact CB-CD1 3.89Å; L187-I205 HydrophobicContact CB-CG1 4.2Å; Y203-I205 PolarHBondContact O-N 3.46Å; I205-Y213 HydrophobicContact CG2-CD1 4.23Å; I205-Y214 WeakPolarHBondContact CA-O 3.23Å; I205-I215 HydrophobicContact CG1-CD1 4.15Å; I205-I215 HydrophobicContact CG1-CG1 3.83Å; I205-L224 HydrophobicContact CD1-CD2 4.09Å; I205-L224 HydrophobicContact CG2-CD2 3.7Å; I205-L227 HydrophobicContact CD1-CD2 4.44Å; I205-L227 HydrophobicContact CG1-CD1 4.31Å; I205-L227 HydrophobicContact CG2-CD1 3.82Å
206	R	88.1	Confident	89.3	Confident	132 Å²	132	51.9 Å²	51.9	50%	0.498	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	147.5	179.8	-64.3	-179.8	-178.3	-132.5	4.4	109.8	K204 Y213 Y214	K204-R206 HydrophobicContact CG-CG 4.42Å; R206-Y213 VanDerWaalsContact O-CA 3.31Å; R206-Y213 WeakPolarHBondContact O-CA 3.26Å; R206-Y214 HydrophobicContact CB-CD1 4.14Å; R206-Y214 HydrophobicContact CB-CE1 3.6Å; R206-Y214 HydrophobicContact CB-CE2 4.15Å; R206-Y214 WeakPolarHBondContact CD-OH 3.28Å; R206-Y214 PolarHBondContact N-O 3.29Å; R206-Y214 PolarHBondContact O-N 2.83Å
207	K	87.9	Confident	89.4	Confident	118 Å²	118	50.9 Å²	50.9	51%	0.513	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	135.7	171.7	-165.9	173.1	-177.7	173.8	0	109.2	G212 Y213	K207-G212 CarbonylContact C-O 3.5Å; K207-G212 WeakPolarHBondContact CA-O 3.41Å; K207-Y213 HydrophobicContact CB-CD1 4.42Å; K207-Y213 HydrophobicContact CB-CE1 4.26Å; K207-Y213 HydrophobicContact CD-CE1 4.14Å; K207-Y213 HydrophobicContact CG-CD1 4.4Å; K207-Y213 HydrophobicContact CG-CE1 3.96Å
208	L	85.9	Confident	89.2	Confident	40 Å²	40	58.9 Å²	58.9	21%	0.209	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-83.5	151.8	171.6	-65.8	164.6	0	0	0	109.9	N210 G211 G212 Y214 Q220	L208-N210 WeakPolarHBondContact CB-OD1 3.34Å; L208-N210 PolarHBondContact O-N 3.23Å; L208-N210 VanDerWaalsContact O-N 3.17Å; L208-G211 PolarHBondContact O-N 2.68Å; L208-G212 PolarHBondContact N-O 3.28Å; L208-Y214 HydrophobicContact CD1-CD1 4.24Å; L208-Y214 HydrophobicContact CD2-CD1 3.7Å; L208-Y214 HydrophobicContact CD2-CE1 3.38Å; L208-Y214 HydrophobicContact CG-CD1 3.68Å; L208-Y214 HydrophobicContact CG-CE1 3.78Å; L208-Q220 HydrophobicContact CD1-CB 4.3Å; L208-Q220 HydrophobicContact CD1-CG 4.23Å
209	D	84.8	Confident	89.2	Confident	181 Å²	181	55.5 Å²	55.5	97%	0.968	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-27.5	178.4	-62	-27.5	0	0	0	112.5	G211	D209-G211 VanDerWaalsContact C-N 3.33Å
210	N	84.3	Confident	89.3	Confident	134 Å²	134	59.6 Å²	59.6	72%	0.717	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	4.1	177.8	69.1	-7.8	0	0	0	114.4	L208	L208-N210 WeakPolarHBondContact CB-OD1 3.34Å; L208-N210 PolarHBondContact O-N 3.23Å; L208-N210 VanDerWaalsContact O-N 3.17Å
211	G	79.7	Confident	89.4	Confident	36 Å²	36	59.8 Å²	59.8	37%	0.371	29%	0.29	S	S	.	.	S	Bend	trans	102.5	0.2	172.2	0	0	0	0	0	117	L208 D209	L208-G211 PolarHBondContact O-N 2.68Å; D209-G211 VanDerWaalsContact C-N 3.33Å
212	G	90.1	Very high	89.4	Confident	7 Å²	7	64.6 Å²	64.6	7%	0.072	31%	0.314	C	S	.	.			trans	-91.5	179.1	176.9	0	0	0	0	0	115.4	K207 L208 F221	K207-G212 CarbonylContact C-O 3.5Å; K207-G212 WeakPolarHBondContact CA-O 3.41Å; L208-G212 PolarHBondContact N-O 3.28Å; G212-F221 CarbonylContact C-O 3.57Å; G212-F221 WeakPolarHBondContact CA-O 3.3Å
213	Y	93.6	Very high	89.3	Confident	32 Å²	32	66.9 Å²	66.9	13%	0.125	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	146.9	-176.3	-59.1	-83.3	0	0	0	112	Y185 I205 R206 K207 F221 L224	Y185-Y213 HydrophobicContact CD2-CD1 4.38Å; Y185-Y213 HydrophobicContact CD2-CE1 4.02Å; Y185-Y213 AromaticContact CE2-CE1 3.74Å; Y185-Y213 HydrophobicContact CE2-CE1 3.74Å; I205-Y213 HydrophobicContact CG2-CD1 4.23Å; R206-Y213 VanDerWaalsContact O-CA 3.31Å; R206-Y213 WeakPolarHBondContact O-CA 3.26Å; K207-Y213 HydrophobicContact CB-CD1 4.42Å; K207-Y213 HydrophobicContact CB-CE1 4.26Å; K207-Y213 HydrophobicContact CD-CE1 4.14Å; K207-Y213 HydrophobicContact CG-CD1 4.4Å; K207-Y213 HydrophobicContact CG-CE1 3.96Å; Y213-F221 PolarHBondContact N-O 3.18Å; Y213-F221 PolarHBondContact O-N 3.49Å; Y213-L224 HydrophobicContact CD1-CD1 4.3Å; Y213-L224 HydrophobicContact CD1-CD2 3.83Å; Y213-L224 HydrophobicContact CD1-CG 3.96Å; Y213-L224 HydrophobicContact CD2-CD2 4.34Å; Y213-L224 HydrophobicContact CD2-CG 3.99Å; Y213-L224 HydrophobicContact CE1-CD1 4.13Å; Y213-L224 HydrophobicContact CE1-CD2 4.46Å; Y213-L224 HydrophobicContact CE1-CG 4.16Å; Y213-L224 HydrophobicContact CE2-CG 4.18Å; Y213-L224 HydrophobicContact CG-CD2 3.75Å; Y213-L224 HydrophobicContact CG-CG 3.87Å
214	Y	91.8	Very high	89.4	Confident	39 Å²	39	66.8 Å²	66.8	15%	0.153	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	157.5	174.7	69.6	-79.9	0	0	0	112.4	I205 R206 L208 T217 A219	I205-Y214 WeakPolarHBondContact CA-O 3.23Å; R206-Y214 HydrophobicContact CB-CD1 4.14Å; R206-Y214 HydrophobicContact CB-CE1 3.6Å; R206-Y214 HydrophobicContact CB-CE2 4.15Å; R206-Y214 WeakPolarHBondContact CD-OH 3.28Å; R206-Y214 PolarHBondContact N-O 3.29Å; R206-Y214 PolarHBondContact O-N 2.83Å; L208-Y214 HydrophobicContact CD1-CD1 4.24Å; L208-Y214 HydrophobicContact CD2-CD1 3.7Å; L208-Y214 HydrophobicContact CD2-CE1 3.38Å; L208-Y214 HydrophobicContact CG-CD1 3.68Å; L208-Y214 HydrophobicContact CG-CE1 3.78Å; Y214-T217 HydrophobicContact CD2-CG2 4.25Å; Y214-T217 HydrophobicContact CE2-CG2 3.77Å; Y214-A219 WeakPolarHBondContact CB-O 3.41Å
215	I	90.3	Very high	89.5	Confident	11 Å²	11	68 Å²	68	6%	0.056	33%	0.334	C	S	.	.	S	Bend	trans	-103.1	-49.7	166.3	-66.3	172.8	0	0	0	109.2	L187 Y203 I205 L227 Y231 L238 L534	L187-I215 HydrophobicContact CB-CD1 4.42Å; L187-I215 HydrophobicContact CD2-CD1 3.66Å; Y203-I215 HydrophobicContact CD1-CG2 4.2Å; Y203-I215 HydrophobicContact CG-CG2 4.48Å; I205-I215 HydrophobicContact CG1-CD1 4.15Å; I205-I215 HydrophobicContact CG1-CG1 3.83Å; I215-L227 HydrophobicContact CD1-CD2 4.38Å; I215-L227 HydrophobicContact CG1-CD1 4.34Å; I215-Y231 HydrophobicContact CD1-CD2 4.38Å; I215-Y231 HydrophobicContact CD1-CE2 3.82Å; I215-Y231 HydrophobicContact CG1-CE2 4.49Å; I215-L238 HydrophobicContact CD1-CD2 4.13Å; I215-L238 HydrophobicContact CG2-CD2 4.49Å; I215-L534 HydrophobicContact CG2-CD1 4.28Å
216	T	85.3	Confident	89.5	Confident	8 Å²	8	72 Å²	72	5%	0.049	35%	0.353	C	S	.	.	S	Bend	trans	-110.4	145.1	170.6	175.5	0	0	0	0	109.7	R218 A219	T216-R218 HydrophobicContact CG2-CB 4.32Å; T216-R218 PolarHBondContact O-N 3.23Å; T216-R218 VanDerWaalsContact O-N 3.13Å; T216-A219 HydrophobicContact CG2-CB 4.11Å; T216-A219 PolarHBondContact O-N 3.49Å
217	T	82.8	Confident	90	Very high	84 Å²	84	65.7 Å²	65.7	52%	0.515	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-16.7	-179.2	51.9	0	0	0	0	113.2	Y214 Q220	Y214-T217 HydrophobicContact CD2-CG2 4.25Å; Y214-T217 HydrophobicContact CE2-CG2 3.77Å; T217-Q220 PolarHBondContact O-NE2 3.05Å; T217-Q220 VanDerWaalsContact O-NE2 3.08Å
218	R	85.4	Confident	90.4	Very high	192 Å²	192	60.6 Å²	60.6	73%	0.725	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-24.5	177	-60.6	175.9	-177.4	167	-2.1	113.5	T216 L534	T216-R218 HydrophobicContact CG2-CB 4.32Å; T216-R218 PolarHBondContact O-N 3.23Å; T216-R218 VanDerWaalsContact O-N 3.13Å; R218-L534 PolarHBondContact NH1-O 2.87Å
219	A	88.8	Confident	90.9	Very high	11 Å²	11	64 Å²	64	9%	0.091	32%	0.322	C	S	.	.	S	Bend	trans	-131.7	105.5	-177.1	0	0	0	0	0	109.8	Y214 T216 F221	Y214-A219 WeakPolarHBondContact CB-O 3.41Å; T216-A219 HydrophobicContact CG2-CB 4.11Å; T216-A219 PolarHBondContact O-N 3.49Å; A219-F221 HydrophobicContact CB-CE2 4.13Å; A219-F221 HydrophobicContact CB-CZ 4Å
220	Q	93.6	Very high	91.5	Very high	112 Å²	112	57.2 Å²	57.2	52%	0.523	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	143.6	-177.8	-59	174.7	26.9	0	0	109.6	L208 T217	L208-Q220 HydrophobicContact CD1-CB 4.3Å; L208-Q220 HydrophobicContact CD1-CG 4.23Å; T217-Q220 PolarHBondContact O-NE2 3.05Å; T217-Q220 VanDerWaalsContact O-NE2 3.08Å
221	F	95.1	Very high	92.1	Very high	22 Å²	22	50.9 Å²	50.9	10%	0.096	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	146.8	-174.4	-52.8	-80.2	0	0	0	109.7	G212 Y213 A219 Q226 L227 H230 Y231	G212-F221 CarbonylContact C-O 3.57Å; G212-F221 WeakPolarHBondContact CA-O 3.3Å; Y213-F221 PolarHBondContact N-O 3.18Å; Y213-F221 PolarHBondContact O-N 3.49Å; A219-F221 HydrophobicContact CB-CE2 4.13Å; A219-F221 HydrophobicContact CB-CZ 4Å; F221-Q226 HydrophobicContact CB-CB 4.1Å; F221-Q226 HydrophobicContact CD1-CB 4.14Å; F221-L227 HydrophobicContact CB-CB 4.14Å; F221-L227 HydrophobicContact CD2-CB 3.59Å; F221-L227 HydrophobicContact CD2-CD1 3.84Å; F221-L227 HydrophobicContact CD2-CG 3.74Å; F221-L227 HydrophobicContact CE2-CB 4.11Å; F221-L227 HydrophobicContact CE2-CD1 4.22Å; F221-L227 HydrophobicContact CE2-CG 3.9Å; F221-L227 HydrophobicContact CG-CB 3.81Å; F221-L227 HydrophobicContact CG-CG 4.46Å; 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 3.8Å; F221-H230 HydrophobicContact CZ-CB 3.77Å; F221-H230 AromaticContact CZ-CD2 3.62Å; F221-H230 AromaticContact CZ-CG 3.56Å; F221-H230 AromaticContact CZ-ND1 3.96Å; F221-Y231 AromaticContact CE2-CE2 3.99Å; F221-Y231 HydrophobicContact CE2-CE2 3.99Å; F221-Y231 HydrophobicContact CZ-CE2 4.28Å
222	E	94.3	Very high	92.9	Very high	146 Å²	146	50.9 Å²	50.9	68%	0.682	25%	0.246	S	C	*	.	S	Bend	trans	-75.1	-33.4	176.5	-62	178	162.3	0	0	110.8
223	T	93.6	Very high	93.2	Very high	51 Å²	51	57.3 Å²	57.3	31%	0.313	27%	0.274	S	S	.	.	S	Bend	trans	-132.1	160.3	-178.1	73	0	0	0	0	111.9	Q225 Q226 L227	T223-Q225 VanDerWaalsContact C-N 3.29Å; T223-Q225 PolarHBondContact O-N 2.9Å; T223-Q225 PolarHBondContact OG1-OE1 2.84Å; T223-Q226 PolarHBondContact O-N 2.81Å; T223-Q226 WeakPolarHBondContact OG1-CG 3.24Å; T223-Q226 PolarHBondContact OG1-N 3.36Å; T223-L227 PolarHBondContact O-N 2.96Å
224	L	94.4	Very high	93.2	Very high	4 Å²	4	60.2 Å²	60.2	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-69.9	-28.5	175.8	-74	171	0	0	0	112.2	I144 W149 Y185 I205 Y213 L227 V228	I144-L224 HydrophobicContact CD1-CB 4.15Å; I144-L224 HydrophobicContact CD1-CD1 3.16Å; I144-L224 HydrophobicContact CD1-CG 4.24Å; W149-L224 HydrophobicContact CH2-CB 3.61Å; W149-L224 HydrophobicContact CZ2-CB 4.47Å; W149-L224 HydrophobicContact CZ3-CB 4.32Å; Y185-L224 HydrophobicContact CD1-CD1 4.36Å; Y185-L224 HydrophobicContact CD2-CD1 3.65Å; Y185-L224 HydrophobicContact CE1-CD1 4.38Å; Y185-L224 HydrophobicContact CE2-CD1 3.68Å; Y185-L224 HydrophobicContact CG-CD1 3.99Å; I205-L224 HydrophobicContact CD1-CD2 4.09Å; I205-L224 HydrophobicContact CG2-CD2 3.7Å; Y213-L224 HydrophobicContact CD1-CD1 4.3Å; Y213-L224 HydrophobicContact CD1-CD2 3.83Å; Y213-L224 HydrophobicContact CD1-CG 3.96Å; Y213-L224 HydrophobicContact CD2-CD2 4.34Å; Y213-L224 HydrophobicContact CD2-CG 3.99Å; Y213-L224 HydrophobicContact CE1-CD1 4.13Å; Y213-L224 HydrophobicContact CE1-CD2 4.46Å; Y213-L224 HydrophobicContact CE1-CG 4.16Å; Y213-L224 HydrophobicContact CE2-CG 4.18Å; Y213-L224 HydrophobicContact CG-CD2 3.75Å; Y213-L224 HydrophobicContact CG-CG 3.87Å; L224-L227 HydrophobicContact CD2-CD1 4.27Å; L224-L227 WeakPolarHBondContact O-CB 3.41Å; L224-L227 PolarHBondContact O-N 2.85Å; L224-V228 WeakPolarHBondContact O-CG2 3.43Å; L224-V228 PolarHBondContact O-N 3.24Å
225	Q	95.1	Very high	93.2	Very high	69 Å²	69	59.9 Å²	59.9	32%	0.322	29%	0.292	S	S	.	.	H	α-helix	trans	-59.7	-45.4	172.1	-66.1	80.6	-6.4	0	0	111.3	E147 W149 T223 L227 V228 Q229	E147-Q225 VanDerWaalsContact OE1-CG 3.28Å; E147-Q225 WeakPolarHBondContact OE1-CG 3.38Å; E147-Q225 PolarHBondContact OE1-NE2 3.5Å; W149-Q225 HydrophobicContact CZ2-CG 4.14Å; T223-Q225 VanDerWaalsContact C-N 3.29Å; T223-Q225 PolarHBondContact O-N 2.9Å; T223-Q225 PolarHBondContact OG1-OE1 2.84Å; Q225-L227 VanDerWaalsContact C-N 3.33Å; Q225-L227 PolarHBondContact O-N 3.43Å; Q225-V228 PolarHBondContact O-N 2.89Å; Q225-Q229 WeakPolarHBondContact O-CB 3.43Å; Q225-Q229 PolarHBondContact O-N 3.15Å
226	Q	95.9	Very high	93.3	Very high	82 Å²	82	62.4 Å²	62.4	38%	0.383	31%	0.306	S	S	.	.	H	α-helix	trans	-63.2	-40.5	176.1	-72.7	173.4	-0.4	0	0	111.6	F221 T223 Q229 H230	F221-Q226 HydrophobicContact CB-CB 4.1Å; F221-Q226 HydrophobicContact CD1-CB 4.14Å; T223-Q226 PolarHBondContact O-N 2.81Å; T223-Q226 WeakPolarHBondContact OG1-CG 3.24Å; T223-Q226 PolarHBondContact OG1-N 3.36Å; Q226-Q229 PolarHBondContact O-N 2.83Å; Q226-H230 WeakPolarHBondContact O-CB 3.49Å; Q226-H230 PolarHBondContact O-N 2.94Å
227	L	96.6	Very high	93.4	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59.8	-48.1	175	-177.1	154.9	0	0	0	111.2	I205 I215 F221 T223 L224 Q225 H230 Y231	I205-L227 HydrophobicContact CD1-CD2 4.44Å; I205-L227 HydrophobicContact CG1-CD1 4.31Å; I205-L227 HydrophobicContact CG2-CD1 3.82Å; I215-L227 HydrophobicContact CD1-CD2 4.38Å; I215-L227 HydrophobicContact CG1-CD1 4.34Å; F221-L227 HydrophobicContact CB-CB 4.14Å; F221-L227 HydrophobicContact CD2-CB 3.59Å; F221-L227 HydrophobicContact CD2-CD1 3.84Å; F221-L227 HydrophobicContact CD2-CG 3.74Å; F221-L227 HydrophobicContact CE2-CB 4.11Å; F221-L227 HydrophobicContact CE2-CD1 4.22Å; F221-L227 HydrophobicContact CE2-CG 3.9Å; F221-L227 HydrophobicContact CG-CB 3.81Å; F221-L227 HydrophobicContact CG-CG 4.46Å; T223-L227 PolarHBondContact O-N 2.96Å; L224-L227 HydrophobicContact CD2-CD1 4.27Å; L224-L227 WeakPolarHBondContact O-CB 3.41Å; L224-L227 PolarHBondContact O-N 2.85Å; Q225-L227 VanDerWaalsContact C-N 3.33Å; Q225-L227 PolarHBondContact O-N 3.43Å; L227-H230 PolarHBondContact O-N 2.87Å; L227-Y231 HydrophobicContact CD2-CD2 3.74Å; L227-Y231 HydrophobicContact CD2-CE2 4.09Å; L227-Y231 HydrophobicContact CG-CD2 3.9Å; L227-Y231 HydrophobicContact CG-CE2 3.91Å; L227-Y231 VanDerWaalsContact O-CD2 3.24Å; L227-Y231 WeakPolarHBondContact O-CD2 3.49Å; L227-Y231 PolarHBondContact O-N 2.92Å; L227-Y231 VanDerWaalsContact O-N 3.12Å
228	V	96.9	Very high	93.9	Very high	11 Å²	11	60 Å²	60	7%	0.067	30%	0.297	C	S	.	.	H	α-helix	trans	-63.7	-44.3	179.2	171.2	0	0	0	0	111	W149 F173 I175 L224 Q225 H230 Y231 S232 L242	W149-V228 HydrophobicContact CD2-CG2 3.91Å; W149-V228 HydrophobicContact CE3-CG2 4.11Å; W149-V228 HydrophobicContact CG-CG1 4.49Å; W149-V228 HydrophobicContact CG-CG2 4.46Å; W149-V228 HydrophobicContact CH2-CG2 4.36Å; W149-V228 HydrophobicContact CZ2-CG2 4.14Å; W149-V228 HydrophobicContact CZ3-CG2 4.35Å; F173-V228 HydrophobicContact CE2-CG1 3.81Å; F173-V228 HydrophobicContact CE2-CG2 4.28Å; F173-V228 HydrophobicContact CZ-CG1 3.7Å; I175-V228 HydrophobicContact CD1-CG2 3.54Å; L224-V228 WeakPolarHBondContact O-CG2 3.43Å; L224-V228 PolarHBondContact O-N 3.24Å; Q225-V228 PolarHBondContact O-N 2.89Å; V228-H230 PolarHBondContact O-N 3.01Å; V228-Y231 PolarHBondContact O-N 3.19Å; V228-S232 WeakPolarHBondContact O-CB 3.32Å; V228-S232 PolarHBondContact O-N 3.29Å; V228-S232 PolarHBondContact O-OG 2.91Å; V228-L242 HydrophobicContact CG1-CD1 4.25Å
229	Q	96.6	Very high	94.3	Very high	111 Å²	111	52 Å²	52	52%	0.519	27%	0.27	S	S	.	.	H	α-helix	trans	-58.1	-49.1	178.2	-178.2	62.5	28.4	0	0	111.4	Q225 Q226 Y231 S232 E233	Q225-Q229 WeakPolarHBondContact O-CB 3.43Å; Q225-Q229 PolarHBondContact O-N 3.15Å; Q226-Q229 PolarHBondContact O-N 2.83Å; Q229-Y231 PolarHBondContact O-N 3.42Å; Q229-S232 WeakPolarHBondContact O-CB 3.25Å; Q229-S232 PolarHBondContact O-N 3.46Å; Q229-E233 PolarHBondContact NE2-OE1 3.38Å; Q229-E233 PolarHBondContact O-N 3.36Å
230	H	96.9	Very high	94.6	Very high	39 Å²	39	54.4 Å²	54.4	18%	0.181	28%	0.279	C	S	.	.	H	α-helix	trans	-58.1	-49.1	178.7	175.1	102	0	0	0	112.4	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 3.8Å; F221-H230 HydrophobicContact CZ-CB 3.77Å; F221-H230 AromaticContact CZ-CD2 3.62Å; F221-H230 AromaticContact CZ-CG 3.56Å; F221-H230 AromaticContact CZ-ND1 3.96Å; Q226-H230 WeakPolarHBondContact O-CB 3.49Å; Q226-H230 PolarHBondContact O-N 2.94Å; L227-H230 PolarHBondContact O-N 2.87Å; V228-H230 PolarHBondContact O-N 3.01Å; H230-S232 VanDerWaalsContact C-N 3.25Å; H230-S232 PolarHBondContact O-N 3.28Å; H230-E233 PolarHBondContact O-N 3.11Å; H230-K234 WeakPolarHBondContact CE1-CE 3.44Å; H230-K234 PolarHBondContact CE1-NZ 2.97Å; H230-K234 WeakPolarHBondContact NE2-CE 3.36Å; H230-K234 PolarHBondContact O-N 3.45Å; H230-K234 VanDerWaalsContact O-N 3.14Å; H230-D236 IonicContact CD2-OD2 3.06Å; H230-D236 IonicContact CE1-OD2 3.63Å; H230-D236 PolarHBondContact CE1-OD2 2.91Å; H230-D236 VanDerWaalsContact CE1-OD2 3.24Å; H230-D236 IonicContact NE2-OD2 2.63Å; H230-D236 PolarHBondContact NE2-OD2 3.2Å
231	Y	97.4	Very high	94.7	Very high	1 Å²	1	51.4 Å²	51.4	0%	0.004	27%	0.266	C	S	.	.	H	α-helix	trans	-75.7	-14	-178.1	-73.2	-63.3	0	0	0	113.8	I215 F221 L227 V228 Q229 K234 A235 D236 L238 N241 L242	I215-Y231 HydrophobicContact CD1-CD2 4.38Å; I215-Y231 HydrophobicContact CD1-CE2 3.82Å; I215-Y231 HydrophobicContact CG1-CE2 4.49Å; F221-Y231 AromaticContact CE2-CE2 3.99Å; F221-Y231 HydrophobicContact CE2-CE2 3.99Å; F221-Y231 HydrophobicContact CZ-CE2 4.28Å; L227-Y231 HydrophobicContact CD2-CD2 3.74Å; L227-Y231 HydrophobicContact CD2-CE2 4.09Å; L227-Y231 HydrophobicContact CG-CD2 3.9Å; L227-Y231 HydrophobicContact CG-CE2 3.91Å; L227-Y231 VanDerWaalsContact O-CD2 3.24Å; L227-Y231 WeakPolarHBondContact O-CD2 3.49Å; L227-Y231 PolarHBondContact O-N 2.92Å; L227-Y231 VanDerWaalsContact O-N 3.12Å; V228-Y231 PolarHBondContact O-N 3.19Å; Q229-Y231 PolarHBondContact O-N 3.42Å; Y231-K234 CarbonylContact C-O 3.42Å; Y231-K234 VanDerWaalsContact CA-O 3.28Å; Y231-K234 WeakPolarHBondContact CA-O 3.48Å; Y231-A235 VanDerWaalsContact CD1-O 3.31Å; Y231-A235 WeakPolarHBondContact CD1-O 3.42Å; Y231-A235 WeakPolarHBondContact CE1-O 3.43Å; Y231-D236 HydrophobicContact CD1-CB 4.27Å; Y231-D236 HydrophobicContact CE1-CB 3.91Å; Y231-L238 HydrophobicContact CD1-CD1 3.22Å; Y231-L238 HydrophobicContact CD1-CG 3.58Å; Y231-L238 HydrophobicContact CD2-CD1 4.08Å; Y231-L238 HydrophobicContact CE1-CD1 3.73Å; Y231-L238 HydrophobicContact CE1-CD2 4.27Å; Y231-L238 HydrophobicContact CE1-CG 3.6Å; Y231-L238 HydrophobicContact CG-CD1 3.42Å; Y231-L238 VanDerWaalsContact CG-CD1 3.42Å; Y231-L238 HydrophobicContact CG-CG 4.25Å; Y231-N241 WeakPolarHBondContact O-CA 3.47Å; Y231-L242 PolarHBondContact O-N 2.92Å
232	S	96.9	Very high	94.8	Very high	37 Å²	37	50.5 Å²	50.5	26%	0.259	26%	0.263	S	S	.	.	H	α-helix	trans	-74.5	-37.9	168.9	-55.8	0	0	0	0	111.7	V228 Q229 H230 L242	V228-S232 WeakPolarHBondContact O-CB 3.32Å; V228-S232 PolarHBondContact O-N 3.29Å; V228-S232 PolarHBondContact O-OG 2.91Å; Q229-S232 WeakPolarHBondContact O-CB 3.25Å; Q229-S232 PolarHBondContact O-N 3.46Å; H230-S232 VanDerWaalsContact C-N 3.25Å; H230-S232 PolarHBondContact O-N 3.28Å; S232-L242 WeakPolarHBondContact CA-O 3.35Å
233	E	96.3	Very high	94.9	Very high	141 Å²	141	46.6 Å²	46.6	66%	0.659	25%	0.249	S	C	*	.	H	α-helix	trans	-74.3	-37.6	178.9	-69.2	173.6	-168.8	0	0	112.7	Q229 H230	Q229-E233 PolarHBondContact NE2-OE1 3.38Å; Q229-E233 PolarHBondContact O-N 3.36Å; H230-E233 PolarHBondContact O-N 3.11Å
234	K	93.7	Very high	94.9	Very high	93 Å²	93	47.4 Å²	47.4	40%	0.404	25%	0.254	S	S	.	.			trans	-150.5	148.6	179.7	55.1	168.3	-176.3	153.4	0	112.1	H230 Y231 D236	H230-K234 WeakPolarHBondContact CE1-CE 3.44Å; H230-K234 PolarHBondContact CE1-NZ 2.97Å; H230-K234 WeakPolarHBondContact NE2-CE 3.36Å; H230-K234 PolarHBondContact O-N 3.45Å; H230-K234 VanDerWaalsContact O-N 3.14Å; Y231-K234 CarbonylContact C-O 3.42Å; Y231-K234 VanDerWaalsContact CA-O 3.28Å; Y231-K234 WeakPolarHBondContact CA-O 3.48Å; K234-D236 HydrophobicContact CD-CB 4.14Å; K234-D236 HydrophobicContact CG-CB 4.22Å; K234-D236 IonicContact NZ-OD1 2.87Å; K234-D236 PolarHBondContact NZ-OD1 2.73Å; K234-D236 IonicContact NZ-OD2 2.98Å; K234-D236 PolarHBondContact NZ-OD2 2.9Å; K234-D236 VanDerWaalsContact NZ-OD2 3.13Å; K234-D236 PolarHBondContact O-N 3.4Å
235	A	91.9	Very high	94.9	Very high	32 Å²	32	49.9 Å²	49.9	26%	0.264	27%	0.266	S	S	.	.			trans	-67.4	-36	-179.7	0	0	0	0	0	113	Y231 G237 L238	Y231-A235 VanDerWaalsContact CD1-O 3.31Å; Y231-A235 WeakPolarHBondContact CD1-O 3.42Å; Y231-A235 WeakPolarHBondContact CE1-O 3.43Å; A235-G237 PolarHBondContact O-N 3.07Å; A235-G237 VanDerWaalsContact O-N 3.12Å; A235-L238 VanDerWaalsContact O-CB 3.25Å; A235-L238 WeakPolarHBondContact O-CB 3.43Å; A235-L238 WeakPolarHBondContact O-CG 3.36Å; A235-L238 PolarHBondContact O-N 2.79Å
236	D	90.9	Very high	94.6	Very high	64 Å²	64	46.8 Å²	46.8	34%	0.342	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.6	47.8	175	-147.4	44.4	0	0	0	113.7	H230 Y231 K234	H230-D236 IonicContact CD2-OD2 3.06Å; H230-D236 IonicContact CE1-OD2 3.63Å; H230-D236 PolarHBondContact CE1-OD2 2.91Å; H230-D236 VanDerWaalsContact CE1-OD2 3.24Å; H230-D236 IonicContact NE2-OD2 2.63Å; H230-D236 PolarHBondContact NE2-OD2 3.2Å; Y231-D236 HydrophobicContact CD1-CB 4.27Å; Y231-D236 HydrophobicContact CE1-CB 3.91Å; K234-D236 HydrophobicContact CD-CB 4.14Å; K234-D236 HydrophobicContact CG-CB 4.22Å; K234-D236 IonicContact NZ-OD1 2.87Å; K234-D236 PolarHBondContact NZ-OD1 2.73Å; K234-D236 IonicContact NZ-OD2 2.98Å; K234-D236 PolarHBondContact NZ-OD2 2.9Å; K234-D236 VanDerWaalsContact NZ-OD2 3.13Å; K234-D236 PolarHBondContact O-N 3.4Å
237	G	87.8	Confident	93.9	Very high	32 Å²	32	47.3 Å²	47.3	33%	0.33	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.7	-27	-178.1	0	0	0	0	0	114.2	A235 L534	A235-G237 PolarHBondContact O-N 3.07Å; A235-G237 VanDerWaalsContact O-N 3.12Å; G237-L534 WeakPolarHBondContact O-CD2 3.45Å
238	L	93.4	Very high	92.9	Very high	9 Å²	9	50.2 Å²	50.2	5%	0.047	28%	0.277	C	S	.	.	S	Bend	trans	-59.3	156.9	173.1	-57.8	-177.3	0	0	0	111.7	L187 I189 Y203 I215 Y231 A235 F240 L242	L187-L238 HydrophobicContact CD2-CD1 3.88Å; I189-L238 HydrophobicContact CD1-CB 4.41Å; I189-L238 HydrophobicContact CD1-CD1 3.85Å; Y203-L238 HydrophobicContact CD1-CD2 3.52Å; Y203-L238 HydrophobicContact CD2-CD2 3.92Å; Y203-L238 HydrophobicContact CE1-CD2 3.58Å; Y203-L238 HydrophobicContact CE2-CD2 3.99Å; Y203-L238 HydrophobicContact CG-CD2 3.7Å; I215-L238 HydrophobicContact CD1-CD2 4.13Å; I215-L238 HydrophobicContact CG2-CD2 4.49Å; Y231-L238 HydrophobicContact CD1-CD1 3.22Å; Y231-L238 HydrophobicContact CD1-CG 3.58Å; Y231-L238 HydrophobicContact CD2-CD1 4.08Å; Y231-L238 HydrophobicContact CE1-CD1 3.73Å; Y231-L238 HydrophobicContact CE1-CD2 4.27Å; Y231-L238 HydrophobicContact CE1-CG 3.6Å; Y231-L238 HydrophobicContact CG-CD1 3.42Å; Y231-L238 VanDerWaalsContact CG-CD1 3.42Å; Y231-L238 HydrophobicContact CG-CG 4.25Å; A235-L238 VanDerWaalsContact O-CB 3.25Å; A235-L238 WeakPolarHBondContact O-CB 3.43Å; A235-L238 WeakPolarHBondContact O-CG 3.36Å; A235-L238 PolarHBondContact O-N 2.79Å; L238-F240 PolarHBondContact O-N 3.25Å; L238-F240 VanDerWaalsContact O-N 3.16Å; L238-L242 HydrophobicContact CD1-CD2 4.46Å
239	C	93.3	Very high	91.9	Very high	25 Å²	25	55.2 Å²	55.2	17%	0.169	30%	0.303	C	S	.	.	S	Bend	trans	-59.8	-26.4	178.5	58	0	0	0	0	114.3	R170 D191 K201 Y203	R170-C239 PolarHBondContact NH2-O 3.5Å; D191-C239 VanDerWaalsContact OD2-CB 3.28Å; D191-C239 WeakPolarHBondContact OD2-CB 3.42Å; K201-C239 HydrophobicContact CD-CB 3.43Å; K201-C239 VanDerWaalsContact CD-CB 3.43Å; Y203-C239 WeakPolarHBondContact OH-CB 3.32Å; Y203-C239 PolarHBondContact OH-N 3.43Å; Y203-C239 PolarHBondContact OH-SG 3.03Å
240	F	95.7	Very high	91.2	Very high	61 Å²	61	53.8 Å²	53.8	27%	0.268	30%	0.302	S	S	.	.	S	Bend	trans	-161.2	159.6	175.8	-153.4	-105.9	0	0	0	109.3	R170 L238 T243	R170-F240 HydrophobicContact CG-CD1 4.1Å; R170-F240 HydrophobicContact CG-CD2 4.12Å; R170-F240 HydrophobicContact CG-CE1 4.34Å; R170-F240 HydrophobicContact CG-CE2 4.36Å; R170-F240 HydrophobicContact CG-CG 3.98Å; R170-F240 HydrophobicContact CG-CZ 4.48Å; L238-F240 PolarHBondContact O-N 3.25Å; L238-F240 VanDerWaalsContact O-N 3.16Å; F240-T243 HydrophobicContact CD1-CG2 4.22Å; F240-T243 HydrophobicContact CE1-CG2 3.81Å
241	N	95.8	Very high	90.6	Very high	49 Å²	49	53.7 Å²	53.7	26%	0.262	31%	0.305	S	S	.	.			trans	-70.1	153.9	171.2	62.2	-46.6	0	0	0	111	G171 Y231 T243	G171-N241 WeakPolarHBondContact CA-O 3.12Å; Y231-N241 WeakPolarHBondContact O-CA 3.47Å; N241-T243 PolarHBondContact O-N 3.01Å
242	L	97.8	Very high	90.1	Very high	4 Å²	4	58.1 Å²	58.1	2%	0.021	33%	0.326	C	S	.	.			trans	-74.3	119.1	176.8	-52.6	-177.1	0	0	0	108.8	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 4.19Å; F173-L242 HydrophobicContact CD1-CG 4.33Å; F173-L242 HydrophobicContact CD2-CB 4.48Å; F173-L242 HydrophobicContact CD2-CD1 3.94Å; F173-L242 HydrophobicContact CD2-CD2 4.1Å; F173-L242 HydrophobicContact CD2-CG 4.39Å; F173-L242 HydrophobicContact CE1-CB 3.73Å; F173-L242 HydrophobicContact CE2-CD1 3.92Å; F173-L242 HydrophobicContact CG-CB 4.05Å; F173-L242 HydrophobicContact CG-CD1 4.27Å; F173-L242 HydrophobicContact CG-CD2 3.74Å; F173-L242 HydrophobicContact CG-CG 4.22Å; F173-L242 HydrophobicContact CZ-CB 4.18Å; F173-L242 HydrophobicContact CZ-CD1 4.24Å; L187-L242 HydrophobicContact CD1-CD1 4.34Å; L187-L242 HydrophobicContact CD1-CD2 4.06Å; L187-L242 HydrophobicContact CD2-CD2 4.21Å; I189-L242 HydrophobicContact CD1-CD2 3.56Å; I189-L242 HydrophobicContact CG1-CD2 3.89Å; V228-L242 HydrophobicContact CG1-CD1 4.25Å; Y231-L242 PolarHBondContact O-N 2.92Å; S232-L242 WeakPolarHBondContact CA-O 3.35Å; L238-L242 HydrophobicContact CD1-CD2 4.46Å
243	T	95.2	Very high	89.6	Confident	63 Å²	63	56.3 Å²	56.3	39%	0.387	31%	0.313	S	S	.	.			trans	-110	-57.9	-173.3	55.7	0	0	0	0	112.4	R170 G171 T172 F240 N241	R170-T243 PolarHBondContact O-OG1 2.72Å; R170-T243 VanDerWaalsContact O-OG1 3.06Å; G171-T243 WeakPolarHBondContact CA-OG1 3.24Å; G171-T243 PolarHBondContact O-N 3.38Å; G171-T243 PolarHBondContact O-OG1 3.3Å; T172-T243 PolarHBondContact N-OG1 3.3Å; F240-T243 HydrophobicContact CD1-CG2 4.22Å; F240-T243 HydrophobicContact CE1-CG2 3.81Å; N241-T243 PolarHBondContact O-N 3.01Å
244	V	94.5	Very high	89.1	Confident	69 Å²	69	51.3 Å²	51.3	42%	0.418	29%	0.292	S	S	.	.	S	Bend	trans	-130	138.2	-172.4	-178.1	0	0	0	0	109.2	P169 T172 F173	P169-V244 HydrophobicContact CG-CB 4.31Å; P169-V244 HydrophobicContact CG-CG2 3.86Å; T172-V244 CarbonylContact C-O 3.56Å; T172-V244 WeakPolarHBondContact CA-O 3.44Å; T172-V244 WeakPolarHBondContact CG2-O 3.44Å; F173-V244 VanDerWaalsContact CD1-O 3.3Å; F173-V244 WeakPolarHBondContact CD1-O 3.39Å; F173-V244 PolarHBondContact N-O 2.81Å
245	I	94	Very high	88.8	Confident	55 Å²	55	47.6 Å²	47.6	28%	0.282	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-72	135.8	174	-56.9	175.8	0	0	0	108.6	E148 W149 F151 F173 T247	E148-I245 HydrophobicContact CB-CD1 3.91Å; E148-I245 WeakPolarHBondContact O-CG2 3.35Å; W149-I245 HydrophobicContact CB-CD1 4.06Å; W149-I245 HydrophobicContact CB-CG1 4.12Å; W149-I245 HydrophobicContact CB-CG2 4.03Å; F151-I245 HydrophobicContact CE2-CG2 4.3Å; F173-I245 HydrophobicContact CE1-CG1 4.01Å; F173-I245 HydrophobicContact CZ-CG1 4Å; I245-T247 PolarHBondContact O-N 3.07Å
246	A	89.9	Confident	88.5	Confident	4 Å²	4	46 Å²	46	3%	0.033	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-54.5	139.6	175.4	0	0	0	0	0	110.9	F151 Q162 L163 T172 F173 L174 N248	F151-A246 HydrophobicContact CZ-CB 4Å; F151-A246 WeakPolarHBondContact CZ-O 3.35Å; Q162-A246 HydrophobicContact CG-CB 4.36Å; L163-A246 HydrophobicContact CD2-CB 3.78Å; T172-A246 HydrophobicContact CG2-CB 4.06Å; F173-A246 PolarHBondContact O-N 2.97Å; L174-A246 HydrophobicContact CB-CB 4.21Å; L174-A246 HydrophobicContact CD2-CB 3.92Å; A246-N248 PolarHBondContact O-N 2.83Å; A246-N248 VanDerWaalsContact O-N 3.13Å
247	T	81.3	Confident	88.4	Confident	94 Å²	94	43.3 Å²	43.3	58%	0.577	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-65.3	118.1	176.9	-50	0	0	0	0	109.6	Q162 I245	Q162-T247 PolarHBondContact NE2-O 3.48Å; I245-T247 PolarHBondContact O-N 3.07Å
248	N	74.6	Confident	88.3	Confident	60 Å²	60	45.5 Å²	45.5	32%	0.321	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-83.2	131.2	175.1	-160.7	0.2	0	0	0	110.5	Y91 F151 A246	Y91-N248 HydrophobicContact CE1-CB 4.4Å; Y91-N248 PolarHBondContact OH-ND2 3.27Å; F151-N248 HydrophobicContact CE1-CB 3.7Å; F151-N248 HydrophobicContact CZ-CB 3.84Å; A246-N248 PolarHBondContact O-N 2.83Å; A246-N248 VanDerWaalsContact O-N 3.13Å
249	N	75.4	Confident	87.8	Confident	117 Å²	117	52 Å²	52	63%	0.626	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-81.7	133.9	175.1	-69.7	-38.3	0	0	0	108.5	P251	N249-P251 WeakPolarHBondContact O-CD 3.3Å; N249-P251 VanDerWaalsContact O-N 3.13Å
250	T	82.6	Confident	87.5	Confident	81 Å²	81	51.7 Å²	51.7	50%	0.497	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-56.8	120.4	172.9	-50.5	0	0	0	0	109.1	Y91 Y137	Y91-T250 HydrophobicContact CD1-CG2 4.44Å; Y91-T250 HydrophobicContact CG-CG2 4.21Å; Y137-T250 HydrophobicContact CE1-CG2 3.8Å; Y137-T250 WeakPolarHBondContact OH-CG2 3.37Å
251	P	84.8	Confident	87.2	Confident	36 Å²	36	50 Å²	50	23%	0.234	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-67.3	155.6	-178.9	28.3	-34.5	0	0	0	110.1	Y91 Y137 N249	Y91-P251 HydrophobicContact CD2-CG 4.03Å; Y91-P251 HydrophobicContact CE2-CG 3.58Å; Y137-P251 HydrophobicContact CD2-CG 4.25Å; Y137-P251 HydrophobicContact CE2-CG 3.96Å; Y137-P251 PolarHBondContact OH-O 2.87Å; N249-P251 WeakPolarHBondContact O-CD 3.3Å; N249-P251 VanDerWaalsContact O-N 3.13Å
252	Q	85.5	Confident	87.1	Confident	94 Å²	94	52.5 Å²	52.5	44%	0.439	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-69.6	147.4	167.6	-65.7	-61.4	-38.2	0	0	109.5	N136 Y327	N136-Q252 PolarHBondContact ND2-O 3.21Å; Q252-Y327 PolarHBondContact OE1-OH 2.85Å
253	T	88.3	Confident	86.9	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-72	153.7	169.2	55.9	0	0	0	0	109.7	Y93 R96 W119 P134 Y137 G255 Q325	Y93-T253 HydrophobicContact CE2-CG2 4.09Å; R96-T253 PolarHBondContact NH1-OG1 2.87Å; R96-T253 PolarHBondContact NH2-OG1 3.12Å; W119-T253 HydrophobicContact CH2-CG2 4.11Å; W119-T253 HydrophobicContact CZ2-CG2 4.15Å; P134-T253 HydrophobicContact CB-CG2 3.8Å; P134-T253 HydrophobicContact CG-CG2 4.02Å; Y137-T253 HydrophobicContact CE2-CG2 3.79Å; T253-G255 PolarHBondContact O-N 3.06Å; T253-G255 PolarHBondContact OG1-O 2.76Å; T253-Q325 PolarHBondContact O-NE2 3.32Å
254	V	84.9	Confident	86.9	Confident	35 Å²	35	53.5 Å²	53.5	21%	0.212	30%	0.304	C	S	.	.	S	Bend	trans	-82	104	172.1	-168.5	0	0	0	0	109.3	D118 W119 K319	D118-V254 HydrophobicContact CB-CB 3.53Å; D118-V254 HydrophobicContact CB-CG1 4.08Å; D118-V254 HydrophobicContact CB-CG2 3.99Å; D118-V254 VanDerWaalsContact CG-CB 3.47Å; D118-V254 WeakPolarHBondContact OD2-CG1 3.1Å; W119-V254 PolarHBondContact NE1-O 2.63Å; V254-K319 HydrophobicContact CG1-CD 4.37Å; V254-K319 VanDerWaalsContact CG1-NZ 3.28Å
255	G	86.8	Confident	86.9	Confident	15 Å²	15	53 Å²	53	16%	0.155	29%	0.294	C	S	.	.	S	Bend	trans	79.7	-179.3	-171.3	0	0	0	0	0	112.4	T253	T253-G255 PolarHBondContact O-N 3.06Å; T253-G255 PolarHBondContact OG1-O 2.76Å
256	L	86.6	Confident	87	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.322	C	S	.	.	S	Bend	trans	-79.5	-46.8	-177.9	-71.6	168	0	0	0	112.4	R96 A260 V263 W287 T291 V293 Y327 A328 V338	R96-L256 WeakPolarHBondContact CD-O 3.37Å; R96-L256 PolarHBondContact NH1-O 3.46Å; L256-A260 HydrophobicContact CB-CB 4.18Å; L256-V263 HydrophobicContact CD1-CG1 4.49Å; L256-W287 HydrophobicContact CB-CD2 4.11Å; L256-W287 HydrophobicContact CB-CE3 3.77Å; L256-W287 HydrophobicContact CB-CH2 3.75Å; L256-W287 HydrophobicContact CB-CZ2 4.09Å; L256-W287 HydrophobicContact CB-CZ3 3.58Å; L256-W287 HydrophobicContact CD1-CD2 3.79Å; L256-W287 HydrophobicContact CD1-CE3 4.22Å; L256-W287 HydrophobicContact CD1-CG 3.91Å; L256-W287 HydrophobicContact CD2-CB 4.42Å; L256-W287 HydrophobicContact CD2-CD2 4.06Å; L256-W287 HydrophobicContact CD2-CE3 3.75Å; L256-W287 HydrophobicContact CD2-CG 4.36Å; L256-W287 HydrophobicContact CD2-CZ3 4.36Å; L256-W287 HydrophobicContact CG-CD2 4.18Å; L256-W287 HydrophobicContact CG-CE3 4.09Å; L256-W287 HydrophobicContact CG-CZ3 4.4Å; L256-T291 HydrophobicContact CD2-CG2 3.86Å; L256-V293 HydrophobicContact CD2-CG1 4.05Å; L256-Y327 HydrophobicContact CD2-CD2 3.8Å; L256-Y327 HydrophobicContact CD2-CE2 4.41Å; L256-Y327 HydrophobicContact CD2-CG 3.97Å; L256-Y327 HydrophobicContact CG-CD2 4.41Å; L256-Y327 HydrophobicContact CG-CG 4.09Å; L256-A328 HydrophobicContact CD1-CB 3.65Å; L256-V338 HydrophobicContact CD1-CG1 4.47Å
257	A	87.6	Confident	87.3	Confident	7 Å²	7	59 Å²	59	6%	0.058	33%	0.329	C	S	.	.	S	Bend	trans	-158.3	179.2	176.3	0	0	0	0	0	108.8	T97 D259 A260 W287	T97-A257 HydrophobicContact CG2-CB 3.57Å; A257-D259 PolarHBondContact O-N 3.19Å; A257-A260 HydrophobicContact CB-CB 4.07Å; A257-A260 PolarHBondContact O-N 3.43Å; A257-W287 HydrophobicContact CB-CH2 3.74Å; A257-W287 HydrophobicContact CB-CZ3 4.45Å
258	K	85.9	Confident	88	Confident	78 Å²	78	55.3 Å²	55.3	34%	0.339	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	130.7	172.3	-179.1	175.2	173	177.2	0	110.4	W119 Y132 A260	W119-K258 HydrophobicContact CB-CB 4.03Å; W119-K258 HydrophobicContact CG-CB 4.19Å; Y132-K258 HydrophobicContact CD1-CD 3.64Å; Y132-K258 HydrophobicContact CD2-CD 4.2Å; Y132-K258 HydrophobicContact CE1-CD 3.26Å; Y132-K258 VanDerWaalsContact CE1-NZ 3.32Å; Y132-K258 HydrophobicContact CE2-CD 3.87Å; Y132-K258 HydrophobicContact CG-CB 4.4Å; Y132-K258 HydrophobicContact CG-CD 4.1Å; Y132-K258 VanDerWaalsContact CZ-NZ 3.3Å; Y132-K258 PolarHBondContact OH-NZ 3.31Å; K258-A260 PolarHBondContact O-N 3.48Å
259	D	83.6	Confident	89.1	Confident	145 Å²	145	58.9 Å²	58.9	78%	0.775	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	10.4	177.4	-56.4	-38	0	0	0	116.5	A257 W261	A257-D259 PolarHBondContact O-N 3.19Å; D259-W261 VanDerWaalsContact C-N 3.28Å; D259-W261 PolarHBondContact O-N 3.34Å
260	A	87.4	Confident	90.1	Very high	19 Å²	19	55.8 Å²	55.8	16%	0.157	30%	0.301	C	S	.	.			trans	-81	65.6	179.9	0	0	0	0	0	112.5	L256 A257 K258 V263 W287	L256-A260 HydrophobicContact CB-CB 4.18Å; A257-A260 HydrophobicContact CB-CB 4.07Å; A257-A260 PolarHBondContact O-N 3.43Å; K258-A260 PolarHBondContact O-N 3.48Å; A260-V263 HydrophobicContact CB-CG1 4.46Å; A260-W287 HydrophobicContact CB-CZ2 4.24Å
261	W	89.8	Confident	90.8	Very high	25 Å²	25	55.6 Å²	55.6	10%	0.095	30%	0.295	C	S	.	.	S	Bend	trans	-98	-57.8	-180	171.5	-111.7	0	0	0	113.5	D259 A312 K316 L326 A328 V329	D259-W261 VanDerWaalsContact C-N 3.28Å; D259-W261 PolarHBondContact O-N 3.34Å; W261-A312 HydrophobicContact CH2-CB 4.03Å; W261-A312 WeakPolarHBondContact CH2-O 3.41Å; W261-A312 HydrophobicContact CZ2-CB 3.77Å; W261-K316 HydrophobicContact CD2-CD 3.93Å; W261-K316 HydrophobicContact CE3-CD 3.71Å; W261-K316 HydrophobicContact CE3-CG 4.23Å; W261-K316 HydrophobicContact CH2-CB 3.76Å; W261-K316 HydrophobicContact CH2-CD 3.98Å; W261-K316 HydrophobicContact CH2-CG 4.14Å; W261-K316 HydrophobicContact CZ2-CB 4.48Å; W261-K316 HydrophobicContact CZ2-CD 4.23Å; W261-K316 HydrophobicContact CZ3-CB 3.91Å; W261-K316 HydrophobicContact CZ3-CD 3.73Å; W261-K316 HydrophobicContact CZ3-CG 3.83Å; W261-L326 HydrophobicContact CH2-CD2 3.43Å; W261-L326 VanDerWaalsContact CH2-CD2 3.43Å; W261-L326 HydrophobicContact CH2-CG 4.05Å; W261-L326 HydrophobicContact CZ3-CD2 3.8Å; W261-L326 HydrophobicContact CZ3-CG 3.89Å; W261-A328 CarbonylContact O-C 3.53Å; W261-A328 WeakPolarHBondContact O-CA 3.18Å; W261-A328 VanDerWaalsContact O-CB 3.27Å; W261-A328 WeakPolarHBondContact O-CB 3.43Å; W261-V329 HydrophobicContact CH2-CG1 4.13Å; W261-V329 HydrophobicContact CZ2-CG1 4.18Å; W261-V329 HydrophobicContact CZ2-CG2 4.25Å; W261-V329 PolarHBondContact O-N 3.25Å
262	E	92.7	Very high	91.3	Very high	102 Å²	102	58.4 Å²	58.4	48%	0.477	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-96	111	169.7	-74.9	-176.2	-116	0	0	107.6	L309 V329 S331	E262-L309 HydrophobicContact CG-CD2 4.45Å; E262-V329 WeakPolarHBondContact CA-O 3.26Å; E262-V329 HydrophobicContact CG-CG2 3.85Å; E262-S331 WeakPolarHBondContact OE2-CB 3.21Å; E262-S331 PolarHBondContact OE2-OG 3.17Å
263	V	94.3	Very high	91.8	Very high	19 Å²	19	57.7 Å²	57.7	12%	0.115	30%	0.3	C	S	.	.			trans	-105.8	149.8	-173.9	-64.6	0	0	0	0	110.9	L256 A260 L268 A328 V329 V330	L256-V263 HydrophobicContact CD1-CG1 4.49Å; A260-V263 HydrophobicContact CB-CG1 4.46Å; V263-L268 HydrophobicContact CG2-CD1 4.08Å; V263-L268 HydrophobicContact CG2-CG 4.44Å; V263-A328 HydrophobicContact CB-CB 4.5Å; V263-A328 HydrophobicContact CG1-CB 3.76Å; V263-A328 HydrophobicContact CG2-CB 3.94Å; V263-V329 PolarHBondContact N-O 3.47Å; V263-V330 HydrophobicContact CG2-CG2 4.18Å
264	A	94.4	Very high	92	Very high	69 Å²	69	61.5 Å²	61.5	57%	0.57	32%	0.32	S	S	*	.			trans	-65.6	137.2	173.8	0	0	0	0	0	110.3	D266 S267	A264-D266 PolarHBondContact O-N 3.49Å; A264-S267 WeakPolarHBondContact O-CB 3.33Å; A264-S267 PolarHBondContact O-N 3.01Å; A264-S267 PolarHBondContact O-OG 3.42Å
265	R	95.4	Very high	92.1	Very high	58 Å²	58	61.3 Å²	61.3	22%	0.219	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-55.4	-38.5	179.9	-171.5	-178.8	-56.7	-73.5	-0.3	112.7	S267 L268 V330 E332 E333 P334 Y336	R265-S267 PolarHBondContact O-N 2.78Å; R265-L268 WeakPolarHBondContact O-CB 3.3Å; R265-L268 PolarHBondContact O-N 3.47Å; R265-V330 HydrophobicContact CB-CG1 4.31Å; R265-E332 PolarHBondContact NH2-O 3.43Å; R265-E333 PolarHBondContact NH2-O 3.45Å; R265-P334 VanDerWaalsContact CZ-O 3.26Å; R265-P334 PolarHBondContact NH1-O 3.44Å; R265-P334 PolarHBondContact NH2-O 3.3Å; R265-Y336 HydrophobicContact CG-CE2 4.06Å; R265-Y336 VanDerWaalsContact NH1-CD1 3.34Å
266	D	95.4	Very high	92	Very high	161 Å²	161	66.7 Å²	66.7	86%	0.861	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-69.3	-14.3	-178.2	-65.4	-3.4	0	0	0	113.1	A264 L268	A264-D266 PolarHBondContact O-N 3.49Å; D266-L268 PolarHBondContact O-N 3.12Å
267	S	95.6	Very high	91.4	Very high	25 Å²	25	68.6 Å²	68.6	18%	0.175	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-74.9	-10	170.7	73.3	0	0	0	0	113.4	A264 R265 W287 N288	A264-S267 WeakPolarHBondContact O-CB 3.33Å; A264-S267 PolarHBondContact O-N 3.01Å; A264-S267 PolarHBondContact O-OG 3.42Å; R265-S267 PolarHBondContact O-N 2.78Å; S267-W287 WeakPolarHBondContact O-CA 3.43Å; S267-W287 PolarHBondContact OG-NE1 3.22Å; S267-N288 WeakPolarHBondContact CB-OD1 3.41Å; S267-N288 PolarHBondContact O-N 2.79Å
268	L	97.5	Very high	90.6	Very high	16 Å²	16	72.6 Å²	72.6	8%	0.084	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122	-176.4	-63.7	169.6	0	0	0	110.9	V263 R265 D266 T286 W287 V293 I295 V330 Y336 V338	V263-L268 HydrophobicContact CG2-CD1 4.08Å; V263-L268 HydrophobicContact CG2-CG 4.44Å; R265-L268 WeakPolarHBondContact O-CB 3.3Å; R265-L268 PolarHBondContact O-N 3.47Å; D266-L268 PolarHBondContact O-N 3.12Å; L268-T286 WeakPolarHBondContact CA-O 3.31Å; L268-W287 HydrophobicContact CD2-CB 3.95Å; L268-W287 HydrophobicContact CD2-CG 4.29Å; L268-V293 HydrophobicContact CD2-CG2 4.44Å; L268-I295 HydrophobicContact CB-CD1 4.04Å; L268-I295 HydrophobicContact CD2-CD1 4.06Å; L268-I295 HydrophobicContact CD2-CG1 4.42Å; L268-I295 HydrophobicContact CG-CD1 4.49Å; L268-V330 HydrophobicContact CD1-CG2 3.75Å; L268-Y336 HydrophobicContact CD1-CD2 3.89Å; L268-V338 HydrophobicContact CD1-CG2 3.65Å; L268-V338 HydrophobicContact CD2-CG1 4.24Å; L268-V338 HydrophobicContact CD2-CG2 3.95Å; L268-V338 HydrophobicContact CG-CG2 4.48Å
269	F	97	Very high	89.9	Confident	135 Å²	135	75.2 Å²	75.2	59%	0.592	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	118.1	175.5	-172.6	-108.4	0	0	0	110.8	E271 G285 T286	F269-E271 HydrophobicContact CD1-CG 3.61Å; F269-E271 HydrophobicContact CE1-CG 3.85Å; F269-G285 CarbonylContact O-C 3.49Å; F269-G285 WeakPolarHBondContact O-CA 3.15Å; F269-T286 PolarHBondContact N-O 3.29Å; F269-T286 PolarHBondContact O-N 3.08Å
270	L	96.8	Very high	89.9	Confident	52 Å²	52	68.7 Å²	68.7	27%	0.272	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	114.5	176.5	-55.6	-179.6	0	0	0	109.7	W283 I295 T297 Y336	L270-W283 HydrophobicContact CB-CD2 4.18Å; L270-W283 HydrophobicContact CB-CE3 3.95Å; L270-W283 HydrophobicContact CB-CG 4.42Å; L270-W283 HydrophobicContact CD1-CD2 4.35Å; L270-W283 HydrophobicContact CD1-CG 4.4Å; L270-W283 HydrophobicContact CD2-CB 3.85Å; L270-W283 HydrophobicContact CD2-CG 4.06Å; L270-I295 HydrophobicContact CD2-CB 3.83Å; L270-I295 HydrophobicContact CD2-CD1 3.58Å; L270-I295 HydrophobicContact CD2-CG1 4.32Å; L270-I295 HydrophobicContact CD2-CG2 3.72Å; L270-T297 HydrophobicContact CD1-CG2 4.44Å; L270-Y336 HydrophobicContact CD2-CE2 4.46Å
271	E	96.1	Very high	90	Very high	77 Å²	77	69.7 Å²	69.7	36%	0.36	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	-56.2	-175.2	-65.1	176	177.1	0	0	112.8	F269 R284 T286	F269-E271 HydrophobicContact CD1-CG 3.61Å; F269-E271 HydrophobicContact CE1-CG 3.85Å; E271-R284 WeakPolarHBondContact CB-O 3.38Å; E271-R284 PolarHBondContact N-O 3.44Å; E271-R284 IonicContact OE2-CZ 3.99Å; E271-R284 IonicContact OE2-NE 3.16Å; E271-R284 PolarHBondContact OE2-NE 3.3Å; E271-R284 VanDerWaalsContact OE2-NE 3.07Å; E271-R284 IonicContact OE2-NH2 3.06Å; E271-R284 PolarHBondContact OE2-NH2 3.21Å; E271-T286 VanDerWaalsContact OE1-CG2 3.26Å; E271-T286 WeakPolarHBondContact OE1-CG2 3.46Å
272	Q	96.1	Very high	90.2	Very high	95 Å²	95	70.8 Å²	70.8	44%	0.444	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	124.5	-170.5	-179	-179.9	1.9	0	0	110	L274 W283 R284	Q272-L274 PolarHBondContact O-N 2.84Å; Q272-W283 CarbonylContact O-C 3.58Å; Q272-W283 WeakPolarHBondContact O-CA 3.49Å; Q272-R284 HydrophobicContact CB-CB 4.36Å; Q272-R284 PolarHBondContact N-O 3.35Å; Q272-R284 VanDerWaalsContact N-O 3.13Å; Q272-R284 PolarHBondContact O-N 3.31Å; Q272-R284 VanDerWaalsContact OE1-CZ 3.31Å
273	K	95.9	Very high	90.4	Very high	79 Å²	79	68.6 Å²	68.6	34%	0.343	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	122.1	171.9	-162.7	177.5	-166.1	175.3	0	109.6	E281 W283	K273-E281 VanDerWaalsContact CE-CD 3.44Å; K273-E281 WeakPolarHBondContact CE-OE1 3.44Å; K273-E281 WeakPolarHBondContact CE-OE2 3.18Å; K273-E281 IonicContact NZ-OE1 2.72Å; K273-E281 PolarHBondContact NZ-OE1 3.31Å; K273-E281 IonicContact NZ-OE2 3.39Å; K273-E281 PolarHBondContact NZ-OE2 3.16Å; K273-W283 HydrophobicContact CB-CD2 4.14Å; K273-W283 HydrophobicContact CB-CE3 3.95Å; K273-W283 HydrophobicContact CB-CH2 3.93Å; K273-W283 HydrophobicContact CB-CZ2 4.11Å; K273-W283 HydrophobicContact CB-CZ3 3.86Å; K273-W283 HydrophobicContact CD-CH2 4.44Å; K273-W283 HydrophobicContact CD-CZ2 4.09Å; K273-W283 HydrophobicContact CG-CD2 4.31Å; K273-W283 HydrophobicContact CG-CH2 4.37Å; K273-W283 HydrophobicContact CG-CZ2 4.05Å; K273-W283 VanDerWaalsContact N-CE3 3.32Å
274	L	91.6	Very high	90.5	Very high	80 Å²	80	70.9 Å²	70.9	42%	0.419	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-35.7	178.6	-62.3	176.1	0	0	0	111.6	Q272 V282 R284 Y341	Q272-L274 PolarHBondContact O-N 2.84Å; L274-V282 WeakPolarHBondContact CA-O 3.36Å; L274-V282 HydrophobicContact CB-CB 4.45Å; L274-V282 HydrophobicContact CB-CG1 4.33Å; L274-V282 HydrophobicContact CD1-CG1 4.23Å; L274-V282 PolarHBondContact N-O 3.04Å; L274-R284 HydrophobicContact CD1-CB 4Å; L274-R284 HydrophobicContact CD2-CB 4.03Å; L274-R284 HydrophobicContact CG-CB 4.06Å; L274-Y341 HydrophobicContact CD1-CD2 4.21Å; L274-Y341 HydrophobicContact CD1-CE2 3.82Å; L274-Y341 HydrophobicContact CD2-CE2 4.35Å
275	G	87.2	Confident	90.6	Very high	30 Å²	30	67.6 Å²	67.6	31%	0.309	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.6	164	-176.9	0	0	0	0	0	113.5	V282	G275-V282 PolarHBondContact N-O 2.99Å; G275-V282 VanDerWaalsContact N-O 3.15Å; G275-V282 PolarHBondContact O-N 2.76Å
276	Q	85.1	Confident	90.7	Very high	128 Å²	128	65.4 Å²	65.4	60%	0.598	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.5	120.6	176	-171	173.2	22.8	0	0	109.7	E281	Q276-E281 HydrophobicContact CG-CG 4.26Å; Q276-E281 PolarHBondContact NE2-OE1 2.79Å
277	G	74.5	Confident	90.7	Very high	41 Å²	41	58.1 Å²	58.1	42%	0.423	30%	0.301	S	S	.	.			trans	-103.8	-177.9	172.7	0	0	0	0	0	112.4	F279 A280	G277-F279 VanDerWaalsContact C-N 3.29Å; G277-F279 PolarHBondContact O-N 3.09Å; G277-A280 WeakPolarHBondContact CA-O 3.29Å; G277-A280 PolarHBondContact N-O 3.03Å
278	C	69.7	Low	90.6	Very high	90 Å²	90	60.3 Å²	60.3	61%	0.608	31%	0.311	S	S	*	.	S	Bend	trans	-61.4	-40.4	176.3	-64.1	0	0	0	0	112	K299	C278-K299 PolarHBondContact O-NZ 3.21Å
279	F	71.8	Confident	90.2	Very high	133 Å²	133	62.5 Å²	62.5	58%	0.583	34%	0.337	S	S	*	.	S	Bend	trans	-113.5	-11.4	-169.3	-52.2	-71.7	0	0	0	114.1	G277 K299 T302	G277-F279 VanDerWaalsContact C-N 3.29Å; G277-F279 PolarHBondContact O-N 3.09Å; F279-K299 PolarHBondContact O-N 3.39Å; F279-T302 HydrophobicContact CB-CG2 4.01Å
280	A	83.4	Confident	89.6	Confident	8 Å²	8	59.2 Å²	59.2	7%	0.066	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	158.2	-173	0	0	0	0	0	112.3	G277 K296 T297 L298	G277-A280 WeakPolarHBondContact CA-O 3.29Å; G277-A280 PolarHBondContact N-O 3.03Å; A280-K296 HydrophobicContact CB-CD 4.3Å; A280-K296 HydrophobicContact CB-CG 3.8Å; A280-T297 CarbonylContact C-O 3.6Å; A280-T297 WeakPolarHBondContact CA-O 3.47Å; A280-T297 WeakPolarHBondContact CB-O 3.33Å; A280-L298 HydrophobicContact CB-CD2 3.86Å
281	E	90.4	Very high	89.4	Confident	41 Å²	41	57.4 Å²	57.4	19%	0.192	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	148.1	164	-44.6	-162.9	135.5	0	0	109.1	K273 Q276 K296 T297	K273-E281 VanDerWaalsContact CE-CD 3.44Å; K273-E281 WeakPolarHBondContact CE-OE1 3.44Å; K273-E281 WeakPolarHBondContact CE-OE2 3.18Å; K273-E281 IonicContact NZ-OE1 2.72Å; K273-E281 PolarHBondContact NZ-OE1 3.31Å; K273-E281 IonicContact NZ-OE2 3.39Å; K273-E281 PolarHBondContact NZ-OE2 3.16Å; Q276-E281 HydrophobicContact CG-CG 4.26Å; Q276-E281 PolarHBondContact NE2-OE1 2.79Å; E281-K296 CarbonylContact O-C 3.55Å; E281-K296 VanDerWaalsContact O-CA 3.29Å; E281-K296 WeakPolarHBondContact O-CA 3.3Å; E281-T297 PolarHBondContact N-O 3.36Å; E281-T297 PolarHBondContact O-N 2.9Å; E281-T297 PolarHBondContact O-OG1 3.05Å
282	V	93.5	Very high	89.3	Confident	47 Å²	47	60.7 Å²	60.7	29%	0.285	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	131.2	178.5	-171.9	0	0	0	0	108.2	L274 G275 K296	L274-V282 WeakPolarHBondContact CA-O 3.36Å; L274-V282 HydrophobicContact CB-CB 4.45Å; L274-V282 HydrophobicContact CB-CG1 4.33Å; L274-V282 HydrophobicContact CD1-CG1 4.23Å; L274-V282 PolarHBondContact N-O 3.04Å; G275-V282 PolarHBondContact N-O 2.99Å; G275-V282 VanDerWaalsContact N-O 3.15Å; G275-V282 PolarHBondContact O-N 2.76Å; V282-K296 HydrophobicContact CG2-CB 4.49Å; V282-K296 HydrophobicContact CG2-CG 4.21Å
283	W	96.6	Very high	89.3	Confident	56 Å²	56	56.2 Å²	56.2	21%	0.212	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	143	-177.4	-65.4	79.3	0	0	0	110.2	L270 Q272 K273 A294 I295	L270-W283 HydrophobicContact CB-CD2 4.18Å; L270-W283 HydrophobicContact CB-CE3 3.95Å; L270-W283 HydrophobicContact CB-CG 4.42Å; L270-W283 HydrophobicContact CD1-CD2 4.35Å; L270-W283 HydrophobicContact CD1-CG 4.4Å; L270-W283 HydrophobicContact CD2-CB 3.85Å; L270-W283 HydrophobicContact CD2-CG 4.06Å; Q272-W283 CarbonylContact O-C 3.58Å; Q272-W283 WeakPolarHBondContact O-CA 3.49Å; K273-W283 HydrophobicContact CB-CD2 4.14Å; K273-W283 HydrophobicContact CB-CE3 3.95Å; K273-W283 HydrophobicContact CB-CH2 3.93Å; K273-W283 HydrophobicContact CB-CZ2 4.11Å; K273-W283 HydrophobicContact CB-CZ3 3.86Å; K273-W283 HydrophobicContact CD-CH2 4.44Å; K273-W283 HydrophobicContact CD-CZ2 4.09Å; K273-W283 HydrophobicContact CG-CD2 4.31Å; K273-W283 HydrophobicContact CG-CH2 4.37Å; K273-W283 HydrophobicContact CG-CZ2 4.05Å; K273-W283 VanDerWaalsContact N-CE3 3.32Å; W283-A294 CarbonylContact O-C 3.5Å; W283-A294 WeakPolarHBondContact O-CA 3.41Å; W283-I295 PolarHBondContact N-O 3.41Å; W283-I295 PolarHBondContact O-N 3.06Å
284	R	96.8	Very high	89.4	Confident	67 Å²	67	52.8 Å²	52.8	25%	0.253	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	137.1	156.4	-171.3	-175.6	78.3	-146	-3.7	107.1	E271 Q272 L274 Y341	E271-R284 WeakPolarHBondContact CB-O 3.38Å; E271-R284 PolarHBondContact N-O 3.44Å; E271-R284 IonicContact OE2-CZ 3.99Å; E271-R284 IonicContact OE2-NE 3.16Å; E271-R284 PolarHBondContact OE2-NE 3.3Å; E271-R284 VanDerWaalsContact OE2-NE 3.07Å; E271-R284 IonicContact OE2-NH2 3.06Å; E271-R284 PolarHBondContact OE2-NH2 3.21Å; Q272-R284 HydrophobicContact CB-CB 4.36Å; Q272-R284 PolarHBondContact N-O 3.35Å; Q272-R284 VanDerWaalsContact N-O 3.13Å; Q272-R284 PolarHBondContact O-N 3.31Å; Q272-R284 VanDerWaalsContact OE1-CZ 3.31Å; L274-R284 HydrophobicContact CD1-CB 4Å; L274-R284 HydrophobicContact CD2-CB 4.03Å; L274-R284 HydrophobicContact CG-CB 4.06Å; R284-Y341 HydrophobicContact CB-CD2 4.4Å; R284-Y341 HydrophobicContact CB-CE2 4.07Å; R284-Y341 HydrophobicContact CG-CD2 3.91Å; R284-Y341 HydrophobicContact CG-CE2 3.74Å; R284-Y341 HydrophobicContact CG-CG 4.41Å
285	G	96.7	Very high	89.6	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	-172.3	176.7	0	0	0	0	0	113	F269 V293	F269-G285 CarbonylContact O-C 3.49Å; F269-G285 WeakPolarHBondContact O-CA 3.15Å; G285-V293 PolarHBondContact N-O 2.83Å; G285-V293 PolarHBondContact O-N 2.87Å
286	T	96.7	Very high	89.9	Confident	12 Å²	12	48.6 Å²	48.6	7%	0.074	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	142.1	174.4	42.6	0	0	0	0	110.4	L268 F269 E271 T291 K292	L268-T286 WeakPolarHBondContact CA-O 3.31Å; F269-T286 PolarHBondContact N-O 3.29Å; F269-T286 PolarHBondContact O-N 3.08Å; E271-T286 VanDerWaalsContact OE1-CG2 3.26Å; E271-T286 WeakPolarHBondContact OE1-CG2 3.46Å; T286-T291 CarbonylContact C-O 3.59Å; T286-T291 VanDerWaalsContact CA-O 3.3Å; T286-T291 WeakPolarHBondContact CA-O 3.36Å; T286-K292 HydrophobicContact CG2-CG 4.46Å
287	W	95.9	Very high	90.2	Very high	9 Å²	9	43.2 Å²	43.2	3%	0.034	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	132.2	165.9	175.6	68.6	0	0	0	108.8	R96 T97 L256 A257 A260 S267 L268 G289 N290 T291 V293	R96-W287 HydrophobicContact CB-CE3 4.39Å; R96-W287 HydrophobicContact CB-CH2 4.33Å; R96-W287 HydrophobicContact CB-CZ3 3.58Å; R96-W287 HydrophobicContact CG-CZ3 4.45Å; T97-W287 HydrophobicContact CG2-CH2 3.63Å; T97-W287 HydrophobicContact CG2-CZ2 4.32Å; T97-W287 HydrophobicContact CG2-CZ3 4.48Å; L256-W287 HydrophobicContact CB-CD2 4.11Å; L256-W287 HydrophobicContact CB-CE3 3.77Å; L256-W287 HydrophobicContact CB-CH2 3.75Å; L256-W287 HydrophobicContact CB-CZ2 4.09Å; L256-W287 HydrophobicContact CB-CZ3 3.58Å; L256-W287 HydrophobicContact CD1-CD2 3.79Å; L256-W287 HydrophobicContact CD1-CE3 4.22Å; L256-W287 HydrophobicContact CD1-CG 3.91Å; L256-W287 HydrophobicContact CD2-CB 4.42Å; L256-W287 HydrophobicContact CD2-CD2 4.06Å; L256-W287 HydrophobicContact CD2-CE3 3.75Å; L256-W287 HydrophobicContact CD2-CG 4.36Å; L256-W287 HydrophobicContact CD2-CZ3 4.36Å; L256-W287 HydrophobicContact CG-CD2 4.18Å; L256-W287 HydrophobicContact CG-CE3 4.09Å; L256-W287 HydrophobicContact CG-CZ3 4.4Å; A257-W287 HydrophobicContact CB-CH2 3.74Å; A257-W287 HydrophobicContact CB-CZ3 4.45Å; A260-W287 HydrophobicContact CB-CZ2 4.24Å; S267-W287 WeakPolarHBondContact O-CA 3.43Å; S267-W287 PolarHBondContact OG-NE1 3.22Å; L268-W287 HydrophobicContact CD2-CB 3.95Å; L268-W287 HydrophobicContact CD2-CG 4.29Å; W287-G289 PolarHBondContact O-N 3.21Å; W287-N290 PolarHBondContact O-N 3.36Å; W287-T291 HydrophobicContact CE3-CG2 4.3Å; W287-T291 PolarHBondContact N-O 2.5Å; W287-T291 PolarHBondContact O-N 3Å; W287-V293 HydrophobicContact CB-CG1 4.25Å; W287-V293 HydrophobicContact CB-CG2 4.41Å
288	N	92.9	Very high	90.7	Very high	71 Å²	71	41.6 Å²	41.6	38%	0.38	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	31.8	-175.8	-73.6	-2.9	0	0	0	114	R96 S267 N290	R96-N288 PolarHBondContact O-ND2 3.38Å; R96-N288 VanDerWaalsContact O-ND2 3.12Å; S267-N288 WeakPolarHBondContact CB-OD1 3.41Å; S267-N288 PolarHBondContact O-N 2.79Å; N288-N290 PolarHBondContact O-N 2.9Å; N288-N290 VanDerWaalsContact O-N 3.08Å
289	G	89	Confident	91.3	Very high	62 Å²	62	41.5 Å²	41.5	64%	0.639	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.9	-20.4	175.5	0	0	0	0	0	116.6	W287	W287-G289 PolarHBondContact O-N 3.21Å
290	N	84.3	Confident	91.8	Very high	65 Å²	65	39.6 Å²	39.6	35%	0.348	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-27.6	-175.9	68.4	5.8	0	0	0	114.6	A95 W287 N288 K292	A95-N290 PolarHBondContact O-ND2 3.02Å; A95-N290 VanDerWaalsContact O-ND2 3.09Å; W287-N290 PolarHBondContact O-N 3.36Å; N288-N290 PolarHBondContact O-N 2.9Å; N288-N290 VanDerWaalsContact O-N 3.08Å; N290-K292 PolarHBondContact O-N 3.36Å
291	T	92.2	Very high	91.3	Very high	15 Å²	15	42.5 Å²	42.5	9%	0.092	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	107.8	-171	-58.8	0	0	0	0	110.3	R96 L256 T286 W287 V293	R96-T291 VanDerWaalsContact CD-OG1 3.27Å; R96-T291 WeakPolarHBondContact CD-OG1 3.31Å; R96-T291 WeakPolarHBondContact CG-OG1 3.36Å; L256-T291 HydrophobicContact CD2-CG2 3.86Å; T286-T291 CarbonylContact C-O 3.59Å; T286-T291 VanDerWaalsContact CA-O 3.3Å; T286-T291 WeakPolarHBondContact CA-O 3.36Å; W287-T291 HydrophobicContact CE3-CG2 4.3Å; W287-T291 PolarHBondContact N-O 2.5Å; W287-T291 PolarHBondContact O-N 3Å; T291-V293 HydrophobicContact CG2-CG1 4.34Å; T291-V293 PolarHBondContact O-N 2.91Å
292	K	94.9	Very high	90.5	Very high	146 Å²	146	43.1 Å²	43.1	64%	0.635	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.8	129.7	178.9	-70.5	177.7	-176.6	169.2	0	111.5	T286 N290	T286-K292 HydrophobicContact CG2-CG 4.46Å; N290-K292 PolarHBondContact O-N 3.36Å
293	V	96.6	Very high	89.5	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	159.1	-177	-67.4	0	0	0	0	111.8	L256 L268 G285 W287 T291 I295 Y327 V338	L256-V293 HydrophobicContact CD2-CG1 4.05Å; L268-V293 HydrophobicContact CD2-CG2 4.44Å; G285-V293 PolarHBondContact N-O 2.83Å; G285-V293 PolarHBondContact O-N 2.87Å; W287-V293 HydrophobicContact CB-CG1 4.25Å; W287-V293 HydrophobicContact CB-CG2 4.41Å; T291-V293 HydrophobicContact CG2-CG1 4.34Å; T291-V293 PolarHBondContact O-N 2.91Å; V293-I295 HydrophobicContact CG2-CD1 3.84Å; V293-I295 HydrophobicContact CG2-CG1 3.78Å; V293-Y327 HydrophobicContact CG1-CD2 4.09Å; V293-Y327 HydrophobicContact CG1-CE2 4.47Å; V293-V338 HydrophobicContact CB-CG1 3.71Å; V293-V338 HydrophobicContact CG1-CG1 3.76Å; V293-V338 HydrophobicContact CG2-CG1 3.99Å
294	A	96.9	Very high	88.6	Confident	8 Å²	8	42.1 Å²	42.1	7%	0.066	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	127.7	163.6	0	0	0	0	0	109.2	W283 V338 T339 Y341	W283-A294 CarbonylContact O-C 3.5Å; W283-A294 WeakPolarHBondContact O-CA 3.41Å; A294-V338 WeakPolarHBondContact O-CA 3.18Å; A294-T339 PolarHBondContact N-O 2.85Å; A294-T339 PolarHBondContact O-N 2.92Å; A294-T339 PolarHBondContact O-OG1 3.02Å; A294-Y341 HydrophobicContact CB-CD2 4.42Å
295	I	96.1	Very high	87.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	111.4	-175.3	-58.1	160	0	0	0	108.4	L268 L270 W283 V293 T297 Y336 I337	L268-I295 HydrophobicContact CB-CD1 4.04Å; L268-I295 HydrophobicContact CD2-CD1 4.06Å; L268-I295 HydrophobicContact CD2-CG1 4.42Å; L268-I295 HydrophobicContact CG-CD1 4.49Å; L270-I295 HydrophobicContact CD2-CB 3.83Å; L270-I295 HydrophobicContact CD2-CD1 3.58Å; L270-I295 HydrophobicContact CD2-CG1 4.32Å; L270-I295 HydrophobicContact CD2-CG2 3.72Å; W283-I295 PolarHBondContact N-O 3.41Å; W283-I295 PolarHBondContact O-N 3.06Å; V293-I295 HydrophobicContact CG2-CD1 3.84Å; V293-I295 HydrophobicContact CG2-CG1 3.78Å; I295-T297 HydrophobicContact CG2-CG2 4.16Å; I295-Y336 HydrophobicContact CG2-CD2 3.68Å; I295-Y336 HydrophobicContact CG2-CE2 4.26Å; I295-Y336 HydrophobicContact CG2-CG 3.94Å; I295-I337 WeakPolarHBondContact CA-O 3.48Å
296	K	93.1	Very high	87.2	Confident	21 Å²	21	46.7 Å²	46.7	9%	0.091	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	117.4	174.2	-175.9	175.7	-170.6	175.6	0	109	A280 E281 V282 Y336 I337 D405	A280-K296 HydrophobicContact CB-CD 4.3Å; A280-K296 HydrophobicContact CB-CG 3.8Å; E281-K296 CarbonylContact O-C 3.55Å; E281-K296 VanDerWaalsContact O-CA 3.29Å; E281-K296 WeakPolarHBondContact O-CA 3.3Å; V282-K296 HydrophobicContact CG2-CB 4.49Å; V282-K296 HydrophobicContact CG2-CG 4.21Å; K296-Y336 CarbonylContact O-C 3.55Å; K296-Y336 WeakPolarHBondContact O-CA 3.48Å; K296-I337 HydrophobicContact CB-CB 4.23Å; K296-I337 HydrophobicContact CD-CD1 4.46Å; K296-I337 PolarHBondContact N-O 3.27Å; K296-I337 PolarHBondContact O-N 2.97Å; K296-D405 IonicContact NZ-OD1 3.25Å; K296-D405 PolarHBondContact NZ-OD1 3.22Å; K296-D405 IonicContact NZ-OD2 3.61Å; K296-D405 PolarHBondContact NZ-OD2 3.39Å
297	T	92	Very high	86.3	Confident	16 Å²	16	48.7 Å²	48.7	10%	0.098	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	119.2	-179.7	66.9	0	0	0	0	109.3	L270 A280 E281 I295 Y336	L270-T297 HydrophobicContact CD1-CG2 4.44Å; A280-T297 CarbonylContact C-O 3.6Å; A280-T297 WeakPolarHBondContact CA-O 3.47Å; A280-T297 WeakPolarHBondContact CB-O 3.33Å; E281-T297 PolarHBondContact N-O 3.36Å; E281-T297 PolarHBondContact O-N 2.9Å; E281-T297 PolarHBondContact O-OG1 3.05Å; I295-T297 HydrophobicContact CG2-CG2 4.16Å; T297-Y336 HydrophobicContact CG2-CD1 3.57Å; T297-Y336 HydrophobicContact CG2-CE1 3.28Å; T297-Y336 HydrophobicContact CG2-CE2 4.29Å; T297-Y336 HydrophobicContact CG2-CG 4.2Å
298	L	85.3	Confident	85.7	Confident	7 Å²	7	48.5 Å²	48.5	4%	0.037	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	138.8	175.9	-65.1	178.6	0	0	0	110	A280 M303 F308 I335	A280-L298 HydrophobicContact CB-CD2 3.86Å; L298-M303 HydrophobicContact CD1-CG 4.25Å; L298-M303 HydrophobicContact CD1-SD 3.69Å; L298-F308 HydrophobicContact CD1-CD2 4.49Å; L298-I335 HydrophobicContact CB-CB 4.25Å; L298-I335 HydrophobicContact CD1-CB 4.06Å; L298-I335 HydrophobicContact CD1-CG2 3.86Å; L298-I335 HydrophobicContact CG-CB 4.49Å; L298-I335 HydrophobicContact CG-CG2 4.49Å; L298-I335 PolarHBondContact N-O 3.14Å
299	K	81.7	Confident	85.2	Confident	88 Å²	88	47.1 Å²	47.1	38%	0.383	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-65.9	141	173.2	-67.7	178.2	-176.9	170	0	109.6	C278 F279 T302	C278-K299 PolarHBondContact O-NZ 3.21Å; F279-K299 PolarHBondContact O-N 3.39Å; K299-T302 VanDerWaalsContact O-CB 3.29Å; K299-T302 WeakPolarHBondContact O-CB 3.38Å; K299-T302 PolarHBondContact O-N 2.96Å; K299-T302 PolarHBondContact O-OG1 3.17Å
300	P	82.6	Confident	84.9	Confident	92 Å²	92	50.8 Å²	50.8	60%	0.597	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	140.8	177	-27.2	34.8	0	0	0	112.4	T302	P300-T302 VanDerWaalsContact C-N 3.29Å; P300-T302 PolarHBondContact O-N 3.13Å
301	G	74	Confident	84.4	Confident	69 Å²	69	49.2 Å²	49.2	71%	0.711	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	9.2	-178.7	0	0	0	0	0	115.4	E333	G301-E333 PolarHBondContact N-OE1 3.05Å
302	T	71.9	Confident	84	Confident	55 Å²	55	48.5 Å²	48.5	34%	0.337	27%	0.272	S	S	.	.	S	Bend	trans	-69.3	-40	173.9	-61.7	0	0	0	0	111.7	F279 K299 P300	F279-T302 HydrophobicContact CB-CG2 4.01Å; K299-T302 VanDerWaalsContact O-CB 3.29Å; K299-T302 WeakPolarHBondContact O-CB 3.38Å; K299-T302 PolarHBondContact O-N 2.96Å; K299-T302 PolarHBondContact O-OG1 3.17Å; P300-T302 VanDerWaalsContact C-N 3.29Å; P300-T302 PolarHBondContact O-N 3.13Å
303	M	72.6	Confident	83.4	Confident	36 Å²	36	45.1 Å²	45.1	18%	0.177	26%	0.258	C	S	.	.	S	Bend	trans	-159.7	159.7	178.5	65.2	-167.4	-54.1	0	0	110.2	L298 F308 E311 I335	L298-M303 HydrophobicContact CD1-CG 4.25Å; L298-M303 HydrophobicContact CD1-SD 3.69Å; M303-F308 VanDerWaalsContact CE-CA 3.41Å; M303-F308 HydrophobicContact CE-CB 3.62Å; M303-F308 HydrophobicContact CE-CD2 4.17Å; M303-F308 HydrophobicContact CE-CG 4.42Å; M303-F308 HydrophobicContact CG-CB 4.1Å; M303-F308 HydrophobicContact SD-CB 3.83Å; M303-F308 HydrophobicContact SD-CD2 3.85Å; M303-F308 HydrophobicContact SD-CG 4.26Å; M303-E311 WeakPolarHBondContact CE-OE2 3.31Å; M303-I335 HydrophobicContact CG-CD1 4.12Å
304	S	78.8	Confident	82.5	Confident	46 Å²	46	46.7 Å²	46.7	32%	0.322	27%	0.266	S	S	.	.			trans	-75.9	147.5	174.8	91.7	0	0	0	0	111	E306 S307 F308	S304-E306 WeakPolarHBondContact CB-OE2 3.4Å; S304-E306 PolarHBondContact O-N 3.49Å; S304-E306 PolarHBondContact OG-OE2 3.47Å; S304-S307 PolarHBondContact O-N 3.04Å; S304-S307 PolarHBondContact OG-N 3.38Å; S304-S307 PolarHBondContact OG-OG 3.07Å; S304-F308 WeakPolarHBondContact O-CB 3.38Å; S304-F308 PolarHBondContact O-N 3.17Å
305	P	82.4	Confident	81.7	Confident	39 Å²	39	47.1 Å²	47.1	25%	0.253	27%	0.267	S	S	.	.	H	α-helix	trans	-54.4	-36.8	175.6	-29.4	37.6	0	0	0	113.9	F308 L309	P305-F308 PolarHBondContact O-N 3.37Å; P305-L309 WeakPolarHBondContact O-CB 3.35Å; P305-L309 WeakPolarHBondContact O-CG 3.31Å; P305-L309 PolarHBondContact O-N 3.29Å
306	E	82.3	Confident	81.1	Confident	123 Å²	123	51.2 Å²	51.2	58%	0.575	29%	0.285	S	S	*	.	H	α-helix	trans	-67	-48.9	180	-54	75.3	-163	0	0	110.8	S304 F308 L309 E310	S304-E306 WeakPolarHBondContact CB-OE2 3.4Å; S304-E306 PolarHBondContact O-N 3.49Å; S304-E306 PolarHBondContact OG-OE2 3.47Å; E306-F308 PolarHBondContact O-N 2.79Å; E306-L309 PolarHBondContact O-N 2.91Å; E306-E310 WeakPolarHBondContact O-CG 3.43Å; E306-E310 PolarHBondContact O-N 3.07Å; E306-E310 VanDerWaalsContact O-N 3.08Å
307	S	77.8	Confident	80.6	Confident	55 Å²	55	57.3 Å²	57.3	39%	0.385	31%	0.311	S	S	.	.	H	α-helix	trans	-61.3	-36.3	177.1	-54.4	0	0	0	0	111.1	S304 E311	S304-S307 PolarHBondContact O-N 3.04Å; S304-S307 PolarHBondContact OG-N 3.38Å; S304-S307 PolarHBondContact OG-OG 3.07Å; S307-E311 PolarHBondContact O-N 2.92Å
308	F	82.4	Confident	80.3	Confident	5 Å²	5	57.1 Å²	57.1	2%	0.022	31%	0.31	C	S	.	.	H	α-helix	trans	-67.1	-46.3	176.6	168.5	-105.3	0	0	0	112.6	L298 M303 S304 P305 E306 E310 E311 A312 V329 I335 I337	L298-F308 HydrophobicContact CD1-CD2 4.49Å; M303-F308 VanDerWaalsContact CE-CA 3.41Å; M303-F308 HydrophobicContact CE-CB 3.62Å; M303-F308 HydrophobicContact CE-CD2 4.17Å; M303-F308 HydrophobicContact CE-CG 4.42Å; M303-F308 HydrophobicContact CG-CB 4.1Å; M303-F308 HydrophobicContact SD-CB 3.83Å; M303-F308 HydrophobicContact SD-CD2 3.85Å; M303-F308 HydrophobicContact SD-CG 4.26Å; S304-F308 WeakPolarHBondContact O-CB 3.38Å; S304-F308 PolarHBondContact O-N 3.17Å; P305-F308 PolarHBondContact O-N 3.37Å; E306-F308 PolarHBondContact O-N 2.79Å; F308-E310 VanDerWaalsContact C-N 3.31Å; F308-E310 PolarHBondContact O-N 3.3Å; F308-E311 PolarHBondContact O-N 2.93Å; F308-A312 HydrophobicContact CE1-CB 4.48Å; F308-A312 HydrophobicContact CE2-CB 4.44Å; F308-A312 HydrophobicContact CZ-CB 4.24Å; F308-A312 WeakPolarHBondContact O-CB 3.49Å; F308-A312 PolarHBondContact O-N 3.01Å; F308-V329 HydrophobicContact CE1-CB 3.75Å; F308-V329 HydrophobicContact CE1-CG1 3.91Å; F308-V329 HydrophobicContact CE1-CG2 4.15Å; F308-V329 HydrophobicContact CZ-CB 3.84Å; F308-V329 HydrophobicContact CZ-CG1 3.57Å; F308-I335 HydrophobicContact CB-CD1 3.94Å; F308-I335 HydrophobicContact CD1-CD1 4.18Å; F308-I335 HydrophobicContact CD1-CG1 4.48Å; F308-I335 HydrophobicContact CD1-CG2 3.61Å; F308-I335 HydrophobicContact CD2-CG2 3.93Å; F308-I335 HydrophobicContact CE1-CG2 3.42Å; F308-I335 VanDerWaalsContact CE1-CG2 3.42Å; F308-I335 HydrophobicContact CE2-CG2 3.76Å; F308-I335 HydrophobicContact CG-CD1 4.02Å; F308-I335 HydrophobicContact CG-CG2 3.86Å; F308-I335 HydrophobicContact CZ-CG2 3.49Å; F308-I335 VanDerWaalsContact CZ-CG2 3.49Å; F308-I337 HydrophobicContact CE2-CD1 3.76Å; F308-I337 HydrophobicContact CE2-CG1 3.61Å; F308-I337 HydrophobicContact CZ-CD1 4.42Å; F308-I337 HydrophobicContact CZ-CG1 3.77Å
309	L	83.3	Confident	80.4	Confident	42 Å²	42	62.1 Å²	62.1	22%	0.22	33%	0.331	C	S	.	.	H	α-helix	trans	-62.8	-39.3	179.4	-80.7	171.2	0	0	0	111.4	E262 P305 E306 A312 Q313 V329	E262-L309 HydrophobicContact CG-CD2 4.45Å; P305-L309 WeakPolarHBondContact O-CB 3.35Å; P305-L309 WeakPolarHBondContact O-CG 3.31Å; P305-L309 PolarHBondContact O-N 3.29Å; E306-L309 PolarHBondContact O-N 2.91Å; L309-A312 PolarHBondContact O-N 3.42Å; L309-Q313 VanDerWaalsContact O-CG 3.29Å; L309-Q313 WeakPolarHBondContact O-CG 3.46Å; L309-Q313 PolarHBondContact O-N 3.23Å; L309-V329 HydrophobicContact CD2-CG2 4.11Å
310	E	80.9	Confident	80.9	Confident	138 Å²	138	60.5 Å²	60.5	65%	0.645	33%	0.325	S	S	*	.	H	α-helix	trans	-58.2	-47.9	173.4	-72.3	177.2	-179.8	0	0	111.9	E306 F308 Q313 I314	E306-E310 WeakPolarHBondContact O-CG 3.43Å; E306-E310 PolarHBondContact O-N 3.07Å; E306-E310 VanDerWaalsContact O-N 3.08Å; F308-E310 VanDerWaalsContact C-N 3.31Å; F308-E310 PolarHBondContact O-N 3.3Å; E310-Q313 PolarHBondContact O-N 2.95Å; E310-I314 WeakPolarHBondContact O-CD1 3.4Å
311	E	75.5	Confident	81.3	Confident	32 Å²	32	61.6 Å²	61.6	15%	0.15	33%	0.326	C	S	.	.	H	α-helix	trans	-63.3	-43.8	176.2	-73.1	-177.6	179.3	0	0	111.7	M303 S307 F308 Q313 I314 M315	M303-E311 WeakPolarHBondContact CE-OE2 3.31Å; S307-E311 PolarHBondContact O-N 2.92Å; F308-E311 PolarHBondContact O-N 2.93Å; E311-Q313 VanDerWaalsContact C-N 3.34Å; E311-Q313 PolarHBondContact O-N 3.38Å; E311-I314 WeakPolarHBondContact O-CB 3.46Å; E311-I314 PolarHBondContact O-N 3.36Å; E311-I314 VanDerWaalsContact O-N 3.12Å; E311-M315 WeakPolarHBondContact O-CG 3.42Å; E311-M315 PolarHBondContact O-N 3.13Å; E311-M315 VanDerWaalsContact O-N 3.1Å
312	A	82.8	Confident	82.4	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.8	-35.5	179.9	0	0	0	0	0	112.8	W261 F308 L309 I314 M315 K316 L326 V329	W261-A312 HydrophobicContact CH2-CB 4.03Å; W261-A312 WeakPolarHBondContact CH2-O 3.41Å; W261-A312 HydrophobicContact CZ2-CB 3.77Å; F308-A312 HydrophobicContact CE1-CB 4.48Å; F308-A312 HydrophobicContact CE2-CB 4.44Å; F308-A312 HydrophobicContact CZ-CB 4.24Å; F308-A312 WeakPolarHBondContact O-CB 3.49Å; F308-A312 PolarHBondContact O-N 3.01Å; L309-A312 PolarHBondContact O-N 3.42Å; A312-I314 PolarHBondContact O-N 3.17Å; A312-M315 PolarHBondContact O-N 3.15Å; A312-K316 WeakPolarHBondContact O-CB 3.48Å; A312-K316 PolarHBondContact O-N 3.39Å; A312-L326 HydrophobicContact CB-CD2 4.4Å; A312-V329 HydrophobicContact CB-CG1 4.1Å
313	Q	82.8	Confident	83.4	Confident	76 Å²	76	56.5 Å²	56.5	36%	0.355	28%	0.279	S	S	.	.	H	α-helix	trans	-64.1	-29.6	175.6	-72.7	-60.4	-23.3	0	0	112.7	L309 E310 E311 K317	L309-Q313 VanDerWaalsContact O-CG 3.29Å; L309-Q313 WeakPolarHBondContact O-CG 3.46Å; L309-Q313 PolarHBondContact O-N 3.23Å; E310-Q313 PolarHBondContact O-N 2.95Å; E311-Q313 VanDerWaalsContact C-N 3.34Å; E311-Q313 PolarHBondContact O-N 3.38Å; Q313-K317 WeakPolarHBondContact O-CG 3.36Å
314	I	78.3	Confident	84.4	Confident	32 Å²	32	55.1 Å²	55.1	16%	0.164	27%	0.273	C	S	.	.	H	α-helix	trans	-77	-46	175.9	-58.6	148.3	0	0	0	109.6	E310 E311 A312 K316 K317 L318 Y383 L411	E310-I314 WeakPolarHBondContact O-CD1 3.4Å; E311-I314 WeakPolarHBondContact O-CB 3.46Å; E311-I314 PolarHBondContact O-N 3.36Å; E311-I314 VanDerWaalsContact O-N 3.12Å; A312-I314 PolarHBondContact O-N 3.17Å; I314-K316 PolarHBondContact O-N 3.47Å; I314-K317 WeakPolarHBondContact O-CB 3.41Å; I314-K317 PolarHBondContact O-N 3.39Å; I314-L318 PolarHBondContact O-N 3.03Å; I314-Y383 HydrophobicContact CG2-CD2 4.24Å; I314-Y383 HydrophobicContact CG2-CE2 3.61Å; I314-L411 HydrophobicContact CD1-CD1 3.15Å; I314-L411 HydrophobicContact CD1-CG 3.66Å; I314-L411 HydrophobicContact CG1-CD1 4.16Å
315	M	79.1	Confident	85	Confident	18 Å²	18	55 Å²	55	9%	0.089	27%	0.267	C	S	.	.	H	α-helix	trans	-54	-40.5	174.6	-65.7	175.3	71.7	0	0	111.9	E311 A312 K317 L318 L326 F406 G407	E311-M315 WeakPolarHBondContact O-CG 3.42Å; E311-M315 PolarHBondContact O-N 3.13Å; E311-M315 VanDerWaalsContact O-N 3.1Å; A312-M315 PolarHBondContact O-N 3.15Å; M315-K317 PolarHBondContact O-N 3.04Å; M315-L318 PolarHBondContact O-N 2.85Å; M315-L318 VanDerWaalsContact O-N 3.14Å; M315-L326 HydrophobicContact CB-CD2 3.57Å; M315-L326 HydrophobicContact CE-CD1 4.47Å; M315-L326 HydrophobicContact CE-CD2 4.03Å; M315-L326 HydrophobicContact CG-CD2 4.46Å; M315-L326 HydrophobicContact SD-CD2 4.03Å; M315-F406 HydrophobicContact CB-CE2 4.35Å; M315-F406 HydrophobicContact CG-CE2 4.39Å; M315-G407 VanDerWaalsContact CG-CA 3.48Å; M315-G407 WeakPolarHBondContact SD-CA 3.36Å
316	K	82.8	Confident	85.5	Confident	86 Å²	86	53.8 Å²	53.8	37%	0.374	26%	0.258	S	S	.	.	H	α-helix	trans	-59.2	-31.2	177	-171.2	-179.7	-177	174.2	0	113.3	W261 A312 I314	W261-K316 HydrophobicContact CD2-CD 3.93Å; W261-K316 HydrophobicContact CE3-CD 3.71Å; W261-K316 HydrophobicContact CE3-CG 4.23Å; W261-K316 HydrophobicContact CH2-CB 3.76Å; W261-K316 HydrophobicContact CH2-CD 3.98Å; W261-K316 HydrophobicContact CH2-CG 4.14Å; W261-K316 HydrophobicContact CZ2-CB 4.48Å; W261-K316 HydrophobicContact CZ2-CD 4.23Å; W261-K316 HydrophobicContact CZ3-CB 3.91Å; W261-K316 HydrophobicContact CZ3-CD 3.73Å; W261-K316 HydrophobicContact CZ3-CG 3.83Å; A312-K316 WeakPolarHBondContact O-CB 3.48Å; A312-K316 PolarHBondContact O-N 3.39Å; I314-K316 PolarHBondContact O-N 3.47Å
317	K	83.4	Confident	85.9	Confident	149 Å²	149	48.3 Å²	48.3	65%	0.648	23%	0.233	S	C	*	.	H	α-helix	trans	-80	-23.7	179.4	-66.8	172.5	-175.6	176.9	0	112.6	Q313 I314 M315 K319	Q313-K317 WeakPolarHBondContact O-CG 3.36Å; I314-K317 WeakPolarHBondContact O-CB 3.41Å; I314-K317 PolarHBondContact O-N 3.39Å; M315-K317 PolarHBondContact O-N 3.04Å; K317-K319 PolarHBondContact O-N 3.15Å; K317-K319 VanDerWaalsContact O-N 3.16Å
318	L	85.9	Confident	86.7	Confident	12 Å²	12	45.7 Å²	45.7	6%	0.063	21%	0.214	C	C	.	.			trans	-80.5	94.8	179.4	-62.5	177.5	0	0	0	109.8	I314 M315 L323 Y377 M381 Y383 F406	I314-L318 PolarHBondContact O-N 3.03Å; M315-L318 PolarHBondContact O-N 2.85Å; M315-L318 VanDerWaalsContact O-N 3.14Å; L318-L323 HydrophobicContact CB-CD1 4.18Å; L318-Y377 HydrophobicContact CB-CE1 4.25Å; L318-Y377 HydrophobicContact CD2-CE1 4.04Å; L318-M381 HydrophobicContact CD2-CB 3.75Å; L318-M381 HydrophobicContact CD2-CE 4.26Å; L318-M381 HydrophobicContact CD2-CG 3.81Å; L318-Y383 HydrophobicContact CD1-CD1 3.97Å; L318-Y383 HydrophobicContact CD1-CE1 4.15Å; L318-Y383 HydrophobicContact CD1-CG 4.22Å; L318-F406 HydrophobicContact CB-CE2 4.04Å; L318-F406 HydrophobicContact CD1-CD2 3.79Å; L318-F406 HydrophobicContact CD1-CE2 3.81Å
319	K	88	Confident	87.2	Confident	111 Å²	111	45.4 Å²	45.4	48%	0.483	21%	0.213	S	C	.	.			trans	-114.7	111.4	-179.6	-66.5	-177.9	177.5	-180	0	109.8	D118 V254 K317 Y377	D118-K319 IonicContact OD2-NZ 3.88Å; D118-K319 PolarHBondContact OD2-NZ 3.2Å; V254-K319 HydrophobicContact CG1-CD 4.37Å; V254-K319 VanDerWaalsContact CG1-NZ 3.28Å; K317-K319 PolarHBondContact O-N 3.15Å; K317-K319 VanDerWaalsContact O-N 3.16Å; K319-Y377 PolarHBondContact N-OH 2.79Å; K319-Y377 VanDerWaalsContact N-OH 3.08Å; K319-Y377 PolarHBondContact O-OH 2.81Å
320	H	91.6	Very high	87.8	Confident	55 Å²	55	43.7 Å²	43.7	26%	0.255	21%	0.205	S	C	.	.			trans	-157.7	144.3	177.4	-177	-97.4	0	0	0	111.2	K322 L323 Y377	H320-K322 PolarHBondContact ND1-N 3.38Å; H320-K322 VanDerWaalsContact ND1-N 3.13Å; H320-K322 PolarHBondContact O-N 2.97Å; H320-L323 HydrophobicContact CB-CB 4.44Å; H320-L323 HydrophobicContact CB-CD1 4.12Å; H320-L323 HydrophobicContact CB-CG 3.99Å; H320-L323 PolarHBondContact O-N 2.81Å; H320-Y377 HydrophobicContact CB-CD1 3.59Å; H320-Y377 HydrophobicContact CB-CD2 4.09Å; H320-Y377 HydrophobicContact CB-CE1 3.82Å; H320-Y377 HydrophobicContact CB-CE2 4.31Å; H320-Y377 HydrophobicContact CB-CG 3.72Å; H320-Y377 AromaticContact CD2-CD2 3.79Å; H320-Y377 AromaticContact CD2-CG 3.72Å; H320-Y377 AromaticContact CG-CG 3.74Å
321	D	91.2	Very high	88.2	Confident	115 Å²	115	38.2 Å²	38.2	62%	0.615	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-19	-174.3	-67	-10.4	0	0	0	114.7	K402	D321-K402 WeakPolarHBondContact O-CE 3.48Å
322	K	95.5	Very high	88.8	Confident	14 Å²	14	43.5 Å²	43.5	6%	0.061	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	13.4	178.4	-50.8	-59.6	-174.5	-77.5	0	112.9	D158 H320 Q370 A373 C401 K402 I403	D158-K322 IonicContact OD1-NZ 2.76Å; D158-K322 PolarHBondContact OD1-NZ 2.92Å; H320-K322 PolarHBondContact ND1-N 3.38Å; H320-K322 VanDerWaalsContact ND1-N 3.13Å; H320-K322 PolarHBondContact O-N 2.97Å; K322-Q370 WeakPolarHBondContact CB-O 3.49Å; K322-Q370 HydrophobicContact CD-CB 4.03Å; K322-Q370 HydrophobicContact CD-CG 4.28Å; K322-Q370 WeakPolarHBondContact CG-O 3.46Å; K322-A373 HydrophobicContact CG-CB 4.37Å; K322-C401 WeakPolarHBondContact CD-O 3.32Å; K322-K402 CarbonylContact O-C 3.54Å; K322-K402 WeakPolarHBondContact O-CA 3.34Å; K322-I403 PolarHBondContact O-N 3.44Å
323	L	94.3	Very high	89	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.016	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-114.5	142.1	168.9	-60.4	-173.4	0	0	0	109.3	L318 H320 Q325 Y377 I378 I403 F406	L318-L323 HydrophobicContact CB-CD1 4.18Å; H320-L323 HydrophobicContact CB-CB 4.44Å; H320-L323 HydrophobicContact CB-CD1 4.12Å; H320-L323 HydrophobicContact CB-CG 3.99Å; H320-L323 PolarHBondContact O-N 2.81Å; L323-Q325 PolarHBondContact O-N 3.26Å; L323-Y377 HydrophobicContact CD1-CD1 3.63Å; L323-Y377 HydrophobicContact CD1-CE1 3.76Å; L323-Y377 HydrophobicContact CG-CD1 4.45Å; L323-I378 HydrophobicContact CD1-CG1 4.22Å; L323-I378 HydrophobicContact CD2-CD1 3.73Å; L323-I378 HydrophobicContact CD2-CG1 4.14Å; L323-I403 HydrophobicContact CD2-CB 3.73Å; L323-I403 HydrophobicContact CD2-CD1 3.83Å; L323-I403 HydrophobicContact CD2-CG1 4.2Å; L323-I403 HydrophobicContact CD2-CG2 4.39Å; L323-F406 HydrophobicContact CB-CE1 3.93Å; L323-F406 HydrophobicContact CB-CZ 4.23Å; L323-F406 HydrophobicContact CD1-CZ 4.39Å; L323-F406 HydrophobicContact CD2-CD1 4.43Å
324	V	93.9	Very high	89.3	Confident	7 Å²	7	46.8 Å²	46.8	4%	0.042	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-68	124.1	173.5	172.6	0	0	0	0	109	L326 T339 E340 L394 K402 I403 A404 F406	V324-L326 PolarHBondContact O-N 3.1Å; V324-T339 HydrophobicContact CG1-CG2 4.12Å; V324-E340 HydrophobicContact CG1-CG 3.86Å; V324-L394 HydrophobicContact CG2-CB 4.47Å; V324-L394 HydrophobicContact CG2-CD1 3.96Å; V324-L394 HydrophobicContact CG2-CG 4.41Å; V324-K402 HydrophobicContact CG2-CB 3.64Å; V324-I403 PolarHBondContact N-O 3.35Å; V324-A404 HydrophobicContact CB-CB 4.37Å; V324-A404 HydrophobicContact CG2-CB 3.85Å; V324-F406 WeakPolarHBondContact O-CE1 3.48Å; V324-F406 WeakPolarHBondContact O-CZ 3.36Å
325	Q	91.7	Very high	89.9	Confident	43 Å²	43	45.4 Å²	45.4	20%	0.201	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-72.9	126.5	-178.3	-171.4	174.1	-8.3	0	0	111.5	T253 L323 Y327 T339 E340	T253-Q325 PolarHBondContact O-NE2 3.32Å; L323-Q325 PolarHBondContact O-N 3.26Å; Q325-Y327 HydrophobicContact CB-CE1 4.33Å; Q325-Y327 HydrophobicContact CG-CD1 4.05Å; Q325-Y327 HydrophobicContact CG-CE1 3.95Å; Q325-T339 VanDerWaalsContact O-CA 3.32Å; Q325-T339 WeakPolarHBondContact O-CA 3.36Å; Q325-T339 WeakPolarHBondContact O-CB 3.47Å; Q325-E340 HydrophobicContact CB-CG 4.45Å; Q325-E340 WeakPolarHBondContact CB-OE1 3.19Å; Q325-E340 PolarHBondContact N-OE1 3.5Å; Q325-E340 PolarHBondContact O-N 3.41Å
326	L	91.3	Very high	90.6	Very high	13 Å²	13	45.9 Å²	45.9	7%	0.068	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	119.6	166.5	-179.2	62.4	0	0	0	109.2	W261 A312 M315 V324 V329 I337 V338 T339	W261-L326 HydrophobicContact CH2-CD2 3.43Å; W261-L326 VanDerWaalsContact CH2-CD2 3.43Å; W261-L326 HydrophobicContact CH2-CG 4.05Å; W261-L326 HydrophobicContact CZ3-CD2 3.8Å; W261-L326 HydrophobicContact CZ3-CG 3.89Å; A312-L326 HydrophobicContact CB-CD2 4.4Å; M315-L326 HydrophobicContact CB-CD2 3.57Å; M315-L326 HydrophobicContact CE-CD1 4.47Å; M315-L326 HydrophobicContact CE-CD2 4.03Å; M315-L326 HydrophobicContact CG-CD2 4.46Å; M315-L326 HydrophobicContact SD-CD2 4.03Å; V324-L326 PolarHBondContact O-N 3.1Å; L326-V329 HydrophobicContact CD1-CG1 4.32Å; L326-I337 HydrophobicContact CD1-CG2 3.39Å; L326-V338 WeakPolarHBondContact CD1-O 3.37Å; L326-T339 HydrophobicContact CD1-CG2 4.18Å
327	Y	91.7	Very high	91.1	Very high	8 Å²	8	42.4 Å²	42.4	3%	0.031	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-54	-178.1	-82.7	-23.7	0	0	0	112.1	Q252 L256 V293 Q325 V338 E340	Q252-Y327 PolarHBondContact OE1-OH 2.85Å; L256-Y327 HydrophobicContact CD2-CD2 3.8Å; L256-Y327 HydrophobicContact CD2-CE2 4.41Å; L256-Y327 HydrophobicContact CD2-CG 3.97Å; L256-Y327 HydrophobicContact CG-CD2 4.41Å; L256-Y327 HydrophobicContact CG-CG 4.09Å; V293-Y327 HydrophobicContact CG1-CD2 4.09Å; V293-Y327 HydrophobicContact CG1-CE2 4.47Å; Q325-Y327 HydrophobicContact CB-CE1 4.33Å; Q325-Y327 HydrophobicContact CG-CD1 4.05Å; Q325-Y327 HydrophobicContact CG-CE1 3.95Å; Y327-V338 WeakPolarHBondContact CB-O 3.33Å; Y327-V338 PolarHBondContact N-O 2.97Å; Y327-E340 VanDerWaalsContact CE2-CA 3.48Å; Y327-E340 HydrophobicContact CE2-CB 3.81Å
328	A	93.4	Very high	91.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	171.6	-174.6	0	0	0	0	0	111	L256 W261 V263 V338	L256-A328 HydrophobicContact CD1-CB 3.65Å; W261-A328 CarbonylContact O-C 3.53Å; W261-A328 WeakPolarHBondContact O-CA 3.18Å; W261-A328 VanDerWaalsContact O-CB 3.27Å; W261-A328 WeakPolarHBondContact O-CB 3.43Å; V263-A328 HydrophobicContact CB-CB 4.5Å; V263-A328 HydrophobicContact CG1-CB 3.76Å; V263-A328 HydrophobicContact CG2-CB 3.94Å; A328-V338 HydrophobicContact CB-CB 4.19Å; A328-V338 HydrophobicContact CB-CG2 4.42Å; A328-V338 PolarHBondContact N-O 3.23Å; A328-V338 WeakPolarHBondContact O-CA 3.4Å; A328-V338 WeakPolarHBondContact O-CB 3.08Å; A328-V338 PolarHBondContact O-N 2.85Å
329	V	94.2	Very high	92	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	155.9	175.3	-57.3	0	0	0	0	111.3	W261 E262 V263 F308 L309 A312 L326 Y336	W261-V329 HydrophobicContact CH2-CG1 4.13Å; W261-V329 HydrophobicContact CZ2-CG1 4.18Å; W261-V329 HydrophobicContact CZ2-CG2 4.25Å; W261-V329 PolarHBondContact O-N 3.25Å; E262-V329 WeakPolarHBondContact CA-O 3.26Å; E262-V329 HydrophobicContact CG-CG2 3.85Å; V263-V329 PolarHBondContact N-O 3.47Å; F308-V329 HydrophobicContact CE1-CB 3.75Å; F308-V329 HydrophobicContact CE1-CG1 3.91Å; F308-V329 HydrophobicContact CE1-CG2 4.15Å; F308-V329 HydrophobicContact CZ-CB 3.84Å; F308-V329 HydrophobicContact CZ-CG1 3.57Å; L309-V329 HydrophobicContact CD2-CG2 4.11Å; A312-V329 HydrophobicContact CB-CG1 4.1Å; L326-V329 HydrophobicContact CD1-CG1 4.32Å; V329-Y336 CarbonylContact C-O 3.57Å; V329-Y336 VanDerWaalsContact CA-O 3.3Å; V329-Y336 WeakPolarHBondContact CA-O 3.42Å
330	V	94.6	Very high	92.3	Very high	6 Å²	6	31.1 Å²	31.1	4%	0.036	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	109.1	160	-177.1	0	0	0	0	105.8	V263 R265 L268 I335 Y336	V263-V330 HydrophobicContact CG2-CG2 4.18Å; R265-V330 HydrophobicContact CB-CG1 4.31Å; L268-V330 HydrophobicContact CD1-CG2 3.75Å; V330-I335 WeakPolarHBondContact O-CA 3.4Å; V330-Y336 HydrophobicContact CB-CG 4.34Å; V330-Y336 HydrophobicContact CG2-CD2 4.18Å; V330-Y336 HydrophobicContact CG2-CG 4.26Å; V330-Y336 PolarHBondContact N-O 3.43Å; V330-Y336 PolarHBondContact O-N 3.14Å
331	S	89.7	Confident	92.4	Very high	22 Å²	22	31.9 Å²	31.9	15%	0.154	16%	0.158	C	C	.	.			trans	-77.1	-28	-173.8	48.7	0	0	0	0	113	E262 I335	E262-S331 WeakPolarHBondContact OE2-CB 3.21Å; E262-S331 PolarHBondContact OE2-OG 3.17Å; S331-I335 WeakPolarHBondContact O-CG1 3.46Å
332	E	89.4	Confident	92.6	Very high	144 Å²	144	27 Å²	27	67%	0.673	13%	0.132	S	C	*	.	S	Bend	trans	-68.9	142.7	175.2	-62.4	-177.6	171.5	0	0	112.1	R265 P334 I335	R265-E332 PolarHBondContact NH2-O 3.43Å; E332-P334 CarbonylContact O-C 3.13Å; E332-P334 VanDerWaalsContact O-O 3.06Å; E332-I335 PolarHBondContact O-N 2.94Å
333	E	86.4	Confident	92.5	Very high	97 Å²	97	28.8 Å²	28.8	45%	0.453	15%	0.146	S	C	.	.	S	Bend	trans	-66.9	139	175.7	-73.8	-158.3	143	0	0	112.1	R265 G301	R265-E333 PolarHBondContact NH2-O 3.45Å; G301-E333 PolarHBondContact N-OE1 3.05Å
334	P	89.3	Confident	92.5	Very high	47 Å²	47	31.1 Å²	31.1	31%	0.305	16%	0.156	S	C	.	.	S	Bend	cis	-71.1	130.3	-6.7	28.8	-33.5	0	0	0	112.2	R265 E332 Y336	R265-P334 VanDerWaalsContact CZ-O 3.26Å; R265-P334 PolarHBondContact NH1-O 3.44Å; R265-P334 PolarHBondContact NH2-O 3.3Å; E332-P334 CarbonylContact O-C 3.13Å; E332-P334 VanDerWaalsContact O-O 3.06Å; P334-Y336 HydrophobicContact CB-CE1 4.37Å; P334-Y336 HydrophobicContact CG-CE1 4.03Å; P334-Y336 VanDerWaalsContact O-CD1 3.28Å; P334-Y336 WeakPolarHBondContact O-CD1 3.47Å; P334-Y336 PolarHBondContact O-N 3.29Å
335	I	90	Very high	92.6	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.015	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-65.4	132.2	-175.7	-67.4	166.5	0	0	0	110.6	L298 M303 F308 V330 S331 E332	L298-I335 HydrophobicContact CB-CB 4.25Å; L298-I335 HydrophobicContact CD1-CB 4.06Å; L298-I335 HydrophobicContact CD1-CG2 3.86Å; L298-I335 HydrophobicContact CG-CB 4.49Å; L298-I335 HydrophobicContact CG-CG2 4.49Å; L298-I335 PolarHBondContact N-O 3.14Å; M303-I335 HydrophobicContact CG-CD1 4.12Å; F308-I335 HydrophobicContact CB-CD1 3.94Å; F308-I335 HydrophobicContact CD1-CD1 4.18Å; F308-I335 HydrophobicContact CD1-CG1 4.48Å; F308-I335 HydrophobicContact CD1-CG2 3.61Å; F308-I335 HydrophobicContact CD2-CG2 3.93Å; F308-I335 HydrophobicContact CE1-CG2 3.42Å; F308-I335 VanDerWaalsContact CE1-CG2 3.42Å; F308-I335 HydrophobicContact CE2-CG2 3.76Å; F308-I335 HydrophobicContact CG-CD1 4.02Å; F308-I335 HydrophobicContact CG-CG2 3.86Å; F308-I335 HydrophobicContact CZ-CG2 3.49Å; F308-I335 VanDerWaalsContact CZ-CG2 3.49Å; V330-I335 WeakPolarHBondContact O-CA 3.4Å; S331-I335 WeakPolarHBondContact O-CG1 3.46Å; E332-I335 PolarHBondContact O-N 2.94Å
336	Y	94.1	Very high	92.8	Very high	28 Å²	28	30.9 Å²	30.9	11%	0.11	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	139.1	173.3	-66.3	2.2	0	0	0	111.4	R265 L268 L270 I295 K296 T297 V329 V330 P334	R265-Y336 HydrophobicContact CG-CE2 4.06Å; R265-Y336 VanDerWaalsContact NH1-CD1 3.34Å; L268-Y336 HydrophobicContact CD1-CD2 3.89Å; L270-Y336 HydrophobicContact CD2-CE2 4.46Å; I295-Y336 HydrophobicContact CG2-CD2 3.68Å; I295-Y336 HydrophobicContact CG2-CE2 4.26Å; I295-Y336 HydrophobicContact CG2-CG 3.94Å; K296-Y336 CarbonylContact O-C 3.55Å; K296-Y336 WeakPolarHBondContact O-CA 3.48Å; T297-Y336 HydrophobicContact CG2-CD1 3.57Å; T297-Y336 HydrophobicContact CG2-CE1 3.28Å; T297-Y336 HydrophobicContact CG2-CE2 4.29Å; T297-Y336 HydrophobicContact CG2-CG 4.2Å; V329-Y336 CarbonylContact C-O 3.57Å; V329-Y336 VanDerWaalsContact CA-O 3.3Å; V329-Y336 WeakPolarHBondContact CA-O 3.42Å; V330-Y336 HydrophobicContact CB-CG 4.34Å; V330-Y336 HydrophobicContact CG2-CD2 4.18Å; V330-Y336 HydrophobicContact CG2-CG 4.26Å; V330-Y336 PolarHBondContact N-O 3.43Å; V330-Y336 PolarHBondContact O-N 3.14Å; P334-Y336 HydrophobicContact CB-CE1 4.37Å; P334-Y336 HydrophobicContact CG-CE1 4.03Å; P334-Y336 VanDerWaalsContact O-CD1 3.28Å; P334-Y336 WeakPolarHBondContact O-CD1 3.47Å; P334-Y336 PolarHBondContact O-N 3.29Å
337	I	92.7	Very high	93.1	Very high	14 Å²	14	30.3 Å²	30.3	7%	0.072	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	119.4	171.5	-52.4	175.2	0	0	0	107.3	I295 K296 F308 L326 T339	I295-I337 WeakPolarHBondContact CA-O 3.48Å; K296-I337 HydrophobicContact CB-CB 4.23Å; K296-I337 HydrophobicContact CD-CD1 4.46Å; K296-I337 PolarHBondContact N-O 3.27Å; K296-I337 PolarHBondContact O-N 2.97Å; F308-I337 HydrophobicContact CE2-CD1 3.76Å; F308-I337 HydrophobicContact CE2-CG1 3.61Å; F308-I337 HydrophobicContact CZ-CD1 4.42Å; F308-I337 HydrophobicContact CZ-CG1 3.77Å; L326-I337 HydrophobicContact CD1-CG2 3.39Å; I337-T339 HydrophobicContact CG2-CG2 4.18Å
338	V	95.2	Very high	93.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	122.5	-177.2	-170.8	0	0	0	0	109	L256 L268 V293 A294 L326 Y327 A328	L256-V338 HydrophobicContact CD1-CG1 4.47Å; L268-V338 HydrophobicContact CD1-CG2 3.65Å; L268-V338 HydrophobicContact CD2-CG1 4.24Å; L268-V338 HydrophobicContact CD2-CG2 3.95Å; L268-V338 HydrophobicContact CG-CG2 4.48Å; V293-V338 HydrophobicContact CB-CG1 3.71Å; V293-V338 HydrophobicContact CG1-CG1 3.76Å; V293-V338 HydrophobicContact CG2-CG1 3.99Å; A294-V338 WeakPolarHBondContact O-CA 3.18Å; L326-V338 WeakPolarHBondContact CD1-O 3.37Å; Y327-V338 WeakPolarHBondContact CB-O 3.33Å; Y327-V338 PolarHBondContact N-O 2.97Å; A328-V338 HydrophobicContact CB-CB 4.19Å; A328-V338 HydrophobicContact CB-CG2 4.42Å; A328-V338 PolarHBondContact N-O 3.23Å; A328-V338 WeakPolarHBondContact O-CA 3.4Å; A328-V338 WeakPolarHBondContact O-CB 3.08Å; A328-V338 PolarHBondContact O-N 2.85Å
339	T	94.5	Very high	93.4	Very high	24 Å²	24	35.7 Å²	35.7	15%	0.147	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	168.3	-176	53.3	0	0	0	0	111.1	A294 V324 Q325 L326 I337	A294-T339 PolarHBondContact N-O 2.85Å; A294-T339 PolarHBondContact O-N 2.92Å; A294-T339 PolarHBondContact O-OG1 3.02Å; V324-T339 HydrophobicContact CG1-CG2 4.12Å; Q325-T339 VanDerWaalsContact O-CA 3.32Å; Q325-T339 WeakPolarHBondContact O-CA 3.36Å; Q325-T339 WeakPolarHBondContact O-CB 3.47Å; L326-T339 HydrophobicContact CD1-CG2 4.18Å; I337-T339 HydrophobicContact CG2-CG2 4.18Å
340	E	92.6	Very high	93.6	Very high	11 Å²	11	36 Å²	36	5%	0.051	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	140.2	168.8	65.3	178.9	123.6	0	0	111.8	V324 Q325 Y327 K402	V324-E340 HydrophobicContact CG1-CG 3.86Å; Q325-E340 HydrophobicContact CB-CG 4.45Å; Q325-E340 WeakPolarHBondContact CB-OE1 3.19Å; Q325-E340 PolarHBondContact N-OE1 3.5Å; Q325-E340 PolarHBondContact O-N 3.41Å; Y327-E340 VanDerWaalsContact CE2-CA 3.48Å; Y327-E340 HydrophobicContact CE2-CB 3.81Å; E340-K402 WeakPolarHBondContact OE1-CD 3.45Å; E340-K402 IonicContact OE1-NZ 2.75Å; E340-K402 PolarHBondContact OE1-NZ 2.92Å; E340-K402 IonicContact OE2-NZ 3.33Å; E340-K402 PolarHBondContact OE2-NZ 3.4Å
341	Y	94.8	Very high	93.7	Very high	70 Å²	70	35.7 Å²	35.7	28%	0.275	19%	0.19	S	C	.	.			trans	-85.6	120.7	177.2	174.5	-107.2	0	0	0	111.3	L274 R284 A294	L274-Y341 HydrophobicContact CD1-CD2 4.21Å; L274-Y341 HydrophobicContact CD1-CE2 3.82Å; L274-Y341 HydrophobicContact CD2-CE2 4.35Å; R284-Y341 HydrophobicContact CB-CD2 4.4Å; R284-Y341 HydrophobicContact CB-CE2 4.07Å; R284-Y341 HydrophobicContact CG-CD2 3.91Å; R284-Y341 HydrophobicContact CG-CE2 3.74Å; R284-Y341 HydrophobicContact CG-CG 4.41Å; A294-Y341 HydrophobicContact CB-CD2 4.42Å
342	M	95.1	Very high	93.9	Very high	14 Å²	14	38.2 Å²	38.2	7%	0.069	20%	0.199	C	C	.	.			trans	-97.6	110.4	178	-65.6	-68.8	-77.7	0	0	110.7	K344 G345 L394 G396 K402	M342-K344 VanDerWaalsContact C-N 3.31Å; M342-K344 PolarHBondContact O-N 3.04Å; M342-G345 PolarHBondContact O-N 3.13Å; M342-L394 HydrophobicContact CB-CB 3.63Å; M342-L394 HydrophobicContact CB-CD1 3.98Å; M342-L394 HydrophobicContact CB-CG 4.39Å; M342-L394 HydrophobicContact CE-CB 4.16Å; M342-L394 WeakPolarHBondContact CE-O 3.46Å; M342-L394 HydrophobicContact CG-CB 3.61Å; M342-L394 HydrophobicContact CG-CD1 3.82Å; M342-L394 HydrophobicContact CG-CG 4.38Å; M342-G396 VanDerWaalsContact CE-N 3.33Å; M342-K402 HydrophobicContact CE-CB 3.93Å; M342-K402 HydrophobicContact CE-CD 3.98Å; M342-K402 HydrophobicContact CE-CG 3.77Å; M342-K402 HydrophobicContact SD-CD 3.98Å; M342-K402 HydrophobicContact SD-CG 4.43Å
343	S	93.3	Very high	93.9	Very high	50 Å²	50	38.1 Å²	38.1	35%	0.35	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-25.3	-164.6	56.5	0	0	0	0	115.9	N397	S343-N397 PolarHBondContact OG-OD1 3.1Å
344	K	94.9	Very high	94.1	Very high	53 Å²	53	35 Å²	35	23%	0.23	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	8.2	-177.7	-59.3	-175.8	178	-84.6	0	113.3	M342 F350 E355 V395 G396	M342-K344 VanDerWaalsContact C-N 3.31Å; M342-K344 PolarHBondContact O-N 3.04Å; K344-F350 HydrophobicContact CB-CD2 4.08Å; K344-F350 HydrophobicContact CB-CE2 4.44Å; K344-F350 HydrophobicContact CD-CD2 4.23Å; K344-F350 HydrophobicContact CD-CE2 3.74Å; K344-F350 HydrophobicContact CD-CZ 4.46Å; K344-E355 IonicContact NZ-OE1 3.36Å; K344-E355 PolarHBondContact NZ-OE1 3.14Å; K344-E355 IonicContact NZ-OE2 2.9Å; K344-E355 PolarHBondContact NZ-OE2 3.16Å; K344-V395 WeakPolarHBondContact CA-O 3.25Å; K344-V395 HydrophobicContact CB-CB 3.95Å; K344-V395 HydrophobicContact CB-CG1 4.04Å; K344-V395 VanDerWaalsContact CB-O 3.31Å; K344-V395 WeakPolarHBondContact CB-O 3.25Å; K344-V395 HydrophobicContact CD-CG1 4.08Å; K344-V395 PolarHBondContact N-O 2.95Å; K344-G396 WeakPolarHBondContact CD-O 3.47Å
345	G	94.9	Very high	94.2	Very high	31 Å²	31	38.8 Å²	38.8	32%	0.32	21%	0.21	S	C	.	.			trans	70.4	-152.9	175.1	0	0	0	0	0	113.4	M342 L394 V395	M342-G345 PolarHBondContact O-N 3.13Å; G345-L394 CarbonylContact O-C 3.54Å; G345-L394 WeakPolarHBondContact O-CA 3.33Å; G345-V395 PolarHBondContact O-N 2.84Å
346	S	96.3	Very high	94.3	Very high	14 Å²	14	38.6 Å²	38.6	10%	0.098	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-73.1	150.1	-179.8	80.8	0	0	0	0	111.8	L348 D349 F350 I393	S346-L348 PolarHBondContact O-N 3.19Å; S346-D349 PolarHBondContact O-N 3.42Å; S346-D349 PolarHBondContact OG-N 3.32Å; S346-D349 VanDerWaalsContact OG-N 3.12Å; S346-D349 PolarHBondContact OG-OD2 2.82Å; S346-F350 VanDerWaalsContact O-CB 3.23Å; S346-F350 WeakPolarHBondContact O-CB 3.46Å; S346-F350 PolarHBondContact O-N 3.22Å; S346-I393 CarbonylContact C-O 3.5Å; S346-I393 WeakPolarHBondContact CA-O 3.37Å
347	L	97.9	Very high	94.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.6	-34.7	174	175.7	61.4	0	0	0	111	F350 L351 M367 S390 I393 V395 L456	L347-F350 HydrophobicContact CD1-CD1 4.31Å; L347-F350 PolarHBondContact O-N 3.22Å; L347-L351 HydrophobicContact CD1-CD1 3.88Å; L347-L351 HydrophobicContact CD1-CD2 4.39Å; L347-L351 HydrophobicContact CD1-CG 3.85Å; L347-L351 HydrophobicContact CG-CD1 3.84Å; L347-L351 HydrophobicContact CG-CG 4.27Å; L347-L351 WeakPolarHBondContact O-CB 3.42Å; L347-L351 WeakPolarHBondContact O-CD1 3.28Å; L347-L351 WeakPolarHBondContact O-CG 3.42Å; L347-L351 PolarHBondContact O-N 2.93Å; L347-M367 HydrophobicContact CD1-CE 3.21Å; L347-M367 HydrophobicContact CD1-SD 4.35Å; L347-S390 WeakPolarHBondContact CB-O 3.32Å; L347-S390 PolarHBondContact N-O 2.75Å; L347-I393 HydrophobicContact CB-CB 3.79Å; L347-I393 HydrophobicContact CB-CG2 4.05Å; L347-I393 HydrophobicContact CD2-CB 3.98Å; L347-I393 HydrophobicContact CD2-CG1 4.27Å; L347-I393 HydrophobicContact CD2-CG2 3.99Å; L347-I393 PolarHBondContact N-O 3.37Å; L347-V395 HydrophobicContact CB-CG2 3.97Å; L347-V395 HydrophobicContact CD1-CG2 3.94Å; L347-L456 HydrophobicContact CD1-CD2 4.22Å; L347-L456 HydrophobicContact CD2-CD2 3.97Å; L347-L456 HydrophobicContact CD2-CG 4.42Å; L347-L456 HydrophobicContact CG-CD2 4.49Å
348	L	96.8	Very high	94.2	Very high	33 Å²	33	49.7 Å²	49.7	17%	0.173	27%	0.269	C	S	.	.	H	α-helix	trans	-57.6	-53.6	175.2	-178.6	59.6	0	0	0	111.8	S346 F350 L351 K352 S390 A391	S346-L348 PolarHBondContact O-N 3.19Å; L348-F350 VanDerWaalsContact C-N 3.35Å; L348-L351 PolarHBondContact O-N 2.89Å; L348-K352 HydrophobicContact CD1-CD 4.06Å; L348-K352 VanDerWaalsContact CD1-CE 3.47Å; L348-K352 HydrophobicContact CG-CD 4.36Å; L348-K352 WeakPolarHBondContact O-CG 3.22Å; L348-K352 PolarHBondContact O-N 2.91Å; L348-K352 VanDerWaalsContact O-N 3.13Å; L348-S390 WeakPolarHBondContact CB-OG 3.37Å; L348-S390 WeakPolarHBondContact CD1-OG 3.28Å; L348-S390 PolarHBondContact N-O 3.09Å; L348-S390 VanDerWaalsContact N-O 3.16Å; L348-A391 HydrophobicContact CB-CB 4.47Å; L348-A391 HydrophobicContact CD2-CB 4.09Å
349	D	95.9	Very high	94.1	Very high	89 Å²	89	51.1 Å²	51.1	48%	0.476	28%	0.276	S	S	.	.	H	α-helix	trans	-69.4	-38.7	-178.2	-56.5	-38	0	0	0	110.4	S346 L351 K352 D353 G354	S346-D349 PolarHBondContact O-N 3.42Å; S346-D349 PolarHBondContact OG-N 3.32Å; S346-D349 VanDerWaalsContact OG-N 3.12Å; S346-D349 PolarHBondContact OG-OD2 2.82Å; D349-L351 VanDerWaalsContact C-N 3.33Å; D349-L351 PolarHBondContact O-N 2.91Å; D349-K352 PolarHBondContact O-N 3.39Å; D349-D353 PolarHBondContact O-N 3.04Å; D349-G354 PolarHBondContact O-N 3.35Å; D349-G354 VanDerWaalsContact O-N 3.11Å
350	F	97.3	Very high	94	Very high	6 Å²	6	57.5 Å²	57.5	3%	0.026	30%	0.302	C	S	.	.	H	α-helix	trans	-59.1	-40.8	176	-179.3	-106.2	0	0	0	112.7	K344 S346 L347 L348 G354 E355 G356 L359 M367 V395 L399	K344-F350 HydrophobicContact CB-CD2 4.08Å; K344-F350 HydrophobicContact CB-CE2 4.44Å; K344-F350 HydrophobicContact CD-CD2 4.23Å; K344-F350 HydrophobicContact CD-CE2 3.74Å; K344-F350 HydrophobicContact CD-CZ 4.46Å; S346-F350 VanDerWaalsContact O-CB 3.23Å; S346-F350 WeakPolarHBondContact O-CB 3.46Å; S346-F350 PolarHBondContact O-N 3.22Å; L347-F350 HydrophobicContact CD1-CD1 4.31Å; L347-F350 PolarHBondContact O-N 3.22Å; L348-F350 VanDerWaalsContact C-N 3.35Å; F350-G354 CarbonylContact O-C 3.46Å; F350-G354 VanDerWaalsContact O-C 3.3Å; F350-G354 VanDerWaalsContact O-CA 3.31Å; F350-G354 WeakPolarHBondContact O-CA 3.45Å; F350-G354 PolarHBondContact O-N 3.07Å; F350-E355 HydrophobicContact CE2-CB 3.77Å; F350-E355 HydrophobicContact CZ-CB 4.14Å; F350-G356 WeakPolarHBondContact O-CA 3.49Å; F350-G356 PolarHBondContact O-N 3.17Å; F350-L359 HydrophobicContact CE1-CD1 3.68Å; F350-L359 HydrophobicContact CZ-CD1 4.22Å; F350-M367 HydrophobicContact CD1-CE 3.99Å; F350-M367 HydrophobicContact CE1-CE 3.88Å; F350-V395 HydrophobicContact CB-CG2 4.17Å; F350-V395 HydrophobicContact CD1-CG1 4.25Å; F350-V395 HydrophobicContact CD1-CG2 4.12Å; F350-V395 HydrophobicContact CD2-CG1 4.44Å; F350-V395 HydrophobicContact CE1-CG1 4.28Å; F350-V395 HydrophobicContact CE2-CG1 4.49Å; F350-V395 HydrophobicContact CG-CB 4.39Å; F350-V395 HydrophobicContact CG-CG1 4.32Å; F350-V395 HydrophobicContact CG-CG2 4.18Å; F350-V395 HydrophobicContact CZ-CG1 4.42Å; F350-L399 HydrophobicContact CE1-CD2 3.97Å; F350-L399 HydrophobicContact CZ-CD2 3.55Å
351	L	96.9	Very high	94	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-74.1	-37.6	178.2	-72.5	168.9	0	0	0	113.3	L347 L348 D349 L364 L456 K459	L347-L351 HydrophobicContact CD1-CD1 3.88Å; L347-L351 HydrophobicContact CD1-CD2 4.39Å; L347-L351 HydrophobicContact CD1-CG 3.85Å; L347-L351 HydrophobicContact CG-CD1 3.84Å; L347-L351 HydrophobicContact CG-CG 4.27Å; L347-L351 WeakPolarHBondContact O-CB 3.42Å; L347-L351 WeakPolarHBondContact O-CD1 3.28Å; L347-L351 WeakPolarHBondContact O-CG 3.42Å; L347-L351 PolarHBondContact O-N 2.93Å; L348-L351 PolarHBondContact O-N 2.89Å; D349-L351 VanDerWaalsContact C-N 3.33Å; D349-L351 PolarHBondContact O-N 2.91Å; L351-L364 HydrophobicContact CD2-CD2 3.74Å; L351-L456 HydrophobicContact CD1-CD2 4.13Å; L351-L456 HydrophobicContact CD2-CD2 4.47Å; L351-K459 HydrophobicContact CD2-CD 4.43Å
352	K	93.9	Very high	93.7	Very high	75 Å²	75	59.2 Å²	59.2	33%	0.326	32%	0.32	S	S	.	.	H	α-helix	trans	-79	-55.1	-176.2	-76.3	-179.3	176.4	174.2	0	112.7	L348 D349 G460	L348-K352 HydrophobicContact CD1-CD 4.06Å; L348-K352 VanDerWaalsContact CD1-CE 3.47Å; L348-K352 HydrophobicContact CG-CD 4.36Å; L348-K352 WeakPolarHBondContact O-CG 3.22Å; L348-K352 PolarHBondContact O-N 2.91Å; L348-K352 VanDerWaalsContact O-N 3.13Å; D349-K352 PolarHBondContact O-N 3.39Å; K352-G460 WeakPolarHBondContact CE-O 3.27Å
353	D	89.9	Confident	93.6	Very high	141 Å²	141	61.5 Å²	61.5	75%	0.754	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	-10.8	-163.8	-59.3	-41.8	0	0	0	112.2	D349	D349-D353 PolarHBondContact O-N 3.04Å
354	G	90.9	Very high	93.8	Very high	33 Å²	33	59.5 Å²	59.5	34%	0.34	32%	0.318	S	S	.	.	S	Bend	trans	-98.9	-166.4	179.1	0	0	0	0	0	115.3	D349 F350 G356 R357	D349-G354 PolarHBondContact O-N 3.35Å; D349-G354 VanDerWaalsContact O-N 3.11Å; F350-G354 CarbonylContact O-C 3.46Å; F350-G354 VanDerWaalsContact O-C 3.3Å; F350-G354 VanDerWaalsContact O-CA 3.31Å; F350-G354 WeakPolarHBondContact O-CA 3.45Å; F350-G354 PolarHBondContact O-N 3.07Å; G354-G356 PolarHBondContact O-N 2.93Å; G354-G356 VanDerWaalsContact O-N 3.17Å; G354-R357 PolarHBondContact O-N 3.2Å
355	E	91	Very high	93.8	Very high	125 Å²	125	57.2 Å²	57.2	58%	0.584	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-62.5	-20.8	178.2	-57.8	162.5	-147.2	0	0	112.5	K344 F350 R357 A358	K344-E355 IonicContact NZ-OE1 3.36Å; K344-E355 PolarHBondContact NZ-OE1 3.14Å; K344-E355 IonicContact NZ-OE2 2.9Å; K344-E355 PolarHBondContact NZ-OE2 3.16Å; F350-E355 HydrophobicContact CE2-CB 3.77Å; F350-E355 HydrophobicContact CZ-CB 4.14Å; E355-R357 PolarHBondContact O-N 3.3Å; E355-R357 VanDerWaalsContact O-N 3.13Å; E355-A358 PolarHBondContact O-N 2.68Å
356	G	91.5	Very high	93.7	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-59.8	-22.2	178.9	0	0	0	0	0	114.3	F350 G354 A358 L359 K459	F350-G356 WeakPolarHBondContact O-CA 3.49Å; F350-G356 PolarHBondContact O-N 3.17Å; G354-G356 PolarHBondContact O-N 2.93Å; G354-G356 VanDerWaalsContact O-N 3.17Å; G356-A358 VanDerWaalsContact C-N 3.26Å; G356-A358 PolarHBondContact O-N 2.96Å; G356-L359 WeakPolarHBondContact O-CB 3.32Å; G356-L359 PolarHBondContact O-N 3.06Å; G356-K459 PolarHBondContact O-NZ 2.92Å
357	R	92.1	Very high	93.8	Very high	188 Å²	188	56.8 Å²	56.8	71%	0.709	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-60.2	-35.8	177.6	-171.2	173	176.1	177.3	-1	112.5	G354 E355	G354-R357 PolarHBondContact O-N 3.2Å; E355-R357 PolarHBondContact O-N 3.3Å; E355-R357 VanDerWaalsContact O-N 3.13Å
358	A	92.9	Very high	93.8	Very high	87 Å²	87	56.9 Å²	56.9	72%	0.719	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-86.3	-7.3	-178.7	0	0	0	0	0	113.9	E355 G356	E355-A358 PolarHBondContact O-N 2.68Å; G356-A358 VanDerWaalsContact C-N 3.26Å; G356-A358 PolarHBondContact O-N 2.96Å
359	L	93.7	Very high	93.8	Very high	30 Å²	30	55.5 Å²	55.5	16%	0.157	29%	0.292	C	S	.	.			trans	-64.8	141.4	-176.6	-69	-177.3	0	0	0	112.2	F350 G356 N363 L364 M367 L399 K459	F350-L359 HydrophobicContact CE1-CD1 3.68Å; F350-L359 HydrophobicContact CZ-CD1 4.22Å; G356-L359 WeakPolarHBondContact O-CB 3.32Å; G356-L359 PolarHBondContact O-N 3.06Å; L359-N363 HydrophobicContact CB-CB 4.09Å; L359-N363 HydrophobicContact CD1-CB 4.16Å; L359-N363 HydrophobicContact CD2-CB 3.96Å; L359-N363 HydrophobicContact CG-CB 4.3Å; L359-L364 HydrophobicContact CB-CD2 4.24Å; L359-M367 HydrophobicContact CD1-SD 3.7Å; L359-L399 HydrophobicContact CD1-CD1 4.28Å; L359-L399 HydrophobicContact CD1-CD2 4.19Å; L359-L399 HydrophobicContact CD2-CD1 3.93Å; L359-L399 HydrophobicContact CD2-CD2 4.49Å; L359-K459 PolarHBondContact O-NZ 2.91Å
360	K	92.6	Very high	93.9	Very high	157 Å²	157	51.3 Å²	51.3	68%	0.683	27%	0.269	S	S	*	.			trans	-89.6	167.7	175.3	-63.8	-178.1	-178.9	178.2	0	110.5	P362 N363 L364	K360-P362 VanDerWaalsContact C-CD 3.44Å; K360-P362 VanDerWaalsContact C-N 3.32Å; K360-N363 PolarHBondContact O-N 2.8Å; K360-N363 VanDerWaalsContact O-N 3.08Å; K360-L364 PolarHBondContact O-N 2.83Å
361	L	91.6	Very high	94	Very high	47 Å²	47	51.1 Å²	51.1	25%	0.246	27%	0.268	C	S	.	.	H	α-helix	trans	-49.2	-42.9	-179.9	179.7	71.8	0	0	0	113.9	N363 L364 V365 P489 L492 F521	L361-N363 VanDerWaalsContact C-N 3.3Å; L361-N363 PolarHBondContact O-N 3.46Å; L361-L364 PolarHBondContact O-N 3.32Å; L361-L364 VanDerWaalsContact O-N 3.07Å; L361-V365 HydrophobicContact CD1-CG2 3.94Å; L361-V365 HydrophobicContact CG-CG2 4.11Å; L361-V365 WeakPolarHBondContact O-CG2 3.27Å; L361-V365 PolarHBondContact O-N 2.7Å; L361-P489 HydrophobicContact CD1-CG 4.33Å; L361-P489 HydrophobicContact CD2-CG 3.35Å; L361-P489 HydrophobicContact CG-CG 4.46Å; L361-L492 HydrophobicContact CD1-CD2 4.22Å; L361-F521 HydrophobicContact CD2-CZ 4.21Å; L361-F521 HydrophobicContact CG-CZ 4.23Å
362	P	89.3	Confident	94	Very high	70 Å²	70	51.1 Å²	51.1	46%	0.455	27%	0.268	S	S	.	.	H	α-helix	trans	-57.5	-40.8	178.7	-27.2	36.7	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 3.48Å; P362-D366 PolarHBondContact O-N 3.19Å; P362-F521 HydrophobicContact CB-CE2 4.03Å; P362-F521 HydrophobicContact CB-CZ 4.26Å; P362-F521 HydrophobicContact CG-CE2 4.3Å; P362-F521 HydrophobicContact CG-CZ 4.04Å
363	N	92.2	Very high	94.2	Very high	62 Å²	62	48 Å²	48	33%	0.332	26%	0.257	S	S	.	.	H	α-helix	trans	-67.6	-39.6	176.3	-57.1	106.6	0	0	0	111.5	L359 K360 L361 D366 M367 L399	L359-N363 HydrophobicContact CB-CB 4.09Å; L359-N363 HydrophobicContact CD1-CB 4.16Å; L359-N363 HydrophobicContact CD2-CB 3.96Å; L359-N363 HydrophobicContact CG-CB 4.3Å; K360-N363 PolarHBondContact O-N 2.8Å; K360-N363 VanDerWaalsContact O-N 3.08Å; L361-N363 VanDerWaalsContact C-N 3.3Å; L361-N363 PolarHBondContact O-N 3.46Å; N363-D366 PolarHBondContact O-N 3.08Å; N363-M367 WeakPolarHBondContact O-CG 3.46Å; N363-M367 PolarHBondContact O-N 3.24Å; N363-L399 HydrophobicContact CB-CD1 4.32Å
364	L	96.4	Very high	94.5	Very high	9 Å²	9	41.3 Å²	41.3	5%	0.047	22%	0.221	C	C	.	.	H	α-helix	trans	-66.2	-39.8	179.1	-59.9	176.6	0	0	0	112.1	L351 L359 K360 L361 M367 A368 L456	L351-L364 HydrophobicContact CD2-CD2 3.74Å; L359-L364 HydrophobicContact CB-CD2 4.24Å; K360-L364 PolarHBondContact O-N 2.83Å; L361-L364 PolarHBondContact O-N 3.32Å; L361-L364 VanDerWaalsContact O-N 3.07Å; L364-M367 PolarHBondContact O-N 3.08Å; L364-A368 PolarHBondContact O-N 3.49Å; L364-L456 WeakPolarHBondContact CD1-O 3.42Å; L364-L456 HydrophobicContact CD2-CD2 4.13Å
365	V	95.1	Very high	94.9	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.024	21%	0.205	C	C	.	.	H	α-helix	trans	-66.5	-41.6	175.4	172.2	0	0	0	0	110.6	L361 A368 A369 L492 L517 Y520 F521	L361-V365 HydrophobicContact CD1-CG2 3.94Å; L361-V365 HydrophobicContact CG-CG2 4.11Å; L361-V365 WeakPolarHBondContact O-CG2 3.27Å; L361-V365 PolarHBondContact O-N 2.7Å; V365-A368 WeakPolarHBondContact O-CB 3.48Å; V365-A368 PolarHBondContact O-N 3.15Å; V365-A369 PolarHBondContact O-N 3.35Å; V365-L492 HydrophobicContact CG2-CD2 4.33Å; V365-L517 HydrophobicContact CG1-CD2 4.15Å; V365-Y520 HydrophobicContact CG1-CD1 4.08Å; V365-Y520 HydrophobicContact CG1-CG 3.94Å; V365-Y520 HydrophobicContact CG2-CD1 4.2Å; V365-Y520 HydrophobicContact CG2-CE1 4.33Å; V365-F521 HydrophobicContact CB-CE2 3.97Å; V365-F521 HydrophobicContact CG1-CE2 4.06Å; V365-F521 HydrophobicContact CG2-CE2 4.14Å; V365-F521 HydrophobicContact CG2-CZ 4.26Å
366	D	93.8	Very high	95.2	Very high	36 Å²	36	33.9 Å²	33.9	19%	0.193	18%	0.178	C	C	.	.	H	α-helix	trans	-62.5	-43.2	174.3	176.6	79.5	0	0	0	112	R161 P362 N363 A368 A369 Q370	R161-D366 WeakPolarHBondContact CD-OD1 3.44Å; R161-D366 VanDerWaalsContact CD-OD2 3.25Å; R161-D366 WeakPolarHBondContact CD-OD2 3.29Å; R161-D366 IonicContact CZ-OD1 3.68Å; R161-D366 IonicContact NE-OD1 2.75Å; R161-D366 PolarHBondContact NE-OD1 3.12Å; R161-D366 IonicContact NE-OD2 3.13Å; R161-D366 PolarHBondContact NE-OD2 2.94Å; P362-D366 WeakPolarHBondContact O-CB 3.48Å; P362-D366 PolarHBondContact O-N 3.19Å; N363-D366 PolarHBondContact O-N 3.08Å; D366-A368 VanDerWaalsContact C-N 3.29Å; D366-A368 PolarHBondContact O-N 3.5Å; D366-A369 WeakPolarHBondContact O-CB 3.44Å; D366-A369 PolarHBondContact O-N 2.98Å; D366-A369 VanDerWaalsContact O-N 3.15Å; D366-Q370 WeakPolarHBondContact O-CG 3.39Å; D366-Q370 PolarHBondContact O-N 3.19Å; D366-Q370 PolarHBondContact OD2-NE2 3.37Å
367	M	97.8	Very high	95.4	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-39.7	173.8	-67	172.9	90.4	0	0	111.6	L347 F350 L359 N363 L364 Q370 V371 V395 C401 L456	L347-M367 HydrophobicContact CD1-CE 3.21Å; L347-M367 HydrophobicContact CD1-SD 4.35Å; F350-M367 HydrophobicContact CD1-CE 3.99Å; F350-M367 HydrophobicContact CE1-CE 3.88Å; L359-M367 HydrophobicContact CD1-SD 3.7Å; N363-M367 WeakPolarHBondContact O-CG 3.46Å; N363-M367 PolarHBondContact O-N 3.24Å; L364-M367 PolarHBondContact O-N 3.08Å; M367-Q370 PolarHBondContact O-N 3.08Å; M367-V371 WeakPolarHBondContact O-CG2 3.41Å; M367-V371 PolarHBondContact O-N 2.92Å; M367-V371 VanDerWaalsContact O-N 3.14Å; M367-V395 HydrophobicContact CE-CG1 4.38Å; M367-V395 HydrophobicContact CE-CG2 4.08Å; M367-C401 WeakPolarHBondContact CE-SG 3.31Å; M367-L456 HydrophobicContact CB-CD2 4.21Å
368	A	98.4	Very high	95.4	Very high	2 Å²	2	26.5 Å²	26.5	2%	0.017	15%	0.15	C	C	.	.	H	α-helix	trans	-63.2	-43.4	173.2	0	0	0	0	0	112.3	L364 V365 D366 Q370 V371 A372 F449 L453 L456 L517	L364-A368 PolarHBondContact O-N 3.49Å; V365-A368 WeakPolarHBondContact O-CB 3.48Å; V365-A368 PolarHBondContact O-N 3.15Å; D366-A368 VanDerWaalsContact C-N 3.29Å; D366-A368 PolarHBondContact O-N 3.5Å; A368-Q370 VanDerWaalsContact C-N 3.32Å; A368-Q370 PolarHBondContact O-N 3.42Å; A368-V371 PolarHBondContact O-N 3.44Å; A368-A372 WeakPolarHBondContact O-CB 3.42Å; A368-A372 PolarHBondContact O-N 3.29Å; A368-F449 HydrophobicContact CB-CZ 4.42Å; A368-L453 HydrophobicContact CB-CD2 3.52Å; A368-L456 HydrophobicContact CB-CD1 3.69Å; A368-L517 HydrophobicContact CB-CD1 3.88Å; A368-L517 HydrophobicContact CB-CD2 4.29Å
369	A	96.9	Very high	95.4	Very high	4 Å²	4	24 Å²	24	3%	0.033	12%	0.124	C	C	.	.	H	α-helix	trans	-60.9	-42.1	177.5	0	0	0	0	0	111.3	V365 D366 V371 A372 A373 L517 E518	V365-A369 PolarHBondContact O-N 3.35Å; D366-A369 WeakPolarHBondContact O-CB 3.44Å; D366-A369 PolarHBondContact O-N 2.98Å; D366-A369 VanDerWaalsContact O-N 3.15Å; A369-V371 PolarHBondContact O-N 3.38Å; A369-A372 PolarHBondContact O-N 3.34Å; A369-A373 WeakPolarHBondContact O-CB 3.38Å; A369-A373 PolarHBondContact O-N 2.89Å; A369-L517 HydrophobicContact CB-CB 3.77Å; A369-E518 HydrophobicContact CB-CG 4.06Å
370	Q	97.8	Very high	95.5	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-60.9	-43.4	175.1	-70	-176.1	61.2	0	0	112.4	K322 D366 M367 A368 A373 G374 L399 C401	K322-Q370 WeakPolarHBondContact CB-O 3.49Å; K322-Q370 HydrophobicContact CD-CB 4.03Å; K322-Q370 HydrophobicContact CD-CG 4.28Å; K322-Q370 WeakPolarHBondContact CG-O 3.46Å; D366-Q370 WeakPolarHBondContact O-CG 3.39Å; D366-Q370 PolarHBondContact O-N 3.19Å; D366-Q370 PolarHBondContact OD2-NE2 3.37Å; M367-Q370 PolarHBondContact O-N 3.08Å; A368-Q370 VanDerWaalsContact C-N 3.32Å; A368-Q370 PolarHBondContact O-N 3.42Å; Q370-A373 PolarHBondContact O-N 2.99Å; Q370-G374 PolarHBondContact O-N 3.33Å; Q370-L399 PolarHBondContact NE2-O 2.89Å; Q370-L399 VanDerWaalsContact NE2-O 3.1Å; Q370-C401 HydrophobicContact CB-CB 4.08Å
371	V	98.6	Very high	95.4	Very high	1 Å²	1	27 Å²	27	1%	0.006	13%	0.134	C	C	.	.	H	α-helix	trans	-66.3	-42.2	175.2	175.7	0	0	0	0	110.9	M367 A368 A369 A373 G374 M375 L388 I393 C401 I403 F449 L452	M367-V371 WeakPolarHBondContact O-CG2 3.41Å; M367-V371 PolarHBondContact O-N 2.92Å; M367-V371 VanDerWaalsContact O-N 3.14Å; A368-V371 PolarHBondContact O-N 3.44Å; A369-V371 PolarHBondContact O-N 3.38Å; V371-A373 VanDerWaalsContact C-N 3.32Å; V371-A373 PolarHBondContact O-N 3.17Å; V371-G374 PolarHBondContact O-N 2.84Å; V371-M375 PolarHBondContact O-N 3.37Å; V371-L388 HydrophobicContact CG1-CD1 4.2Å; V371-I393 HydrophobicContact CG1-CD1 3.92Å; V371-I393 HydrophobicContact CG2-CD1 3.95Å; V371-I393 HydrophobicContact CG2-CG1 4.02Å; V371-I393 HydrophobicContact CG2-CG2 3.85Å; V371-C401 HydrophobicContact CG2-CB 4.26Å; V371-I403 HydrophobicContact CG1-CD1 4.39Å; V371-I403 HydrophobicContact CG1-CG1 4.34Å; V371-F449 HydrophobicContact CB-CE2 4.15Å; V371-F449 HydrophobicContact CG1-CD2 4.07Å; V371-F449 HydrophobicContact CG1-CE2 3.9Å; V371-L452 HydrophobicContact CG1-CD1 4.13Å
372	A	98.4	Very high	95.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-60.3	-41.2	176	0	0	0	0	0	111.8	A368 A369 G374 M375 A376 F449 L513 Q514 L517	A368-A372 WeakPolarHBondContact O-CB 3.42Å; A368-A372 PolarHBondContact O-N 3.29Å; A369-A372 PolarHBondContact O-N 3.34Å; A372-G374 PolarHBondContact O-N 3.14Å; A372-M375 CarbonylContact O-C 3.56Å; A372-M375 PolarHBondContact O-N 3.32Å; A372-A376 WeakPolarHBondContact O-CB 3.37Å; A372-A376 PolarHBondContact O-N 3.5Å; A372-F449 HydrophobicContact CB-CE2 4.13Å; A372-F449 HydrophobicContact CB-CZ 3.83Å; A372-L513 HydrophobicContact CB-CB 4.4Å; A372-Q514 HydrophobicContact CB-CB 4.09Å; A372-L517 HydrophobicContact CB-CD1 4.13Å
373	A	97.4	Very high	95.1	Very high	10 Å²	10	28 Å²	28	8%	0.083	14%	0.135	C	C	.	.	H	α-helix	trans	-61.6	-41.8	175.6	0	0	0	0	0	112.5	K322 A369 Q370 V371 A376 Y377 Q514	K322-A373 HydrophobicContact CG-CB 4.37Å; A369-A373 WeakPolarHBondContact O-CB 3.38Å; A369-A373 PolarHBondContact O-N 2.89Å; Q370-A373 PolarHBondContact O-N 2.99Å; V371-A373 VanDerWaalsContact C-N 3.32Å; V371-A373 PolarHBondContact O-N 3.17Å; A373-A376 PolarHBondContact O-N 3.05Å; A373-Y377 PolarHBondContact O-N 3.07Å; A373-Y377 VanDerWaalsContact O-N 3.12Å; A373-Q514 HydrophobicContact CB-CG 4.1Å
374	G	97.1	Very high	94.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.7	-42.1	173.3	0	0	0	0	0	112.8	Q370 V371 A372 Y377 I378	Q370-G374 PolarHBondContact O-N 3.33Å; V371-G374 PolarHBondContact O-N 2.84Å; A372-G374 PolarHBondContact O-N 3.14Å; G374-Y377 WeakPolarHBondContact O-CB 3.37Å; G374-Y377 PolarHBondContact O-N 3.32Å; G374-I378 PolarHBondContact O-N 2.92Å; G374-I378 VanDerWaalsContact O-N 3.07Å
375	M	97.7	Very high	94.5	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-71.9	-31.7	177.4	-71.9	-57.5	-55.2	0	0	113.4	V371 A372 Y377 I378 E379 H385 L388 I403 I442 D445 F510	V371-M375 PolarHBondContact O-N 3.37Å; A372-M375 CarbonylContact O-C 3.56Å; A372-M375 PolarHBondContact O-N 3.32Å; M375-Y377 VanDerWaalsContact C-N 3.3Å; M375-I378 HydrophobicContact CE-CB 4.49Å; M375-I378 HydrophobicContact CE-CG2 4.07Å; M375-I378 WeakPolarHBondContact O-CB 3.46Å; M375-I378 PolarHBondContact O-N 2.83Å; M375-I378 HydrophobicContact SD-CD1 3.77Å; M375-E379 WeakPolarHBondContact O-CB 3.49Å; M375-E379 PolarHBondContact O-N 3.35Å; M375-H385 HydrophobicContact CE-CB 3.91Å; M375-H385 HydrophobicContact SD-CB 4.04Å; M375-L388 HydrophobicContact CE-CD2 4.31Å; M375-L388 HydrophobicContact CG-CD1 4.3Å; M375-L388 HydrophobicContact CG-CD2 3.83Å; M375-L388 HydrophobicContact SD-CD1 3.99Å; M375-L388 HydrophobicContact SD-CD2 3.95Å; M375-I403 HydrophobicContact CG-CD1 3.71Å; M375-I403 HydrophobicContact SD-CD1 3.79Å; M375-I442 HydrophobicContact CE-CD1 3.97Å; M375-D445 HydrophobicContact CE-CB 3.67Å; M375-F510 HydrophobicContact CB-CB 4.2Å; M375-F510 HydrophobicContact CB-CD1 3.29Å; M375-F510 HydrophobicContact CB-CD2 3.77Å; M375-F510 HydrophobicContact CB-CE1 3.37Å; M375-F510 HydrophobicContact CB-CE2 3.84Å; M375-F510 HydrophobicContact CB-CG 3.48Å; M375-F510 VanDerWaalsContact CB-CG 3.48Å; M375-F510 HydrophobicContact CB-CZ 3.65Å; M375-F510 HydrophobicContact CE-CD2 4.29Å; M375-F510 HydrophobicContact CE-CE2 3.56Å; M375-F510 HydrophobicContact CE-CZ 3.7Å; M375-F510 HydrophobicContact CG-CD1 4.14Å; M375-F510 HydrophobicContact CG-CE1 3.7Å; M375-F510 HydrophobicContact CG-CE2 4.33Å; M375-F510 HydrophobicContact CG-CZ 3.8Å
376	A	97.3	Very high	94.2	Very high	3 Å²	3	26.4 Å²	26.4	3%	0.025	12%	0.123	C	C	.	.	H	α-helix	trans	-65.9	-35.6	172.8	0	0	0	0	0	111.2	A372 A373 R380 F510	A372-A376 WeakPolarHBondContact O-CB 3.37Å; A372-A376 PolarHBondContact O-N 3.5Å; A373-A376 PolarHBondContact O-N 3.05Å; A376-R380 WeakPolarHBondContact O-CG 3.47Å; A376-R380 PolarHBondContact O-N 3.23Å; A376-R380 VanDerWaalsContact O-N 3.09Å; A376-F510 HydrophobicContact CB-CB 3.91Å
377	Y	95.8	Very high	93.9	Very high	32 Å²	32	26.8 Å²	26.8	13%	0.125	13%	0.125	C	C	.	.	H	α-helix	trans	-64.1	-47.4	168.9	175.3	-95.5	0	0	0	111.9	L318 K319 H320 L323 A373 G374 M375 E379 R380 M381	L318-Y377 HydrophobicContact CB-CE1 4.25Å; L318-Y377 HydrophobicContact CD2-CE1 4.04Å; K319-Y377 PolarHBondContact N-OH 2.79Å; K319-Y377 VanDerWaalsContact N-OH 3.08Å; K319-Y377 PolarHBondContact O-OH 2.81Å; H320-Y377 HydrophobicContact CB-CD1 3.59Å; H320-Y377 HydrophobicContact CB-CD2 4.09Å; H320-Y377 HydrophobicContact CB-CE1 3.82Å; H320-Y377 HydrophobicContact CB-CE2 4.31Å; H320-Y377 HydrophobicContact CB-CG 3.72Å; H320-Y377 AromaticContact CD2-CD2 3.79Å; H320-Y377 AromaticContact CD2-CG 3.72Å; H320-Y377 AromaticContact CG-CG 3.74Å; L323-Y377 HydrophobicContact CD1-CD1 3.63Å; L323-Y377 HydrophobicContact CD1-CE1 3.76Å; L323-Y377 HydrophobicContact CG-CD1 4.45Å; A373-Y377 PolarHBondContact O-N 3.07Å; A373-Y377 VanDerWaalsContact O-N 3.12Å; G374-Y377 WeakPolarHBondContact O-CB 3.37Å; G374-Y377 PolarHBondContact O-N 3.32Å; M375-Y377 VanDerWaalsContact C-N 3.3Å; Y377-E379 VanDerWaalsContact C-N 3.31Å; Y377-E379 PolarHBondContact O-N 3.08Å; Y377-R380 PolarHBondContact O-N 3.08Å; Y377-M381 HydrophobicContact CD1-CG 4.24Å; Y377-M381 HydrophobicContact CD2-CG 4.39Å; Y377-M381 HydrophobicContact CE1-CG 3.81Å; Y377-M381 HydrophobicContact CE2-CG 3.96Å; Y377-M381 HydrophobicContact CE2-SD 4.16Å; Y377-M381 WeakPolarHBondContact O-CG 3.45Å; Y377-M381 PolarHBondContact O-N 2.89Å
378	I	92.8	Very high	93.8	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-56.4	-43.9	175.5	-75.8	173	0	0	0	111.6	L323 G374 M375 M381 N382 Y383 I403 F406 I442	L323-I378 HydrophobicContact CD1-CG1 4.22Å; L323-I378 HydrophobicContact CD2-CD1 3.73Å; L323-I378 HydrophobicContact CD2-CG1 4.14Å; G374-I378 PolarHBondContact O-N 2.92Å; G374-I378 VanDerWaalsContact O-N 3.07Å; M375-I378 HydrophobicContact CE-CB 4.49Å; M375-I378 HydrophobicContact CE-CG2 4.07Å; M375-I378 WeakPolarHBondContact O-CB 3.46Å; M375-I378 PolarHBondContact O-N 2.83Å; M375-I378 HydrophobicContact SD-CD1 3.77Å; I378-M381 CarbonylContact O-C 3.58Å; I378-M381 PolarHBondContact O-N 3.39Å; I378-N382 PolarHBondContact O-N 2.96Å; I378-Y383 WeakPolarHBondContact CG2-O 3.13Å; I378-Y383 PolarHBondContact O-N 2.71Å; I378-I403 HydrophobicContact CD1-CD1 4.39Å; I378-F406 HydrophobicContact CD1-CB 4.41Å; I378-I442 HydrophobicContact CG2-CD1 4.32Å
379	E	93.9	Very high	93.6	Very high	36 Å²	36	29.8 Å²	29.8	17%	0.168	14%	0.136	C	C	.	.	H	α-helix	trans	-58	-49.1	175.7	178.9	170.2	-119.8	0	0	111.5	M375 Y377 M381 N382 I442 F510 E511	M375-E379 WeakPolarHBondContact O-CB 3.49Å; M375-E379 PolarHBondContact O-N 3.35Å; Y377-E379 VanDerWaalsContact C-N 3.31Å; Y377-E379 PolarHBondContact O-N 3.08Å; E379-M381 PolarHBondContact O-N 2.7Å; E379-N382 PolarHBondContact O-N 2.82Å; E379-I442 HydrophobicContact CB-CD1 3.97Å; E379-I442 HydrophobicContact CB-CG1 3.88Å; E379-I442 HydrophobicContact CG-CG1 3.92Å; E379-F510 PolarHBondContact OE2-N 3.28Å; E379-E511 PolarHBondContact OE2-N 3.43Å
380	R	94.2	Very high	93.7	Very high	160 Å²	160	29.6 Å²	29.6	60%	0.604	14%	0.135	S	C	*	.	H	α-helix	trans	-63.6	-29.2	177.3	-72.2	-177.3	-61.5	-160.4	-0.1	113.7	A376 Y377 N382	A376-R380 WeakPolarHBondContact O-CG 3.47Å; A376-R380 PolarHBondContact O-N 3.23Å; A376-R380 VanDerWaalsContact O-N 3.09Å; Y377-R380 PolarHBondContact O-N 3.08Å; R380-N382 PolarHBondContact O-N 2.7Å
381	M	90.3	Very high	93.4	Very high	89 Å²	89	30.9 Å²	30.9	44%	0.438	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	5	175.8	-62.8	-55.8	-64.4	0	0	112.7	L318 Y377 I378 E379 Y383	L318-M381 HydrophobicContact CD2-CB 3.75Å; L318-M381 HydrophobicContact CD2-CE 4.26Å; L318-M381 HydrophobicContact CD2-CG 3.81Å; Y377-M381 HydrophobicContact CD1-CG 4.24Å; Y377-M381 HydrophobicContact CD2-CG 4.39Å; Y377-M381 HydrophobicContact CE1-CG 3.81Å; Y377-M381 HydrophobicContact CE2-CG 3.96Å; Y377-M381 HydrophobicContact CE2-SD 4.16Å; Y377-M381 WeakPolarHBondContact O-CG 3.45Å; Y377-M381 PolarHBondContact O-N 2.89Å; I378-M381 CarbonylContact O-C 3.58Å; I378-M381 PolarHBondContact O-N 3.39Å; E379-M381 PolarHBondContact O-N 2.7Å; M381-Y383 VanDerWaalsContact C-N 3.28Å; M381-Y383 PolarHBondContact O-N 3.28Å
382	N	87.9	Confident	93.3	Very high	129 Å²	129	31.4 Å²	31.4	69%	0.69	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	43.9	-176.5	-61.7	-57.6	0	0	0	112.5	I378 E379 R380 I412	I378-N382 PolarHBondContact O-N 2.96Å; E379-N382 PolarHBondContact O-N 2.82Å; R380-N382 PolarHBondContact O-N 2.7Å; N382-I412 WeakPolarHBondContact O-CD1 3.4Å
383	Y	86.6	Confident	93.2	Very high	10 Å²	10	31.4 Å²	31.4	4%	0.039	15%	0.148	C	C	.	.			trans	-117	156.9	-178.6	-151.5	-104.5	0	0	0	111.1	I314 L318 I378 M381 F406 A409	I314-Y383 HydrophobicContact CG2-CD2 4.24Å; I314-Y383 HydrophobicContact CG2-CE2 3.61Å; L318-Y383 HydrophobicContact CD1-CD1 3.97Å; L318-Y383 HydrophobicContact CD1-CE1 4.15Å; L318-Y383 HydrophobicContact CD1-CG 4.22Å; I378-Y383 WeakPolarHBondContact CG2-O 3.13Å; I378-Y383 PolarHBondContact O-N 2.71Å; M381-Y383 VanDerWaalsContact C-N 3.28Å; M381-Y383 PolarHBondContact O-N 3.28Å; Y383-F406 WeakPolarHBondContact CE1-O 3.44Å; Y383-A409 HydrophobicContact CE1-CB 3.67Å; Y383-A409 PolarHBondContact OH-O 2.63Å
384	I	87.3	Confident	93.3	Very high	3 Å²	3	32.8 Å²	32.8	2%	0.015	15%	0.154	C	C	.	.			trans	-124.8	131.8	-179.6	-57.4	161.1	0	0	0	107.9	R386 A409 I412 F440 D445	I384-R386 HydrophobicContact CB-CG 4.24Å; I384-R386 HydrophobicContact CG2-CG 3.58Å; I384-A409 WeakPolarHBondContact O-CB 3.35Å; I384-I412 HydrophobicContact CD1-CD1 3.42Å; I384-I412 VanDerWaalsContact CD1-CD1 3.42Å; I384-I412 HydrophobicContact CD1-CG1 3.57Å; I384-I412 HydrophobicContact CG1-CD1 3.65Å; I384-I412 HydrophobicContact CG1-CG1 4.15Å; I384-F440 WeakPolarHBondContact CD1-O 3.47Å; I384-F440 HydrophobicContact CG2-CB 4.42Å; I384-D445 VanDerWaalsContact CG2-OD2 3.25Å; I384-D445 WeakPolarHBondContact CG2-OD2 3.31Å
385	H	90.3	Very high	93.3	Very high	3 Å²	3	32.8 Å²	32.8	1%	0.014	15%	0.154	C	C	.	.			trans	-77.3	-43.2	179.2	-171.4	-73.3	0	0	0	112.9	M375 D387 L388 I403 A404 D445	M375-H385 HydrophobicContact CE-CB 3.91Å; M375-H385 HydrophobicContact SD-CB 4.04Å; H385-D387 VanDerWaalsContact CE1-C 3.41Å; H385-D387 PolarHBondContact CE1-O 2.88Å; H385-D387 PolarHBondContact ND1-N 2.72Å; H385-D387 PolarHBondContact ND1-O 2.85Å; H385-D387 PolarHBondContact O-N 2.97Å; H385-L388 PolarHBondContact ND1-N 3.45Å; H385-L388 VanDerWaalsContact ND1-N 3.15Å; H385-I403 WeakPolarHBondContact CD2-CG2 3.35Å; H385-I403 WeakPolarHBondContact NE2-CG2 2.98Å; H385-A404 PolarHBondContact NE2-O 3Å; H385-D445 PolarHBondContact N-OD2 2.8Å
386	R	87.6	Confident	93.1	Very high	35 Å²	35	33 Å²	33	13%	0.132	16%	0.157	C	C	.	.	S	Bend	trans	70.9	-26.5	177.9	-49	179.4	-178.5	-151.8	-5	116.8	I384 R410 Y417 F440 D445	I384-R386 HydrophobicContact CB-CG 4.24Å; I384-R386 HydrophobicContact CG2-CG 3.58Å; R386-R410 PolarHBondContact NH2-O 2.95Å; R386-Y417 VanDerWaalsContact NH1-CE1 3.33Å; R386-F440 HydrophobicContact CB-CD1 3.97Å; R386-F440 HydrophobicContact CB-CE1 4.29Å; R386-F440 HydrophobicContact CG-CB 4.3Å; R386-F440 HydrophobicContact CG-CD1 4.05Å; R386-F440 HydrophobicContact CG-CG 4.3Å; R386-D445 WeakPolarHBondContact CA-OD1 3.23Å; R386-D445 PolarHBondContact N-OD1 2.9Å
387	D	88	Confident	92.6	Very high	43 Å²	43	38.7 Å²	38.7	23%	0.23	19%	0.186	C	C	.	.			trans	-128.2	48.6	177.3	-169	12	0	0	0	112.7	H385 R389 N392 P426	H385-D387 VanDerWaalsContact CE1-C 3.41Å; H385-D387 PolarHBondContact CE1-O 2.88Å; H385-D387 PolarHBondContact ND1-N 2.72Å; H385-D387 PolarHBondContact ND1-O 2.85Å; H385-D387 PolarHBondContact O-N 2.97Å; D387-R389 PolarHBondContact O-N 3.23Å; D387-R389 WeakPolarHBondContact OD1-CD 3.41Å; D387-R389 IonicContact OD1-CZ 2.85Å; D387-R389 IonicContact OD1-NE 3.71Å; D387-R389 PolarHBondContact OD1-NE 2.84Å; D387-R389 IonicContact OD1-NH2 2.7Å; D387-R389 IonicContact OD2-CZ 3.78Å; D387-R389 IonicContact OD2-NE 3.25Å; D387-R389 PolarHBondContact OD2-NE 3.29Å; D387-R389 IonicContact OD2-NH2 2.79Å; D387-R389 PolarHBondContact OD2-NH2 3.27Å; D387-N392 PolarHBondContact O-ND2 3.36Å; D387-N392 PolarHBondContact OD2-ND2 2.96Å; D387-P426 WeakPolarHBondContact OD1-CG 3.49Å
388	L	95.3	Very high	92.2	Very high	1 Å²	1	40 Å²	40	1%	0.005	21%	0.209	C	C	.	.			trans	-77.5	114.8	-178.8	-176	67.6	0	0	0	110.8	V371 M375 H385 I393 I403 S448 F449 L452 F510	V371-L388 HydrophobicContact CG1-CD1 4.2Å; M375-L388 HydrophobicContact CE-CD2 4.31Å; M375-L388 HydrophobicContact CG-CD1 4.3Å; M375-L388 HydrophobicContact CG-CD2 3.83Å; M375-L388 HydrophobicContact SD-CD1 3.99Å; M375-L388 HydrophobicContact SD-CD2 3.95Å; H385-L388 PolarHBondContact ND1-N 3.45Å; H385-L388 VanDerWaalsContact ND1-N 3.15Å; L388-I393 HydrophobicContact CD1-CD1 3.91Å; L388-I403 HydrophobicContact CD1-CG2 4.46Å; L388-S448 WeakPolarHBondContact O-CB 3.49Å; L388-F449 HydrophobicContact CD2-CB 3.84Å; L388-F449 HydrophobicContact CD2-CD2 4.2Å; L388-L452 HydrophobicContact CD1-CD1 4.29Å; L388-L452 HydrophobicContact CG-CD1 4.22Å; L388-F510 HydrophobicContact CD2-CZ 4.2Å
389	R	95.8	Very high	92.1	Very high	66 Å²	66	41.6 Å²	41.6	25%	0.249	22%	0.218	C	C	.	.	S	Bend	trans	-163.1	164.4	178.5	54.6	-179.4	165.3	134.3	6.3	111	D387 A391 N392 I393 W429	D387-R389 PolarHBondContact O-N 3.23Å; D387-R389 WeakPolarHBondContact OD1-CD 3.41Å; D387-R389 IonicContact OD1-CZ 2.85Å; D387-R389 IonicContact OD1-NE 3.71Å; D387-R389 PolarHBondContact OD1-NE 2.84Å; D387-R389 IonicContact OD1-NH2 2.7Å; D387-R389 IonicContact OD2-CZ 3.78Å; D387-R389 IonicContact OD2-NE 3.25Å; D387-R389 PolarHBondContact OD2-NE 3.29Å; D387-R389 IonicContact OD2-NH2 2.79Å; D387-R389 PolarHBondContact OD2-NH2 3.27Å; R389-A391 HydrophobicContact CG-CB 4.23Å; R389-A391 PolarHBondContact O-N 2.79Å; R389-A391 VanDerWaalsContact O-N 3.07Å; R389-N392 PolarHBondContact O-N 3.37Å; R389-I393 PolarHBondContact O-N 2.82Å; R389-W429 HydrophobicContact CB-CD2 4.23Å; R389-W429 HydrophobicContact CB-CG 3.94Å
390	S	97	Very high	92.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-57.6	-26.4	-178.6	71.5	0	0	0	0	114.2	L347 L348 N392 I393 E455	L347-S390 WeakPolarHBondContact CB-O 3.32Å; L347-S390 PolarHBondContact N-O 2.75Å; L348-S390 WeakPolarHBondContact CB-OG 3.37Å; L348-S390 WeakPolarHBondContact CD1-OG 3.28Å; L348-S390 PolarHBondContact N-O 3.09Å; L348-S390 VanDerWaalsContact N-O 3.16Å; S390-N392 VanDerWaalsContact C-N 3.26Å; S390-N392 PolarHBondContact O-N 2.75Å; S390-I393 PolarHBondContact O-N 2.95Å; S390-E455 WeakPolarHBondContact CB-OE1 3.21Å; S390-E455 PolarHBondContact N-OE2 3.45Å; S390-E455 PolarHBondContact OG-OE1 2.68Å; S390-E455 PolarHBondContact OG-OE2 3.1Å
391	A	93.5	Very high	92.3	Very high	28 Å²	28	34.6 Å²	34.6	23%	0.231	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-67.4	-24.3	174.8	0	0	0	0	0	113.8	L348 R389	L348-A391 HydrophobicContact CB-CB 4.47Å; L348-A391 HydrophobicContact CD2-CB 4.09Å; R389-A391 HydrophobicContact CG-CB 4.23Å; R389-A391 PolarHBondContact O-N 2.79Å; R389-A391 VanDerWaalsContact O-N 3.07Å
392	N	94.8	Very high	92.6	Very high	12 Å²	12	31.6 Å²	31.6	6%	0.064	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-105.5	10.1	-179.7	-67.2	-15.8	0	0	0	112.4	D387 R389 S390 A404	D387-N392 PolarHBondContact O-ND2 3.36Å; D387-N392 PolarHBondContact OD2-ND2 2.96Å; R389-N392 PolarHBondContact O-N 3.37Å; S390-N392 VanDerWaalsContact C-N 3.26Å; S390-N392 PolarHBondContact O-N 2.75Å; N392-A404 WeakPolarHBondContact O-CB 3.39Å; N392-A404 PolarHBondContact O-N 2.79Å
393	I	98	Very high	93	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	130.3	166.4	-53.1	-52.5	0	0	0	107.2	S346 L347 V371 L388 R389 S390 C401 I403 L452	S346-I393 CarbonylContact C-O 3.5Å; S346-I393 WeakPolarHBondContact CA-O 3.37Å; L347-I393 HydrophobicContact CB-CB 3.79Å; L347-I393 HydrophobicContact CB-CG2 4.05Å; L347-I393 HydrophobicContact CD2-CB 3.98Å; L347-I393 HydrophobicContact CD2-CG1 4.27Å; L347-I393 HydrophobicContact CD2-CG2 3.99Å; L347-I393 PolarHBondContact N-O 3.37Å; V371-I393 HydrophobicContact CG1-CD1 3.92Å; V371-I393 HydrophobicContact CG2-CD1 3.95Å; V371-I393 HydrophobicContact CG2-CG1 4.02Å; V371-I393 HydrophobicContact CG2-CG2 3.85Å; L388-I393 HydrophobicContact CD1-CD1 3.91Å; R389-I393 PolarHBondContact O-N 2.82Å; S390-I393 PolarHBondContact O-N 2.95Å; I393-C401 HydrophobicContact CG2-CB 3.94Å; I393-I403 HydrophobicContact CD1-CB 4.23Å; I393-I403 HydrophobicContact CD1-CG1 3.8Å; I393-I403 HydrophobicContact CD1-CG2 4.3Å; I393-L452 HydrophobicContact CD1-CD1 4.25Å; I393-L452 HydrophobicContact CG1-CD1 3.8Å
394	L	97.6	Very high	93.3	Very high	38 Å²	38	25.5 Å²	25.5	20%	0.199	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	145	175.8	-59.9	-175.3	0	0	0	110.9	V324 M342 G345 C401 K402 A404	V324-L394 HydrophobicContact CG2-CB 4.47Å; V324-L394 HydrophobicContact CG2-CD1 3.96Å; V324-L394 HydrophobicContact CG2-CG 4.41Å; M342-L394 HydrophobicContact CB-CB 3.63Å; M342-L394 HydrophobicContact CB-CD1 3.98Å; M342-L394 HydrophobicContact CB-CG 4.39Å; M342-L394 HydrophobicContact CE-CB 4.16Å; M342-L394 WeakPolarHBondContact CE-O 3.46Å; M342-L394 HydrophobicContact CG-CB 3.61Å; M342-L394 HydrophobicContact CG-CD1 3.82Å; M342-L394 HydrophobicContact CG-CG 4.38Å; G345-L394 CarbonylContact O-C 3.54Å; G345-L394 WeakPolarHBondContact O-CA 3.33Å; L394-C401 WeakPolarHBondContact O-CA 3.48Å; L394-K402 PolarHBondContact N-O 3.38Å; L394-K402 PolarHBondContact O-N 2.91Å; L394-A404 HydrophobicContact CD1-CB 3.91Å; L394-A404 HydrophobicContact CG-CB 3.83Å
395	V	97.3	Very high	93	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	129.3	-177.5	-171.9	0	0	0	0	110	K344 G345 L347 F350 M367 I400	K344-V395 WeakPolarHBondContact CA-O 3.25Å; K344-V395 HydrophobicContact CB-CB 3.95Å; K344-V395 HydrophobicContact CB-CG1 4.04Å; K344-V395 VanDerWaalsContact CB-O 3.31Å; K344-V395 WeakPolarHBondContact CB-O 3.25Å; K344-V395 HydrophobicContact CD-CG1 4.08Å; K344-V395 PolarHBondContact N-O 2.95Å; G345-V395 PolarHBondContact O-N 2.84Å; L347-V395 HydrophobicContact CB-CG2 3.97Å; L347-V395 HydrophobicContact CD1-CG2 3.94Å; F350-V395 HydrophobicContact CB-CG2 4.17Å; F350-V395 HydrophobicContact CD1-CG1 4.25Å; F350-V395 HydrophobicContact CD1-CG2 4.12Å; F350-V395 HydrophobicContact CD2-CG1 4.44Å; F350-V395 HydrophobicContact CE1-CG1 4.28Å; F350-V395 HydrophobicContact CE2-CG1 4.49Å; F350-V395 HydrophobicContact CG-CB 4.39Å; F350-V395 HydrophobicContact CG-CG1 4.32Å; F350-V395 HydrophobicContact CG-CG2 4.18Å; F350-V395 HydrophobicContact CZ-CG1 4.42Å; M367-V395 HydrophobicContact CE-CG1 4.38Å; M367-V395 HydrophobicContact CE-CG2 4.08Å; V395-I400 CarbonylContact C-O 3.59Å; V395-I400 WeakPolarHBondContact CA-O 3.41Å
396	G	93.1	Very high	92	Very high	6 Å²	6	28.4 Å²	28.4	6%	0.062	16%	0.163	C	C	.	.			trans	-105.8	-171.6	177.1	0	0	0	0	0	112.4	M342 K344 I400	M342-G396 VanDerWaalsContact CE-N 3.33Å; K344-G396 WeakPolarHBondContact CD-O 3.47Å; G396-I400 PolarHBondContact N-O 3.34Å
397	N	88.4	Confident	90.4	Very high	121 Å²	121	27 Å²	27	65%	0.647	16%	0.159	S	C	*	.	G	3₁₀ helix	trans	-63.3	148.6	171.8	-64.2	-22.6	0	0	0	110.5	S343 L399 I400	S343-N397 PolarHBondContact OG-OD1 3.1Å; N397-L399 VanDerWaalsContact C-N 3.28Å; N397-L399 PolarHBondContact O-N 3.24Å; N397-I400 WeakPolarHBondContact O-CG1 3.48Å
398	G	86.3	Confident	88.7	Confident	59 Å²	59	29.4 Å²	29.4	61%	0.608	17%	0.171	S	C	*	.	G	3₁₀ helix	trans	67.7	23.3	-178.6	0	0	0	0	0	114.8	I400	G398-I400 PolarHBondContact O-N 3.32Å
399	L	91.9	Very high	86.4	Confident	35 Å²	35	29.3 Å²	29.3	18%	0.183	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	61.1	24.3	-178.6	-52.4	178.6	0	0	0	114.2	F350 L359 N363 Q370 N397 C401	F350-L399 HydrophobicContact CE1-CD2 3.97Å; F350-L399 HydrophobicContact CZ-CD2 3.55Å; L359-L399 HydrophobicContact CD1-CD1 4.28Å; L359-L399 HydrophobicContact CD1-CD2 4.19Å; L359-L399 HydrophobicContact CD2-CD1 3.93Å; L359-L399 HydrophobicContact CD2-CD2 4.49Å; N363-L399 HydrophobicContact CB-CD1 4.32Å; Q370-L399 PolarHBondContact NE2-O 2.89Å; Q370-L399 VanDerWaalsContact NE2-O 3.1Å; N397-L399 VanDerWaalsContact C-N 3.28Å; N397-L399 PolarHBondContact O-N 3.24Å; L399-C401 PolarHBondContact O-N 3.12Å
400	I	93.4	Very high	84.3	Confident	47 Å²	47	31.6 Å²	31.6	24%	0.241	18%	0.18	C	C	.	.			trans	-65.2	125.4	174.1	-64.3	-63.6	0	0	0	109.6	V395 G396 N397 G398 K402	V395-I400 CarbonylContact C-O 3.59Å; V395-I400 WeakPolarHBondContact CA-O 3.41Å; G396-I400 PolarHBondContact N-O 3.34Å; N397-I400 WeakPolarHBondContact O-CG1 3.48Å; G398-I400 PolarHBondContact O-N 3.32Å; I400-K402 HydrophobicContact CG2-CG 4.17Å
401	C	97.4	Very high	81.6	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.007	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	128.6	176.2	-65.5	0	0	0	0	110	K322 M367 Q370 V371 I393 L394 L399	K322-C401 WeakPolarHBondContact CD-O 3.32Å; M367-C401 WeakPolarHBondContact CE-SG 3.31Å; Q370-C401 HydrophobicContact CB-CB 4.08Å; V371-C401 HydrophobicContact CG2-CB 4.26Å; I393-C401 HydrophobicContact CG2-CB 3.94Å; L394-C401 WeakPolarHBondContact O-CA 3.48Å; L399-C401 PolarHBondContact O-N 3.12Å
402	K	97.6	Very high	79.2	Confident	27 Å²	27	37.6 Å²	37.6	12%	0.117	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	137.8	173.6	-61.6	-171.4	172.8	-165.9	0	110.9	D321 K322 V324 E340 M342 L394 I400	D321-K402 WeakPolarHBondContact O-CE 3.48Å; K322-K402 CarbonylContact O-C 3.54Å; K322-K402 WeakPolarHBondContact O-CA 3.34Å; V324-K402 HydrophobicContact CG2-CB 3.64Å; E340-K402 WeakPolarHBondContact OE1-CD 3.45Å; E340-K402 IonicContact OE1-NZ 2.75Å; E340-K402 PolarHBondContact OE1-NZ 2.92Å; E340-K402 IonicContact OE2-NZ 3.33Å; E340-K402 PolarHBondContact OE2-NZ 3.4Å; M342-K402 HydrophobicContact CE-CB 3.93Å; M342-K402 HydrophobicContact CE-CD 3.98Å; M342-K402 HydrophobicContact CE-CG 3.77Å; M342-K402 HydrophobicContact SD-CD 3.98Å; M342-K402 HydrophobicContact SD-CG 4.43Å; L394-K402 PolarHBondContact N-O 3.38Å; L394-K402 PolarHBondContact O-N 2.91Å; I400-K402 HydrophobicContact CG2-CG 4.17Å
403	I	96.4	Very high	76.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	124.4	176.1	-54.9	168.9	0	0	0	108.4	K322 L323 V324 V371 M375 I378 H385 L388 I393	K322-I403 PolarHBondContact O-N 3.44Å; L323-I403 HydrophobicContact CD2-CB 3.73Å; L323-I403 HydrophobicContact CD2-CD1 3.83Å; L323-I403 HydrophobicContact CD2-CG1 4.2Å; L323-I403 HydrophobicContact CD2-CG2 4.39Å; V324-I403 PolarHBondContact N-O 3.35Å; V371-I403 HydrophobicContact CG1-CD1 4.39Å; V371-I403 HydrophobicContact CG1-CG1 4.34Å; M375-I403 HydrophobicContact CG-CD1 3.71Å; M375-I403 HydrophobicContact SD-CD1 3.79Å; I378-I403 HydrophobicContact CD1-CD1 4.39Å; H385-I403 WeakPolarHBondContact CD2-CG2 3.35Å; H385-I403 WeakPolarHBondContact NE2-CG2 2.98Å; L388-I403 HydrophobicContact CD1-CG2 4.46Å; I393-I403 HydrophobicContact CD1-CB 4.23Å; I393-I403 HydrophobicContact CD1-CG1 3.8Å; I393-I403 HydrophobicContact CD1-CG2 4.3Å
404	A	92	Very high	73.9	Confident	10 Å²	10	52.4 Å²	52.4	8%	0.083	28%	0.28	C	S	.	.			trans	-106.7	172	175.3	0	0	0	0	0	110.8	V324 H385 N392 L394 F406	V324-A404 HydrophobicContact CB-CB 4.37Å; V324-A404 HydrophobicContact CG2-CB 3.85Å; H385-A404 PolarHBondContact NE2-O 3Å; N392-A404 WeakPolarHBondContact O-CB 3.39Å; N392-A404 PolarHBondContact O-N 2.79Å; L394-A404 HydrophobicContact CD1-CB 3.91Å; L394-A404 HydrophobicContact CG-CB 3.83Å; A404-F406 PolarHBondContact O-N 3.44Å
405	D	81.2	Confident	71.4	Confident	63 Å²	63	57 Å²	57	34%	0.337	31%	0.305	S	S	.	.			trans	58.2	13.3	171.4	-77.5	-3.9	0	0	0	116.5	K296 G407 L408	K296-D405 IonicContact NZ-OD1 3.25Å; K296-D405 PolarHBondContact NZ-OD1 3.22Å; K296-D405 IonicContact NZ-OD2 3.61Å; K296-D405 PolarHBondContact NZ-OD2 3.39Å; D405-G407 PolarHBondContact O-N 3.25Å; D405-L408 PolarHBondContact O-N 3.38Å
406	F	69.4	Low	68.9	Low	4 Å²	4	61.8 Å²	61.8	2%	0.018	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-61.9	-12.1	167.7	62.9	-92.3	0	0	0	112.9	M315 L318 L323 V324 I378 Y383 A404 A409	M315-F406 HydrophobicContact CB-CE2 4.35Å; M315-F406 HydrophobicContact CG-CE2 4.39Å; L318-F406 HydrophobicContact CB-CE2 4.04Å; L318-F406 HydrophobicContact CD1-CD2 3.79Å; L318-F406 HydrophobicContact CD1-CE2 3.81Å; L323-F406 HydrophobicContact CB-CE1 3.93Å; L323-F406 HydrophobicContact CB-CZ 4.23Å; L323-F406 HydrophobicContact CD1-CZ 4.39Å; L323-F406 HydrophobicContact CD2-CD1 4.43Å; V324-F406 WeakPolarHBondContact O-CE1 3.48Å; V324-F406 WeakPolarHBondContact O-CZ 3.36Å; I378-F406 HydrophobicContact CD1-CB 4.41Å; Y383-F406 WeakPolarHBondContact CE1-O 3.44Å; A404-F406 PolarHBondContact O-N 3.44Å; F406-A409 WeakPolarHBondContact O-CB 3.27Å; F406-A409 PolarHBondContact O-N 2.94Å
407	G	54.1	Low	66.8	Low	6 Å²	6	64 Å²	64	6%	0.062	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-83.6	-9.1	-179	0	0	0	0	0	117.8	M315 D405	M315-G407 VanDerWaalsContact CG-CA 3.48Å; M315-G407 WeakPolarHBondContact SD-CA 3.36Å; D405-G407 PolarHBondContact O-N 3.25Å
408	L	53	Low	65.1	Low	93 Å²	93	63.1 Å²	63.1	49%	0.487	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-91.2	8.1	168	-65.5	172.9	0	0	0	111.5	D405	D405-L408 PolarHBondContact O-N 3.38Å
409	A	47.3	Very low	63.2	Low	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-81.5	147.5	170.2	0	0	0	0	0	110.9	Y383 I384 F406	Y383-A409 HydrophobicContact CE1-CB 3.67Å; Y383-A409 PolarHBondContact OH-O 2.63Å; I384-A409 WeakPolarHBondContact O-CB 3.35Å; F406-A409 WeakPolarHBondContact O-CB 3.27Å; F406-A409 PolarHBondContact O-N 2.94Å
410	R	50.6	Low	60.9	Low	114 Å²	114	69.5 Å²	69.5	43%	0.43	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-103	145	179.5	-66.2	-179.6	172.4	155.1	-1.5	111.3	R386 Y417	R386-R410 PolarHBondContact NH2-O 2.95Å; R410-Y417 PolarHBondContact NH1-OH 3.22Å
411	L	39.6	Very low	58.2	Low	105 Å²	105	77.1 Å²	77.1	55%	0.55	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-46.4	143.9	171.3	-99.6	149.3	0	0	0	112.6	I314	I314-L411 HydrophobicContact CD1-CD1 3.15Å; I314-L411 HydrophobicContact CD1-CG 3.66Å; I314-L411 HydrophobicContact CG1-CD1 4.16Å
412	I	44.8	Very low	55.5	Low	48 Å²	48	80.9 Å²	80.9	25%	0.246	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-91.7	120.8	168.3	-52.5	173.1	0	0	0	107	N382 I384	N382-I412 WeakPolarHBondContact O-CD1 3.4Å; I384-I412 HydrophobicContact CD1-CD1 3.42Å; I384-I412 VanDerWaalsContact CD1-CD1 3.42Å; I384-I412 HydrophobicContact CD1-CG1 3.57Å; I384-I412 HydrophobicContact CG1-CD1 3.65Å; I384-I412 HydrophobicContact CG1-CG1 4.15Å
413	E	42.2	Very low	53.3	Low	179 Å²	179	82.1 Å²	82.1	84%	0.836	43%	0.43	S	S	*	.	S	Bend	trans	-94.9	-30.2	165.7	-71	-177.1	165.7	0	0	111.4
414	D	39	Very low	51.6	Low	144 Å²	144	91.2 Å²	91.2	77%	0.77	47%	0.47	S	S	*	.	S	Bend	trans	-149.5	54.7	-173.8	-75.3	-49.2	0	0	0	115	E416	D414-E416 PolarHBondContact O-N 2.91Å
415	N	44.9	Very low	50.5	Low	134 Å²	134	94.1 Å²	94.1	72%	0.717	48%	0.481	S	S	*	.	S	Bend	trans	52.2	-5.2	174.1	-75.1	-15.1	0	0	0	119.3
416	E	44.4	Very low	50.8	Low	102 Å²	102	92.4 Å²	92.4	48%	0.477	47%	0.473	S	S	.	.			trans	-140.5	131.3	173.3	-69.6	-167.8	153.4	0	0	109.2	D414 R439	D414-E416 PolarHBondContact O-N 2.91Å; E416-R439 IonicContact OE1-CZ 3.1Å; E416-R439 IonicContact OE1-NE 2.68Å; E416-R439 IonicContact OE1-NH1 3.98Å; E416-R439 PolarHBondContact OE1-NH1 2.59Å; E416-R439 IonicContact OE2-CZ 3.2Å; E416-R439 IonicContact OE2-NE 3.46Å; E416-R439 IonicContact OE2-NH1 3.85Å
417	Y	49.9	Very low	51.8	Low	52 Å²	52	94.1 Å²	94.1	20%	0.204	48%	0.482	C	S	.	.	B	Isolated β-bridge	trans	-99.4	149.5	166.2	179.4	-108.6	0	0	0	109.5	R386 R410 A419 G438 R439 F440	R386-Y417 VanDerWaalsContact NH1-CE1 3.33Å; R410-Y417 PolarHBondContact NH1-OH 3.22Å; Y417-A419 HydrophobicContact CE1-CB 4.06Å; Y417-G438 CarbonylContact C-O 3.5Å; Y417-G438 CarbonylContact O-C 3.56Å; Y417-R439 WeakPolarHBondContact O-CA 3.31Å; Y417-F440 HydrophobicContact CD1-CD2 4.1Å
418	T	50.8	Low	53.8	Low	103 Å²	103	94.9 Å²	94.9	63%	0.632	48%	0.484	S	S	*	.			trans	-118.2	116.6	168.2	-51.9	0	0	0	0	109.2
419	A	47.8	Very low	55.9	Low	23 Å²	23	92 Å²	92	19%	0.19	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-67.7	147.2	178.3	0	0	0	0	0	113	Y417 F425 F440	Y417-A419 HydrophobicContact CE1-CB 4.06Å; A419-F425 HydrophobicContact CB-CE2 4.1Å; A419-F425 HydrophobicContact CB-CZ 3.83Å; A419-F440 HydrophobicContact CB-CE2 4.3Å
420	R	43.7	Very low	58.2	Low	204 Å²	204	92.6 Å²	92.6	77%	0.77	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-69.4	137.9	169.5	-64.2	-176.5	-178.4	178.1	1.2	109.7	G422	R420-G422 PolarHBondContact O-N 3.21Å
421	Q	35.9	Very low	60.3	Low	207 Å²	207	87.2 Å²	87.2	97%	0.967	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	129.7	175.2	-78	177.3	-15.5	0	0	111.1
422	G	41.3	Very low	62.9	Low	80 Å²	80	83 Å²	83	83%	0.825	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.8	0.8	174	0	0	0	0	0	117	R420	R420-G422 PolarHBondContact O-N 3.21Å
423	A	50.8	Low	65.3	Low	53 Å²	53	81.8 Å²	81.8	44%	0.438	42%	0.422	S	S	.	.			trans	-70.8	132.2	174.7	0	0	0	0	0	112.2	F425	A423-F425 HydrophobicContact CB-CD2 4.17Å; A423-F425 HydrophobicContact CB-CE1 4Å; A423-F425 HydrophobicContact CB-CE2 3.39Å; A423-F425 HydrophobicContact CB-CZ 3.29Å; A423-F425 WeakPolarHBondContact O-CD2 3.14Å; A423-F425 PolarHBondContact O-N 3.32Å
424	K	61.2	Low	67.6	Low	191 Å²	191	73.3 Å²	73.3	83%	0.83	38%	0.383	S	S	*	.			trans	-81.6	99.9	176.1	-71.4	-175.9	179.9	179.1	0	109.5
425	F	69.6	Low	69.9	Low	71 Å²	71	67.9 Å²	67.9	31%	0.311	36%	0.358	S	S	.	.			trans	-97.4	154.1	175.4	-59.2	-68.9	0	0	0	112	A419 A423 I427 F440	A419-F425 HydrophobicContact CB-CE2 4.1Å; A419-F425 HydrophobicContact CB-CZ 3.83Å; A423-F425 HydrophobicContact CB-CD2 4.17Å; A423-F425 HydrophobicContact CB-CE1 4Å; A423-F425 HydrophobicContact CB-CE2 3.39Å; A423-F425 HydrophobicContact CB-CZ 3.29Å; A423-F425 WeakPolarHBondContact O-CD2 3.14Å; A423-F425 PolarHBondContact O-N 3.32Å; F425-I427 HydrophobicContact CB-CD1 4.39Å; F425-I427 PolarHBondContact O-N 2.62Å; F425-F440 HydrophobicContact CD1-CZ 4.16Å; F425-F440 HydrophobicContact CE1-CE2 4.43Å; F425-F440 AromaticContact CE1-CZ 3.98Å; F425-F440 HydrophobicContact CE1-CZ 3.98Å; F425-F440 HydrophobicContact CZ-CE2 4.31Å; F425-F440 HydrophobicContact CZ-CZ 4.2Å
426	P	86.7	Confident	71.9	Confident	28 Å²	28	64.7 Å²	64.7	18%	0.182	34%	0.341	C	S	.	.			trans	-75.2	76.5	172.3	29.4	-28.4	0	0	0	110.2	D387 K428 W429 T430	D387-P426 WeakPolarHBondContact OD1-CG 3.49Å; P426-K428 PolarHBondContact O-N 2.97Å; P426-W429 HydrophobicContact CB-CE3 3.92Å; P426-W429 PolarHBondContact O-N 3.34Å; P426-T430 PolarHBondContact O-N 3.47Å; P426-T430 PolarHBondContact O-OG1 3.29Å; P426-T430 VanDerWaalsContact O-OG1 3.12Å
427	I	90.8	Very high	74	Confident	39 Å²	39	66.5 Å²	66.5	20%	0.2	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.5	-36.1	-171.1	-62.3	-59.8	0	0	0	114.2	F425 W429 T430 N469	F425-I427 HydrophobicContact CB-CD1 4.39Å; F425-I427 PolarHBondContact O-N 2.62Å; I427-W429 VanDerWaalsContact C-N 3.26Å; I427-W429 PolarHBondContact O-N 3.45Å; I427-T430 PolarHBondContact O-N 2.76Å; I427-N469 HydrophobicContact CB-CB 3.99Å; I427-N469 HydrophobicContact CG1-CB 4.13Å; I427-N469 HydrophobicContact CG2-CB 4.07Å; I427-N469 WeakPolarHBondContact CG2-O 3.32Å
428	K	96.4	Very high	75.6	Confident	22 Å²	22	64.5 Å²	64.5	10%	0.096	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-18.3	-178.6	-62.5	-171.5	165.8	-156.7	0	114.7	P426 V462 P463 Y464 M467 V472	P426-K428 PolarHBondContact O-N 2.97Å; K428-V462 HydrophobicContact CD-CG1 4.11Å; K428-P463 HydrophobicContact CB-CB 4.3Å; K428-P463 VanDerWaalsContact CD-O 3.32Å; K428-P463 WeakPolarHBondContact CD-O 3.48Å; K428-P463 PolarHBondContact NZ-O 3.28Å; K428-Y464 HydrophobicContact CB-CD2 4.19Å; K428-Y464 HydrophobicContact CG-CD2 4.44Å; K428-Y464 PolarHBondContact NZ-O 3.45Å; K428-Y464 WeakPolarHBondContact O-CE2 3.39Å; K428-M467 VanDerWaalsContact CE-O 3.27Å; K428-M467 WeakPolarHBondContact CE-O 3.41Å; K428-M467 PolarHBondContact NZ-O 3.12Å; K428-V472 HydrophobicContact CG-CG2 4.26Å
429	W	96.9	Very high	77.4	Confident	34 Å²	34	64.9 Å²	64.9	13%	0.129	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-21.3	175.4	-70.5	-100.7	0	0	0	112.2	R389 P426 I427 W447 S448 I451 E455 P463	R389-W429 HydrophobicContact CB-CD2 4.23Å; R389-W429 HydrophobicContact CB-CG 3.94Å; P426-W429 HydrophobicContact CB-CE3 3.92Å; P426-W429 PolarHBondContact O-N 3.34Å; I427-W429 VanDerWaalsContact C-N 3.26Å; I427-W429 PolarHBondContact O-N 3.45Å; W429-W447 VanDerWaalsContact O-CD1 3.26Å; W429-S448 WeakPolarHBondContact O-CA 3.4Å; W429-S448 PolarHBondContact O-OG 2.84Å; W429-I451 HydrophobicContact CD2-CG2 4.28Å; W429-I451 HydrophobicContact CG-CB 4.4Å; W429-I451 HydrophobicContact CG-CG2 3.86Å; W429-E455 WeakPolarHBondContact CZ2-OE1 3.43Å; W429-E455 PolarHBondContact NE1-OE2 3.32Å; W429-P463 HydrophobicContact CD2-CG 4.41Å; W429-P463 HydrophobicContact CH2-CG 4.06Å; W429-P463 VanDerWaalsContact CZ2-CD 3.43Å; W429-P463 HydrophobicContact CZ2-CG 3.58Å
430	T	94.3	Very high	79.3	Confident	12 Å²	12	64 Å²	64	7%	0.074	32%	0.321	C	S	.	.	S	Bend	trans	-75.3	133.5	-174.2	-49	0	0	0	0	111.7	P426 I427 A434 A435 F440	P426-T430 PolarHBondContact O-N 3.47Å; P426-T430 PolarHBondContact O-OG1 3.29Å; P426-T430 VanDerWaalsContact O-OG1 3.12Å; I427-T430 PolarHBondContact O-N 2.76Å; T430-A434 HydrophobicContact CG2-CB 3.64Å; T430-A435 HydrophobicContact CG2-CB 3.92Å; T430-F440 HydrophobicContact CG2-CE1 4.27Å; T430-F440 HydrophobicContact CG2-CZ 4.45Å
431	A	96.1	Very high	81.6	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.008	29%	0.292	C	S	.	.			trans	-61.4	149.3	173	0	0	0	0	0	111.5	E433 A434 A435 W447	A431-E433 VanDerWaalsContact C-N 3.33Å; A431-E433 WeakPolarHBondContact CB-OE1 3.41Å; A431-E433 WeakPolarHBondContact CB-OE2 3.34Å; A431-E433 PolarHBondContact O-N 3.04Å; A431-A434 HydrophobicContact CB-CB 4.34Å; A431-A434 PolarHBondContact O-N 3.33Å; A431-A434 VanDerWaalsContact O-N 3.1Å; A431-A435 PolarHBondContact O-N 3.13Å; A431-W447 HydrophobicContact CB-CB 3.71Å; A431-W447 HydrophobicContact CB-CD2 4.04Å; A431-W447 HydrophobicContact CB-CE3 4.46Å; A431-W447 HydrophobicContact CB-CG 3.68Å
432	P	94.3	Very high	84.4	Confident	17 Å²	17	47.3 Å²	47.3	11%	0.11	25%	0.254	C	S	.	.	H	α-helix	trans	-59.5	-40.2	-175	22.3	-32.7	0	0	0	112.9	A434 A435 L436 W447 V476	P432-A434 VanDerWaalsContact C-N 3.32Å; P432-A434 PolarHBondContact O-N 2.97Å; P432-A435 PolarHBondContact O-N 3.17Å; P432-L436 VanDerWaalsContact O-CB 3.28Å; P432-L436 WeakPolarHBondContact O-CB 3.36Å; P432-L436 VanDerWaalsContact O-CG 3.27Å; P432-L436 WeakPolarHBondContact O-CG 3.29Å; P432-L436 PolarHBondContact O-N 3.32Å; P432-W447 HydrophobicContact CG-CH2 4.14Å; P432-W447 HydrophobicContact CG-CZ3 4.06Å; P432-V476 HydrophobicContact CB-CG1 4.3Å; P432-V476 HydrophobicContact CG-CG1 4.34Å
433	E	93.6	Very high	87.1	Confident	21 Å²	21	44.7 Å²	44.7	10%	0.098	22%	0.22	C	C	.	.	H	α-helix	trans	-66.3	-34.3	177.5	72.2	-72.7	175	0	0	113	A431 Y437 G438 R439 P504 R507	A431-E433 VanDerWaalsContact C-N 3.33Å; A431-E433 WeakPolarHBondContact CB-OE1 3.41Å; A431-E433 WeakPolarHBondContact CB-OE2 3.34Å; A431-E433 PolarHBondContact O-N 3.04Å; E433-Y437 HydrophobicContact CB-CD2 4.3Å; E433-Y437 WeakPolarHBondContact O-CA 3.26Å; E433-Y437 WeakPolarHBondContact O-CB 3.27Å; E433-Y437 PolarHBondContact O-N 3.29Å; E433-G438 PolarHBondContact O-N 2.7Å; E433-R439 HydrophobicContact CG-CB 4.45Å; E433-R439 PolarHBondContact O-N 2.78Å; E433-P504 HydrophobicContact CG-CG 4.07Å; E433-R507 IonicContact OE1-CZ 3.11Å; E433-R507 IonicContact OE1-NH1 2.78Å; E433-R507 PolarHBondContact OE1-NH1 2.83Å; E433-R507 IonicContact OE1-NH2 3.05Å; E433-R507 PolarHBondContact OE1-NH2 3.17Å; E433-R507 IonicContact OE2-CZ 3.87Å; E433-R507 IonicContact OE2-NH1 3.67Å; E433-R507 IonicContact OE2-NH2 3.77Å; E433-R507 PolarHBondContact OE2-NH2 3.18Å
434	A	90.6	Very high	89.3	Confident	2 Å²	2	42.2 Å²	42.2	2%	0.017	20%	0.2	C	C	.	.	H	α-helix	trans	-73	-39.3	176	0	0	0	0	0	111.4	T430 A431 P432 G438 R439 F440	T430-A434 HydrophobicContact CG2-CB 3.64Å; A431-A434 HydrophobicContact CB-CB 4.34Å; A431-A434 PolarHBondContact O-N 3.33Å; A431-A434 VanDerWaalsContact O-N 3.1Å; P432-A434 VanDerWaalsContact C-N 3.32Å; P432-A434 PolarHBondContact O-N 2.97Å; A434-G438 WeakPolarHBondContact O-CA 3.36Å; A434-G438 PolarHBondContact O-N 2.96Å; A434-G438 VanDerWaalsContact O-N 3.1Å; A434-R439 WeakPolarHBondContact CA-O 3.21Å; A434-R439 WeakPolarHBondContact CB-O 3.4Å; A434-F440 HydrophobicContact CB-CD1 3.92Å; A434-F440 HydrophobicContact CB-CD2 4.47Å; A434-F440 HydrophobicContact CB-CE1 3.85Å; A434-F440 HydrophobicContact CB-CE2 4.38Å; A434-F440 HydrophobicContact CB-CG 4.25Å; A434-F440 HydrophobicContact CB-CZ 4.08Å
435	A	88.2	Confident	91	Very high	30 Å²	30	33.1 Å²	33.1	25%	0.248	16%	0.16	C	C	.	.	H	α-helix	trans	-73	-39.9	179.5	0	0	0	0	0	113	T430 A431 P432 L473	T430-A435 HydrophobicContact CG2-CB 3.92Å; A431-A435 PolarHBondContact O-N 3.13Å; P432-A435 PolarHBondContact O-N 3.17Å; A435-L473 HydrophobicContact CB-CD1 3.77Å
436	L	87.4	Confident	92.4	Very high	66 Å²	66	29.8 Å²	29.8	35%	0.346	15%	0.145	S	C	.	.	H	α-helix	trans	-86.7	-42.3	-175	-66.3	170.2	0	0	0	112.9	P432 L473	P432-L436 VanDerWaalsContact O-CB 3.28Å; P432-L436 WeakPolarHBondContact O-CB 3.36Å; P432-L436 VanDerWaalsContact O-CG 3.27Å; P432-L436 WeakPolarHBondContact O-CG 3.29Å; P432-L436 PolarHBondContact O-N 3.32Å; L436-L473 HydrophobicContact CD2-CD1 4.03Å; L436-L473 HydrophobicContact CD2-CD2 3.78Å; L436-L473 HydrophobicContact CD2-CG 4Å; L436-L473 HydrophobicContact CG-CD1 4.05Å
437	Y	87.3	Confident	93	Very high	141 Å²	141	28.5 Å²	28.5	55%	0.553	14%	0.137	S	C	*	.	H	α-helix	trans	-114.4	0.5	-171.5	-46.5	-59	0	0	0	112.7	E433 R439	E433-Y437 HydrophobicContact CB-CD2 4.3Å; E433-Y437 WeakPolarHBondContact O-CA 3.26Å; E433-Y437 WeakPolarHBondContact O-CB 3.27Å; E433-Y437 PolarHBondContact O-N 3.29Å; Y437-R439 PolarHBondContact O-N 3.15Å
438	G	83.3	Confident	93.3	Very high	9 Å²	9	26.9 Å²	26.9	9%	0.093	13%	0.129	C	C	.	.			trans	70.5	11.2	-178.3	0	0	0	0	0	114	Y417 E433 A434 F440	Y417-G438 CarbonylContact C-O 3.5Å; Y417-G438 CarbonylContact O-C 3.56Å; E433-G438 PolarHBondContact O-N 2.7Å; A434-G438 WeakPolarHBondContact O-CA 3.36Å; A434-G438 PolarHBondContact O-N 2.96Å; A434-G438 VanDerWaalsContact O-N 3.1Å; G438-F440 WeakPolarHBondContact O-CD2 3.17Å; G438-F440 PolarHBondContact O-N 2.93Å
439	R	88.3	Confident	93.5	Very high	112 Å²	112	25.9 Å²	25.9	42%	0.423	13%	0.125	S	C	.	.			trans	-81.9	95.2	-175.2	-68	-176.1	-175.4	-158.1	7.7	111.9	E416 Y417 E433 A434 Y437	E416-R439 IonicContact OE1-CZ 3.1Å; E416-R439 IonicContact OE1-NE 2.68Å; E416-R439 IonicContact OE1-NH1 3.98Å; E416-R439 PolarHBondContact OE1-NH1 2.59Å; E416-R439 IonicContact OE2-CZ 3.2Å; E416-R439 IonicContact OE2-NE 3.46Å; E416-R439 IonicContact OE2-NH1 3.85Å; Y417-R439 WeakPolarHBondContact O-CA 3.31Å; E433-R439 HydrophobicContact CG-CB 4.45Å; E433-R439 PolarHBondContact O-N 2.78Å; A434-R439 WeakPolarHBondContact CA-O 3.21Å; A434-R439 WeakPolarHBondContact CB-O 3.4Å; Y437-R439 PolarHBondContact O-N 3.15Å
440	F	87.9	Confident	93.5	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.018	12%	0.119	C	C	.	.	B	Isolated β-bridge	trans	-93.7	129.9	174.6	-67.3	-92.5	0	0	0	110.6	I384 R386 Y417 A419 F425 T430 A434 G438	I384-F440 WeakPolarHBondContact CD1-O 3.47Å; I384-F440 HydrophobicContact CG2-CB 4.42Å; R386-F440 HydrophobicContact CB-CD1 3.97Å; R386-F440 HydrophobicContact CB-CE1 4.29Å; R386-F440 HydrophobicContact CG-CB 4.3Å; R386-F440 HydrophobicContact CG-CD1 4.05Å; R386-F440 HydrophobicContact CG-CG 4.3Å; Y417-F440 HydrophobicContact CD1-CD2 4.1Å; A419-F440 HydrophobicContact CB-CE2 4.3Å; F425-F440 HydrophobicContact CD1-CZ 4.16Å; F425-F440 HydrophobicContact CE1-CE2 4.43Å; F425-F440 AromaticContact CE1-CZ 3.98Å; F425-F440 HydrophobicContact CE1-CZ 3.98Å; F425-F440 HydrophobicContact CZ-CE2 4.31Å; F425-F440 HydrophobicContact CZ-CZ 4.2Å; T430-F440 HydrophobicContact CG2-CE1 4.27Å; T430-F440 HydrophobicContact CG2-CZ 4.45Å; A434-F440 HydrophobicContact CB-CD1 3.92Å; A434-F440 HydrophobicContact CB-CD2 4.47Å; A434-F440 HydrophobicContact CB-CE1 3.85Å; A434-F440 HydrophobicContact CB-CE2 4.38Å; A434-F440 HydrophobicContact CB-CG 4.25Å; A434-F440 HydrophobicContact CB-CZ 4.08Å; G438-F440 WeakPolarHBondContact O-CD2 3.17Å; G438-F440 PolarHBondContact O-N 2.93Å
441	T	92.9	Very high	93.7	Very high	29 Å²	29	23.7 Å²	23.7	18%	0.178	12%	0.115	C	C	.	.			trans	-143.5	171.2	176.2	67.9	0	0	0	0	109.7	K443 S444 D445	T441-K443 PolarHBondContact O-N 2.84Å; T441-K443 PolarHBondContact OG1-N 3.22Å; T441-S444 PolarHBondContact N-OG 3.13Å; T441-S444 WeakPolarHBondContact O-CB 3.18Å; T441-S444 PolarHBondContact O-N 3.2Å; T441-S444 PolarHBondContact O-OG 3.42Å; T441-S444 PolarHBondContact OG1-N 3.38Å; T441-D445 PolarHBondContact O-N 3.06Å
442	I	95	Very high	93.9	Very high	32 Å²	32	23.6 Å²	23.6	16%	0.164	12%	0.115	C	C	.	.	H	α-helix	trans	-57.8	-30.7	171.4	-167.6	64.1	0	0	0	111.9	M375 I378 E379 S444 D445 V446 F510	M375-I442 HydrophobicContact CE-CD1 3.97Å; I378-I442 HydrophobicContact CG2-CD1 4.32Å; E379-I442 HydrophobicContact CB-CD1 3.97Å; E379-I442 HydrophobicContact CB-CG1 3.88Å; E379-I442 HydrophobicContact CG-CG1 3.92Å; I442-S444 VanDerWaalsContact C-N 3.31Å; I442-S444 PolarHBondContact O-N 3.42Å; I442-D445 HydrophobicContact CD1-CB 4.43Å; I442-D445 WeakPolarHBondContact O-CB 3.5Å; I442-D445 PolarHBondContact O-N 3.48Å; I442-D445 VanDerWaalsContact O-N 3.09Å; I442-V446 WeakPolarHBondContact O-CG2 3.25Å; I442-V446 PolarHBondContact O-N 3.45Å; I442-F510 HydrophobicContact CD1-CD2 3.76Å; I442-F510 HydrophobicContact CD1-CE2 3.69Å; I442-F510 HydrophobicContact CG1-CD2 3.92Å; I442-F510 HydrophobicContact CG1-CE2 4.05Å
443	K	98.1	Very high	94.1	Very high	24 Å²	24	23 Å²	23	10%	0.104	11%	0.11	C	C	.	.	H	α-helix	trans	-68.6	-28.3	175.3	-60.1	-59.5	-169.6	174.4	0	113	T441 D445 V446 W447 P504 R507 P508	T441-K443 PolarHBondContact O-N 2.84Å; T441-K443 PolarHBondContact OG1-N 3.22Å; K443-D445 VanDerWaalsContact C-N 3.34Å; K443-V446 PolarHBondContact O-N 3.02Å; K443-W447 PolarHBondContact O-N 3.06Å; K443-P504 HydrophobicContact CB-CB 3.76Å; K443-P504 WeakPolarHBondContact CD-O 3.21Å; K443-P504 HydrophobicContact CG-CB 4.31Å; K443-P504 WeakPolarHBondContact CG-O 3.39Å; K443-R507 HydrophobicContact CD-CB 4.32Å; K443-R507 PolarHBondContact NZ-O 2.83Å; K443-R507 WeakPolarHBondContact O-CD 3.44Å; K443-R507 PolarHBondContact O-NH1 3.25Å; K443-P508 PolarHBondContact NZ-O 3.02Å
444	S	96.4	Very high	94.3	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.014	11%	0.107	C	C	.	.	H	α-helix	trans	-72.4	-28.4	170.5	72.9	0	0	0	0	112.4	T441 I442 W447 S448	T441-S444 PolarHBondContact N-OG 3.13Å; T441-S444 WeakPolarHBondContact O-CB 3.18Å; T441-S444 PolarHBondContact O-N 3.2Å; T441-S444 PolarHBondContact O-OG 3.42Å; T441-S444 PolarHBondContact OG1-N 3.38Å; I442-S444 VanDerWaalsContact C-N 3.31Å; I442-S444 PolarHBondContact O-N 3.42Å; S444-W447 WeakPolarHBondContact O-CB 3.2Å; S444-S448 PolarHBondContact O-N 3.39Å; S444-S448 PolarHBondContact O-OG 3.49Å
445	D	97.1	Very high	94.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-73.1	-34.4	170	-69.8	-31.4	0	0	0	111.8	M375 I384 H385 R386 T441 I442 K443 W447 S448 F449 F510	M375-D445 HydrophobicContact CE-CB 3.67Å; I384-D445 VanDerWaalsContact CG2-OD2 3.25Å; I384-D445 WeakPolarHBondContact CG2-OD2 3.31Å; H385-D445 PolarHBondContact N-OD2 2.8Å; R386-D445 WeakPolarHBondContact CA-OD1 3.23Å; R386-D445 PolarHBondContact N-OD1 2.9Å; T441-D445 PolarHBondContact O-N 3.06Å; I442-D445 HydrophobicContact CD1-CB 4.43Å; I442-D445 WeakPolarHBondContact O-CB 3.5Å; I442-D445 PolarHBondContact O-N 3.48Å; I442-D445 VanDerWaalsContact O-N 3.09Å; K443-D445 VanDerWaalsContact C-N 3.34Å; D445-W447 VanDerWaalsContact C-N 3.28Å; D445-W447 PolarHBondContact O-N 3.42Å; D445-S448 CarbonylContact O-C 3.56Å; D445-S448 WeakPolarHBondContact O-CA 3.4Å; D445-S448 WeakPolarHBondContact O-CB 3.33Å; D445-S448 PolarHBondContact O-N 3.38Å; D445-S448 VanDerWaalsContact O-N 3.08Å; D445-F449 PolarHBondContact O-N 2.97Å; D445-F510 HydrophobicContact CB-CE2 3.96Å; D445-F510 HydrophobicContact CB-CZ 4.1Å
446	V	98.8	Very high	95.1	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58.6	-41.2	172.6	171.7	0	0	0	0	111.1	I442 K443 S448 F449 G450 C499 R507 P508 F510 L513	I442-V446 WeakPolarHBondContact O-CG2 3.25Å; I442-V446 PolarHBondContact O-N 3.45Å; K443-V446 PolarHBondContact O-N 3.02Å; V446-S448 PolarHBondContact O-N 2.59Å; V446-F449 WeakPolarHBondContact O-CB 3.47Å; V446-F449 PolarHBondContact O-N 3.07Å; V446-G450 PolarHBondContact O-N 2.9Å; V446-C499 HydrophobicContact CG1-CB 4.09Å; V446-C499 WeakPolarHBondContact O-CB 3.46Å; V446-R507 HydrophobicContact CB-CB 4.46Å; V446-R507 HydrophobicContact CG1-CB 3.86Å; V446-P508 HydrophobicContact CG1-CG 4.13Å; V446-P508 WeakPolarHBondContact CG2-O 3.47Å; V446-F510 HydrophobicContact CB-CE2 4.49Å; V446-F510 HydrophobicContact CG2-CD2 3.87Å; V446-F510 HydrophobicContact CG2-CE2 3.56Å; V446-F510 HydrophobicContact CG2-CG 4.5Å; V446-F510 HydrophobicContact CG2-CZ 3.96Å; V446-L513 HydrophobicContact CG1-CD1 4.14Å
447	W	98.7	Very high	95.6	Very high	2 Å²	2	18.9 Å²	18.9	1%	0.008	9%	0.086	C	C	.	.	H	α-helix	trans	-58.5	-48.8	171.9	177.9	-73.7	0	0	0	111.7	W429 A431 P432 K443 S444 D445 F449 G450 I451 V476 C499 W500	W429-W447 VanDerWaalsContact O-CD1 3.26Å; A431-W447 HydrophobicContact CB-CB 3.71Å; A431-W447 HydrophobicContact CB-CD2 4.04Å; A431-W447 HydrophobicContact CB-CE3 4.46Å; A431-W447 HydrophobicContact CB-CG 3.68Å; P432-W447 HydrophobicContact CG-CH2 4.14Å; P432-W447 HydrophobicContact CG-CZ3 4.06Å; K443-W447 PolarHBondContact O-N 3.06Å; S444-W447 WeakPolarHBondContact O-CB 3.2Å; D445-W447 VanDerWaalsContact C-N 3.28Å; D445-W447 PolarHBondContact O-N 3.42Å; W447-F449 VanDerWaalsContact C-N 3.27Å; W447-F449 PolarHBondContact O-N 2.74Å; W447-G450 WeakPolarHBondContact O-CA 3.35Å; W447-G450 PolarHBondContact O-N 3.38Å; W447-I451 PolarHBondContact O-N 2.91Å; W447-I451 VanDerWaalsContact O-N 3.14Å; W447-V476 HydrophobicContact CH2-CG1 3.49Å; W447-V476 VanDerWaalsContact CH2-CG1 3.49Å; W447-V476 HydrophobicContact CZ2-CG1 3.53Å; W447-C499 WeakPolarHBondContact CA-O 3.3Å; W447-W500 HydrophobicContact CD2-CB 4.48Å; W447-W500 AromaticContact CD2-CD1 3.71Å; W447-W500 HydrophobicContact CD2-CG 4.43Å; W447-W500 AromaticContact CE2-CD1 3.82Å; W447-W500 HydrophobicContact CE3-CB 4.05Å; W447-W500 HydrophobicContact CE3-CG 4.46Å; W447-W500 AromaticContact CG-CD1 3.97Å; W447-W500 HydrophobicContact CH2-CB 4Å; W447-W500 HydrophobicContact CH2-CG 4.5Å; W447-W500 HydrophobicContact CZ2-CB 4.45Å; W447-W500 HydrophobicContact CZ2-CG 4.48Å; W447-W500 HydrophobicContact CZ3-CB 3.81Å; W447-W500 VanDerWaalsContact CZ3-O 3.31Å; W447-W500 WeakPolarHBondContact CZ3-O 3.41Å; W447-W500 PolarHBondContact O-NE1 3.03Å
448	S	98.5	Very high	96	Very high	5 Å²	5	13.6 Å²	13.6	4%	0.035	7%	0.068	C	C	.	.	H	α-helix	trans	-60.4	-37.9	179.6	-54.1	0	0	0	0	111.4	L388 W429 S444 D445 V446 I451 L452	L388-S448 WeakPolarHBondContact O-CB 3.49Å; W429-S448 WeakPolarHBondContact O-CA 3.4Å; W429-S448 PolarHBondContact O-OG 2.84Å; S444-S448 PolarHBondContact O-N 3.39Å; S444-S448 PolarHBondContact O-OG 3.49Å; D445-S448 CarbonylContact O-C 3.56Å; D445-S448 WeakPolarHBondContact O-CA 3.4Å; D445-S448 WeakPolarHBondContact O-CB 3.33Å; D445-S448 PolarHBondContact O-N 3.38Å; D445-S448 VanDerWaalsContact O-N 3.08Å; V446-S448 PolarHBondContact O-N 2.59Å; S448-I451 WeakPolarHBondContact O-CB 3.38Å; S448-I451 PolarHBondContact O-N 3.1Å; S448-I451 VanDerWaalsContact O-N 3.17Å; S448-L452 PolarHBondContact O-N 3.04Å
449	F	98.8	Very high	96.7	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-62.6	-42.3	172.8	-176.3	-101.9	0	0	0	112.1	A368 V371 A372 L388 D445 V446 W447 I451 L452 L453 F510 L513 L517	A368-F449 HydrophobicContact CB-CZ 4.42Å; V371-F449 HydrophobicContact CB-CE2 4.15Å; V371-F449 HydrophobicContact CG1-CD2 4.07Å; V371-F449 HydrophobicContact CG1-CE2 3.9Å; A372-F449 HydrophobicContact CB-CE2 4.13Å; A372-F449 HydrophobicContact CB-CZ 3.83Å; L388-F449 HydrophobicContact CD2-CB 3.84Å; L388-F449 HydrophobicContact CD2-CD2 4.2Å; D445-F449 PolarHBondContact O-N 2.97Å; V446-F449 WeakPolarHBondContact O-CB 3.47Å; V446-F449 PolarHBondContact O-N 3.07Å; W447-F449 VanDerWaalsContact C-N 3.27Å; W447-F449 PolarHBondContact O-N 2.74Å; F449-I451 VanDerWaalsContact C-N 3.25Å; F449-I451 PolarHBondContact O-N 3.31Å; F449-L452 HydrophobicContact CD2-CD2 4.47Å; F449-L452 HydrophobicContact CE2-CD2 4.42Å; F449-L452 WeakPolarHBondContact O-CA 3.41Å; F449-L452 WeakPolarHBondContact O-CB 3.49Å; F449-L452 PolarHBondContact O-N 3.35Å; F449-L452 VanDerWaalsContact O-N 3.08Å; F449-L453 HydrophobicContact CD1-CD1 4.18Å; F449-L453 HydrophobicContact CD1-CG 4.2Å; F449-L453 HydrophobicContact CE1-CD1 3.85Å; F449-L453 HydrophobicContact CE1-CD2 3.89Å; F449-L453 HydrophobicContact CE1-CG 3.9Å; F449-L453 HydrophobicContact CZ-CD2 3.84Å; F449-L453 HydrophobicContact CZ-CG 4.29Å; F449-L453 WeakPolarHBondContact O-CG 3.28Å; F449-L453 PolarHBondContact O-N 3.33Å; F449-F510 HydrophobicContact CB-CE1 3.7Å; F449-F510 HydrophobicContact CB-CZ 3.99Å; F449-F510 HydrophobicContact CD1-CE1 4.31Å; F449-F510 AromaticContact CD2-CE1 3.98Å; F449-F510 HydrophobicContact CD2-CE1 3.98Å; F449-F510 AromaticContact CG-CE1 3.74Å; F449-F510 HydrophobicContact CG-CE1 3.74Å; F449-L513 HydrophobicContact CD1-CD1 3.72Å; F449-L513 HydrophobicContact CE1-CB 4.31Å; F449-L513 HydrophobicContact CE1-CD1 4.04Å; F449-L513 HydrophobicContact CE1-CD2 4.38Å; F449-L513 HydrophobicContact CE1-CG 4.49Å; F449-L517 HydrophobicContact CE1-CD1 3.92Å; F449-L517 HydrophobicContact CZ-CD1 3.59Å
450	G	98.8	Very high	97	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-56.4	-40.3	172.2	0	0	0	0	0	112.5	V446 W447 L453 T454 W500	V446-G450 PolarHBondContact O-N 2.9Å; W447-G450 WeakPolarHBondContact O-CA 3.35Å; W447-G450 PolarHBondContact O-N 3.38Å; G450-L453 PolarHBondContact O-N 3.21Å; G450-T454 PolarHBondContact O-N 3.22Å; G450-W500 VanDerWaalsContact C-CZ2 3.49Å; G450-W500 VanDerWaalsContact O-CZ2 3.27Å; G450-W500 WeakPolarHBondContact O-CZ2 3.33Å
451	I	98.8	Very high	97.4	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-67.2	-42.7	174	-55.8	-67.5	0	0	0	111	W429 W447 S448 F449 L453 T454 E455 P463 Y464 M482 W500	W429-I451 HydrophobicContact CD2-CG2 4.28Å; W429-I451 HydrophobicContact CG-CB 4.4Å; W429-I451 HydrophobicContact CG-CG2 3.86Å; W447-I451 PolarHBondContact O-N 2.91Å; W447-I451 VanDerWaalsContact O-N 3.14Å; S448-I451 WeakPolarHBondContact O-CB 3.38Å; S448-I451 PolarHBondContact O-N 3.1Å; S448-I451 VanDerWaalsContact O-N 3.17Å; F449-I451 VanDerWaalsContact C-N 3.25Å; F449-I451 PolarHBondContact O-N 3.31Å; I451-L453 VanDerWaalsContact C-N 3.28Å; I451-L453 PolarHBondContact O-N 2.76Å; I451-T454 WeakPolarHBondContact O-CA 3.13Å; I451-T454 WeakPolarHBondContact O-CB 3.4Å; I451-T454 PolarHBondContact O-N 3.39Å; I451-T454 PolarHBondContact O-OG1 2.9Å; I451-E455 PolarHBondContact O-N 3.35Å; I451-E455 VanDerWaalsContact O-N 3.15Å; I451-P463 HydrophobicContact CG2-CB 3.84Å; I451-P463 HydrophobicContact CG2-CG 3.42Å; I451-P463 VanDerWaalsContact CG2-CG 3.42Å; I451-Y464 HydrophobicContact CD1-CE2 3.84Å; I451-M482 HydrophobicContact CD1-CE 3.55Å; I451-W500 HydrophobicContact CD1-CZ2 3.69Å; I451-W500 HydrophobicContact CG1-CZ2 4.45Å
452	L	98.7	Very high	97.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-57.7	-39	175.2	-179.1	156.3	0	0	0	112.3	V371 L388 I393 S448 F449 T454 E455 L456	V371-L452 HydrophobicContact CG1-CD1 4.13Å; L388-L452 HydrophobicContact CD1-CD1 4.29Å; L388-L452 HydrophobicContact CG-CD1 4.22Å; I393-L452 HydrophobicContact CD1-CD1 4.25Å; I393-L452 HydrophobicContact CG1-CD1 3.8Å; S448-L452 PolarHBondContact O-N 3.04Å; F449-L452 HydrophobicContact CD2-CD2 4.47Å; F449-L452 HydrophobicContact CE2-CD2 4.42Å; F449-L452 WeakPolarHBondContact O-CA 3.41Å; F449-L452 WeakPolarHBondContact O-CB 3.49Å; F449-L452 PolarHBondContact O-N 3.35Å; F449-L452 VanDerWaalsContact O-N 3.08Å; L452-T454 VanDerWaalsContact C-N 3.25Å; L452-T454 PolarHBondContact O-N 2.84Å; L452-E455 WeakPolarHBondContact O-CB 3.27Å; L452-E455 PolarHBondContact O-N 3.32Å; L452-E455 VanDerWaalsContact O-N 3.08Å; L452-L456 HydrophobicContact CD2-CD1 3.63Å; L452-L456 HydrophobicContact CD2-CG 4.23Å; L452-L456 PolarHBondContact O-N 3.15Å
453	L	98.7	Very high	97.6	Very high	3 Å²	3	19.9 Å²	19.9	2%	0.016	10%	0.095	C	C	.	.	H	α-helix	trans	-59.1	-38.2	173.8	-66.4	179.3	0	0	0	111.5	A368 F449 G450 I451 E455 L456 V457 L492 L495 M496	A368-L453 HydrophobicContact CB-CD2 3.52Å; F449-L453 HydrophobicContact CD1-CD1 4.18Å; F449-L453 HydrophobicContact CD1-CG 4.2Å; F449-L453 HydrophobicContact CE1-CD1 3.85Å; F449-L453 HydrophobicContact CE1-CD2 3.89Å; F449-L453 HydrophobicContact CE1-CG 3.9Å; F449-L453 HydrophobicContact CZ-CD2 3.84Å; F449-L453 HydrophobicContact CZ-CG 4.29Å; F449-L453 WeakPolarHBondContact O-CG 3.28Å; F449-L453 PolarHBondContact O-N 3.33Å; G450-L453 PolarHBondContact O-N 3.21Å; I451-L453 VanDerWaalsContact C-N 3.28Å; I451-L453 PolarHBondContact O-N 2.76Å; L453-E455 VanDerWaalsContact C-N 3.35Å; L453-L456 HydrophobicContact CD2-CD1 4.4Å; L453-L456 PolarHBondContact O-N 3.15Å; L453-V457 WeakPolarHBondContact O-CG2 3.48Å; L453-V457 PolarHBondContact O-N 3.41Å; L453-V457 VanDerWaalsContact O-N 3.15Å; L453-L492 HydrophobicContact CD1-CD1 4.45Å; L453-L495 HydrophobicContact CD1-CD2 4.01Å; L453-M496 HydrophobicContact CB-CE 3.66Å; L453-M496 HydrophobicContact CB-CG 3.91Å; L453-M496 HydrophobicContact CB-SD 4.46Å; L453-M496 HydrophobicContact CD1-CG 3.99Å
454	T	98.2	Very high	97.6	Very high	6 Å²	6	18.8 Å²	18.8	4%	0.037	9%	0.09	C	C	.	.	H	α-helix	trans	-64.7	-40	174.3	70.4	0	0	0	0	111.8	G450 I451 L452 L456 V457 T458 M482 M496 W500	G450-T454 PolarHBondContact O-N 3.22Å; I451-T454 WeakPolarHBondContact O-CA 3.13Å; I451-T454 WeakPolarHBondContact O-CB 3.4Å; I451-T454 PolarHBondContact O-N 3.39Å; I451-T454 PolarHBondContact O-OG1 2.9Å; L452-T454 VanDerWaalsContact C-N 3.25Å; L452-T454 PolarHBondContact O-N 2.84Å; T454-L456 VanDerWaalsContact C-N 3.34Å; T454-L456 PolarHBondContact O-N 3.03Å; T454-V457 PolarHBondContact O-N 2.98Å; T454-T458 VanDerWaalsContact O-CB 3.27Å; T454-T458 WeakPolarHBondContact O-CB 3.42Å; T454-T458 VanDerWaalsContact O-CG2 3.26Å; T454-T458 WeakPolarHBondContact O-CG2 3.18Å; T454-T458 PolarHBondContact O-N 3.27Å; T454-T458 PolarHBondContact O-OG1 3.07Å; T454-M482 HydrophobicContact CG2-CE 3.8Å; T454-M496 HydrophobicContact CG2-CE 4.36Å; T454-M496 HydrophobicContact CG2-SD 3.66Å; T454-W500 HydrophobicContact CG2-CH2 3.44Å; T454-W500 VanDerWaalsContact CG2-CH2 3.44Å; T454-W500 HydrophobicContact CG2-CZ2 3.62Å
455	E	98.2	Very high	97.6	Very high	3 Å²	3	23.9 Å²	23.9	1%	0.014	12%	0.123	C	C	.	.	H	α-helix	trans	-61.3	-43.9	176.6	-60.3	-177.6	91.3	0	0	110.8	S390 W429 I451 L452 L453 T458 K459 G460 P463	S390-E455 WeakPolarHBondContact CB-OE1 3.21Å; S390-E455 PolarHBondContact N-OE2 3.45Å; S390-E455 PolarHBondContact OG-OE1 2.68Å; S390-E455 PolarHBondContact OG-OE2 3.1Å; W429-E455 WeakPolarHBondContact CZ2-OE1 3.43Å; W429-E455 PolarHBondContact NE1-OE2 3.32Å; I451-E455 PolarHBondContact O-N 3.35Å; I451-E455 VanDerWaalsContact O-N 3.15Å; L452-E455 WeakPolarHBondContact O-CB 3.27Å; L452-E455 PolarHBondContact O-N 3.32Å; L452-E455 VanDerWaalsContact O-N 3.08Å; L453-E455 VanDerWaalsContact C-N 3.35Å; E455-T458 PolarHBondContact O-N 3.4Å; E455-K459 PolarHBondContact O-N 2.93Å; E455-G460 PolarHBondContact O-N 3.41Å; E455-P463 HydrophobicContact CG-CG 4.31Å
456	L	98.1	Very high	97.5	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-57.5	-56	177	-82	166.2	0	0	0	112	L347 L351 L364 M367 A368 L452 L453 T454 T458 K459	L347-L456 HydrophobicContact CD1-CD2 4.22Å; L347-L456 HydrophobicContact CD2-CD2 3.97Å; L347-L456 HydrophobicContact CD2-CG 4.42Å; L347-L456 HydrophobicContact CG-CD2 4.49Å; L351-L456 HydrophobicContact CD1-CD2 4.13Å; L351-L456 HydrophobicContact CD2-CD2 4.47Å; L364-L456 WeakPolarHBondContact CD1-O 3.42Å; L364-L456 HydrophobicContact CD2-CD2 4.13Å; M367-L456 HydrophobicContact CB-CD2 4.21Å; A368-L456 HydrophobicContact CB-CD1 3.69Å; L452-L456 HydrophobicContact CD2-CD1 3.63Å; L452-L456 HydrophobicContact CD2-CG 4.23Å; L452-L456 PolarHBondContact O-N 3.15Å; L453-L456 HydrophobicContact CD2-CD1 4.4Å; L453-L456 PolarHBondContact O-N 3.15Å; T454-L456 VanDerWaalsContact C-N 3.34Å; T454-L456 PolarHBondContact O-N 3.03Å; L456-T458 VanDerWaalsContact C-N 3.26Å; L456-T458 PolarHBondContact O-N 3.05Å; L456-K459 PolarHBondContact O-N 3.27Å
457	V	97.2	Very high	97.4	Very high	23 Å²	23	30.1 Å²	30.1	14%	0.139	18%	0.175	C	C	.	.	H	α-helix	trans	-71.1	-23.1	-175.4	-57.4	0	0	0	0	112.9	L453 T454 P485 C488 L492 M496	L453-V457 WeakPolarHBondContact O-CG2 3.48Å; L453-V457 PolarHBondContact O-N 3.41Å; L453-V457 VanDerWaalsContact O-N 3.15Å; T454-V457 PolarHBondContact O-N 2.98Å; V457-P485 HydrophobicContact CG2-CB 4.09Å; V457-P485 HydrophobicContact CG2-CG 3.85Å; V457-C488 HydrophobicContact CG2-CB 4.35Å; V457-L492 HydrophobicContact CG1-CD2 3.69Å; V457-M496 HydrophobicContact CG1-CE 4.33Å; V457-M496 HydrophobicContact CG2-CE 3.99Å
458	T	96.6	Very high	97.1	Very high	29 Å²	29	33.7 Å²	33.7	18%	0.178	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	6.7	177.8	64.6	0	0	0	0	114.4	T454 E455 L456 R461 P485	T454-T458 VanDerWaalsContact O-CB 3.27Å; T454-T458 WeakPolarHBondContact O-CB 3.42Å; T454-T458 VanDerWaalsContact O-CG2 3.26Å; T454-T458 WeakPolarHBondContact O-CG2 3.18Å; T454-T458 PolarHBondContact O-N 3.27Å; T454-T458 PolarHBondContact O-OG1 3.07Å; E455-T458 PolarHBondContact O-N 3.4Å; L456-T458 VanDerWaalsContact C-N 3.26Å; L456-T458 PolarHBondContact O-N 3.05Å; T458-R461 WeakPolarHBondContact O-CG 3.17Å; T458-P485 HydrophobicContact CG2-CB 3.78Å; T458-P485 HydrophobicContact CG2-CG 4.01Å
459	K	96.3	Very high	96.7	Very high	55 Å²	55	37.4 Å²	37.4	24%	0.239	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	46	179.9	-50.5	-57.7	-169.2	169.6	0	113.3	L351 G356 L359 E455 L456	L351-K459 HydrophobicContact CD2-CD 4.43Å; G356-K459 PolarHBondContact O-NZ 2.92Å; L359-K459 PolarHBondContact O-NZ 2.91Å; E455-K459 PolarHBondContact O-N 2.93Å; L456-K459 PolarHBondContact O-N 3.27Å
460	G	95.6	Very high	96.2	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.01	24%	0.244	C	C	.	.	S	Bend	trans	76.5	18	176.2	0	0	0	0	0	114.3	K352 E455 V462	K352-G460 WeakPolarHBondContact CE-O 3.27Å; E455-G460 PolarHBondContact O-N 3.41Å; G460-V462 PolarHBondContact O-N 3.07Å
461	R	95.6	Very high	96.1	Very high	178 Å²	178	48.9 Å²	48.9	67%	0.672	26%	0.26	S	S	*	.	P	Polyproline II helix	trans	-60.1	143.9	173.6	-73.8	179	-172.1	179.7	1.3	109.9	T458	T458-R461 WeakPolarHBondContact O-CG 3.17Å
462	V	95.6	Very high	95.9	Very high	81 Å²	81	49 Å²	49	49%	0.491	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-63	130	177.3	-179.9	0	0	0	0	108.9	K428 G460	K428-V462 HydrophobicContact CD-CG1 4.11Å; G460-V462 PolarHBondContact O-N 3.07Å
463	P	97.6	Very high	95.6	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.019	27%	0.272	C	S	.	.	S	Bend	trans	-57.9	154	176.9	-25.5	34.3	0	0	0	112.4	K428 W429 I451 E455 M482	K428-P463 HydrophobicContact CB-CB 4.3Å; K428-P463 VanDerWaalsContact CD-O 3.32Å; K428-P463 WeakPolarHBondContact CD-O 3.48Å; K428-P463 PolarHBondContact NZ-O 3.28Å; W429-P463 HydrophobicContact CD2-CG 4.41Å; W429-P463 HydrophobicContact CH2-CG 4.06Å; W429-P463 VanDerWaalsContact CZ2-CD 3.43Å; W429-P463 HydrophobicContact CZ2-CG 3.58Å; I451-P463 HydrophobicContact CG2-CB 3.84Å; I451-P463 HydrophobicContact CG2-CG 3.42Å; I451-P463 VanDerWaalsContact CG2-CG 3.42Å; E455-P463 HydrophobicContact CG-CG 4.31Å; P463-M482 HydrophobicContact CB-CE 4.16Å; P463-M482 HydrophobicContact CB-SD 4.25Å
464	Y	97.4	Very high	95.3	Very high	1 Å²	1	54.4 Å²	54.4	0%	0.004	29%	0.288	C	S	.	.	S	Bend	trans	49.3	64.2	-179.1	-53.8	-85.8	0	0	0	112	K428 I451 G466 M467 V472 V476 Y480 M482	K428-Y464 HydrophobicContact CB-CD2 4.19Å; K428-Y464 HydrophobicContact CG-CD2 4.44Å; K428-Y464 PolarHBondContact NZ-O 3.45Å; K428-Y464 WeakPolarHBondContact O-CE2 3.39Å; I451-Y464 HydrophobicContact CD1-CE2 3.84Å; Y464-G466 PolarHBondContact O-N 3.26Å; Y464-M467 HydrophobicContact CD1-SD 4.35Å; Y464-M467 PolarHBondContact O-N 3.09Å; Y464-V472 VanDerWaalsContact CB-CG2 3.48Å; Y464-V472 HydrophobicContact CD1-CG1 4.27Å; Y464-V472 HydrophobicContact CD1-CG2 4.33Å; Y464-V472 HydrophobicContact CD2-CG1 3.7Å; Y464-V472 HydrophobicContact CD2-CG2 4.04Å; Y464-V472 HydrophobicContact CE1-CG1 4.4Å; Y464-V472 HydrophobicContact CE2-CG1 3.84Å; Y464-V472 HydrophobicContact CG-CB 4.49Å; Y464-V472 HydrophobicContact CG-CG1 3.95Å; Y464-V472 HydrophobicContact CG-CG2 3.71Å; Y464-V476 HydrophobicContact CE1-CG2 3.9Å; Y464-Y480 HydrophobicContact CD1-CD1 4.27Å; Y464-Y480 AromaticContact CD1-CE1 3.76Å; Y464-Y480 HydrophobicContact CD1-CE1 3.76Å; Y464-Y480 HydrophobicContact CE1-CD1 4.09Å; Y464-Y480 AromaticContact CE1-CE1 3.87Å; Y464-Y480 HydrophobicContact CE1-CE1 3.87Å; Y464-M482 HydrophobicContact CD1-CG 3.68Å; Y464-M482 HydrophobicContact CD1-SD 4.19Å; Y464-M482 HydrophobicContact CD2-CE 4.36Å; Y464-M482 HydrophobicContact CD2-SD 4.29Å; Y464-M482 HydrophobicContact CE1-CE 4.36Å; Y464-M482 HydrophobicContact CE1-CG 3.63Å; Y464-M482 HydrophobicContact CE1-SD 4.32Å; Y464-M482 HydrophobicContact CE2-CE 3.96Å; Y464-M482 HydrophobicContact CE2-SD 4.42Å; Y464-M482 HydrophobicContact CG-CG 4.25Å; Y464-M482 HydrophobicContact CG-SD 4.16Å; Y464-M482 PolarHBondContact N-SD 2.91Å
465	P	95.8	Very high	95.3	Very high	109 Å²	109	57.3 Å²	57.3	71%	0.708	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	135.1	-176.6	25.7	-34.5	0	0	0	110.5	M467	P465-M467 VanDerWaalsContact C-N 3.3Å; P465-M467 PolarHBondContact O-N 2.84Å
466	G	95.7	Very high	95.2	Very high	84 Å²	84	57.6 Å²	57.6	87%	0.866	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	-5.2	-178.8	0	0	0	0	0	115.7	Y464	Y464-G466 PolarHBondContact O-N 3.26Å
467	M	96.3	Very high	95	Very high	48 Å²	48	62.3 Å²	62.3	24%	0.236	33%	0.325	C	S	.	.			trans	-105.8	138	177	-59.3	178.5	-176.9	0	0	111.7	K428 Y464 P465 E471 V472 Y480	K428-M467 VanDerWaalsContact CE-O 3.27Å; K428-M467 WeakPolarHBondContact CE-O 3.41Å; K428-M467 PolarHBondContact NZ-O 3.12Å; Y464-M467 HydrophobicContact CD1-SD 4.35Å; Y464-M467 PolarHBondContact O-N 3.09Å; P465-M467 VanDerWaalsContact C-N 3.3Å; P465-M467 PolarHBondContact O-N 2.84Å; M467-E471 WeakPolarHBondContact CA-OE2 3.2Å; M467-E471 HydrophobicContact CB-CB 4.24Å; M467-V472 HydrophobicContact CB-CG2 3.62Å; M467-V472 HydrophobicContact SD-CG2 4.37Å; M467-Y480 HydrophobicContact CE-CE1 4.06Å; M467-Y480 HydrophobicContact CE-CE2 4.42Å; M467-Y480 HydrophobicContact SD-CE1 4.45Å
468	N	92.6	Very high	94.9	Very high	76 Å²	76	70.1 Å²	70.1	41%	0.406	35%	0.352	S	S	.	.			trans	-81.8	171.1	168.8	71.8	53.7	0	0	0	111.7	R470 E471 V472	N468-R470 VanDerWaalsContact C-N 3.32Å; N468-R470 PolarHBondContact O-N 3.33Å; N468-R470 WeakPolarHBondContact OD1-CB 3.27Å; N468-R470 PolarHBondContact OD1-N 2.83Å; N468-E471 VanDerWaalsContact CG-CD 3.5Å; N468-E471 VanDerWaalsContact CG-OE2 3.29Å; N468-E471 PolarHBondContact N-OE2 3.08Å; N468-E471 PolarHBondContact ND2-OE1 3.44Å; N468-E471 VanDerWaalsContact ND2-OE1 3.12Å; N468-E471 PolarHBondContact ND2-OE2 3.25Å; N468-E471 VanDerWaalsContact ND2-OE2 3.09Å; N468-E471 PolarHBondContact O-N 3.24Å; N468-E471 PolarHBondContact OD1-N 3.24Å; N468-V472 WeakPolarHBondContact O-CG2 3.5Å; N468-V472 PolarHBondContact O-N 2.9Å
469	N	89.6	Confident	94.9	Very high	84 Å²	84	71.1 Å²	71.1	45%	0.449	37%	0.368	S	S	.	.	H	α-helix	trans	-60	-37.4	-174.5	-71.8	-3.6	0	0	0	113.8	I427 L473	I427-N469 HydrophobicContact CB-CB 3.99Å; I427-N469 HydrophobicContact CG1-CB 4.13Å; I427-N469 HydrophobicContact CG2-CB 4.07Å; I427-N469 WeakPolarHBondContact CG2-O 3.32Å; N469-L473 PolarHBondContact O-N 3.32Å
470	R	89.9	Confident	95	Very high	169 Å²	169	72.1 Å²	72.1	64%	0.638	37%	0.37	S	S	*	.	H	α-helix	trans	-68.5	-46.5	179.3	-173.9	-176.2	70.5	176	1.6	110.6	N468 V472 L473 E474	N468-R470 VanDerWaalsContact C-N 3.32Å; N468-R470 PolarHBondContact O-N 3.33Å; N468-R470 WeakPolarHBondContact OD1-CB 3.27Å; N468-R470 PolarHBondContact OD1-N 2.83Å; R470-V472 VanDerWaalsContact C-N 3.33Å; R470-V472 PolarHBondContact O-N 2.86Å; R470-L473 PolarHBondContact O-N 2.88Å; R470-E474 WeakPolarHBondContact CG-OE1 3.43Å; R470-E474 IonicContact NE-OE1 3.07Å; R470-E474 WeakPolarHBondContact O-CG 3.46Å; R470-E474 PolarHBondContact O-N 3.13Å; R470-E474 VanDerWaalsContact O-N 3.09Å
471	E	94.9	Very high	95.1	Very high	71 Å²	71	74.2 Å²	74.2	33%	0.332	38%	0.378	S	S	.	.	H	α-helix	trans	-60.3	-42.3	177.9	-71	163.6	171.6	0	0	111.8	M467 N468 L473 E474 Q475	M467-E471 WeakPolarHBondContact CA-OE2 3.2Å; M467-E471 HydrophobicContact CB-CB 4.24Å; N468-E471 VanDerWaalsContact CG-CD 3.5Å; N468-E471 VanDerWaalsContact CG-OE2 3.29Å; N468-E471 PolarHBondContact N-OE2 3.08Å; N468-E471 PolarHBondContact ND2-OE1 3.44Å; N468-E471 VanDerWaalsContact ND2-OE1 3.12Å; N468-E471 PolarHBondContact ND2-OE2 3.25Å; N468-E471 VanDerWaalsContact ND2-OE2 3.09Å; N468-E471 PolarHBondContact O-N 3.24Å; N468-E471 PolarHBondContact OD1-N 3.24Å; E471-L473 VanDerWaalsContact C-N 3.34Å; E471-L473 PolarHBondContact O-N 3.33Å; E471-E474 PolarHBondContact O-N 3.11Å; E471-Q475 WeakPolarHBondContact O-CB 3.16Å; E471-Q475 WeakPolarHBondContact O-CG 3.34Å; E471-Q475 PolarHBondContact O-N 3.5Å
472	V	95.4	Very high	95.2	Very high	4 Å²	4	66.5 Å²	66.5	2%	0.024	35%	0.35	C	S	.	.	H	α-helix	trans	-58.5	-48.1	177	171	0	0	0	0	110.9	K428 Y464 M467 N468 R470 E474 Q475 V476	K428-V472 HydrophobicContact CG-CG2 4.26Å; Y464-V472 VanDerWaalsContact CB-CG2 3.48Å; Y464-V472 HydrophobicContact CD1-CG1 4.27Å; Y464-V472 HydrophobicContact CD1-CG2 4.33Å; Y464-V472 HydrophobicContact CD2-CG1 3.7Å; Y464-V472 HydrophobicContact CD2-CG2 4.04Å; Y464-V472 HydrophobicContact CE1-CG1 4.4Å; Y464-V472 HydrophobicContact CE2-CG1 3.84Å; Y464-V472 HydrophobicContact CG-CB 4.49Å; Y464-V472 HydrophobicContact CG-CG1 3.95Å; Y464-V472 HydrophobicContact CG-CG2 3.71Å; M467-V472 HydrophobicContact CB-CG2 3.62Å; M467-V472 HydrophobicContact SD-CG2 4.37Å; N468-V472 WeakPolarHBondContact O-CG2 3.5Å; N468-V472 PolarHBondContact O-N 2.9Å; R470-V472 VanDerWaalsContact C-N 3.33Å; R470-V472 PolarHBondContact O-N 2.86Å; V472-E474 PolarHBondContact O-N 2.9Å; V472-Q475 PolarHBondContact O-N 2.9Å; V472-V476 HydrophobicContact CG1-CG2 4.09Å; V472-V476 VanDerWaalsContact O-CB 3.25Å; V472-V476 WeakPolarHBondContact O-CB 3.32Å; V472-V476 WeakPolarHBondContact O-CG2 2.79Å; V472-V476 PolarHBondContact O-N 3.29Å
473	L	91.6	Very high	95.3	Very high	44 Å²	44	67 Å²	67	23%	0.23	35%	0.354	C	S	.	.	H	α-helix	trans	-60.6	-48.7	-179.1	-172.3	59.6	0	0	0	111.6	A435 L436 N469 R470 E471 Q475 E477	A435-L473 HydrophobicContact CB-CD1 3.77Å; L436-L473 HydrophobicContact CD2-CD1 4.03Å; L436-L473 HydrophobicContact CD2-CD2 3.78Å; L436-L473 HydrophobicContact CD2-CG 4Å; L436-L473 HydrophobicContact CG-CD1 4.05Å; N469-L473 PolarHBondContact O-N 3.32Å; R470-L473 PolarHBondContact O-N 2.88Å; E471-L473 VanDerWaalsContact C-N 3.34Å; E471-L473 PolarHBondContact O-N 3.33Å; L473-Q475 PolarHBondContact O-N 3.12Å; L473-E477 WeakPolarHBondContact O-CB 3.48Å; L473-E477 PolarHBondContact O-N 3.34Å
474	E	93.6	Very high	95.3	Very high	72 Å²	72	69.4 Å²	69.4	34%	0.336	37%	0.371	S	S	.	.	H	α-helix	trans	-61.4	-42.4	178.6	-70.5	174.1	-167.6	0	0	112.5	R470 E471 V472 R478	R470-E474 WeakPolarHBondContact CG-OE1 3.43Å; R470-E474 IonicContact NE-OE1 3.07Å; R470-E474 WeakPolarHBondContact O-CG 3.46Å; R470-E474 PolarHBondContact O-N 3.13Å; R470-E474 VanDerWaalsContact O-N 3.09Å; E471-E474 PolarHBondContact O-N 3.11Å; V472-E474 PolarHBondContact O-N 2.9Å; E474-R478 VanDerWaalsContact O-CG 3.31Å; E474-R478 WeakPolarHBondContact O-CG 3.31Å; E474-R478 PolarHBondContact O-N 3.46Å
475	Q	97.6	Very high	95.2	Very high	66 Å²	66	70.5 Å²	70.5	31%	0.308	38%	0.378	S	S	.	.	H	α-helix	trans	-72.6	-42.8	-178.3	-68	-66.7	-14.8	0	0	111.7	E471 V472 L473 E477 R478 G479 Y480	E471-Q475 WeakPolarHBondContact O-CB 3.16Å; E471-Q475 WeakPolarHBondContact O-CG 3.34Å; E471-Q475 PolarHBondContact O-N 3.5Å; V472-Q475 PolarHBondContact O-N 2.9Å; L473-Q475 PolarHBondContact O-N 3.12Å; Q475-E477 VanDerWaalsContact C-N 3.29Å; Q475-E477 PolarHBondContact O-N 3.16Å; Q475-R478 CarbonylContact O-C 3.5Å; Q475-R478 WeakPolarHBondContact O-CB 3.46Å; Q475-R478 PolarHBondContact O-N 3.37Å; Q475-R478 VanDerWaalsContact O-N 3.13Å; Q475-G479 PolarHBondContact O-N 3.5Å; Q475-Y480 HydrophobicContact CB-CD1 4.39Å; Q475-Y480 HydrophobicContact CB-CG 4.3Å; Q475-Y480 WeakPolarHBondContact O-CB 3.37Å; Q475-Y480 PolarHBondContact O-N 3.26Å
476	V	96.8	Very high	95	Very high	10 Å²	10	73 Å²	73	6%	0.061	38%	0.381	C	S	.	.	H	α-helix	trans	-61.2	-40.3	177.5	166.1	0	0	0	0	111	P432 W447 Y464 V472 R478 G479 R481	P432-V476 HydrophobicContact CB-CG1 4.3Å; P432-V476 HydrophobicContact CG-CG1 4.34Å; W447-V476 HydrophobicContact CH2-CG1 3.49Å; W447-V476 VanDerWaalsContact CH2-CG1 3.49Å; W447-V476 HydrophobicContact CZ2-CG1 3.53Å; Y464-V476 HydrophobicContact CE1-CG2 3.9Å; V472-V476 HydrophobicContact CG1-CG2 4.09Å; V472-V476 VanDerWaalsContact O-CB 3.25Å; V472-V476 WeakPolarHBondContact O-CB 3.32Å; V472-V476 WeakPolarHBondContact O-CG2 2.79Å; V472-V476 PolarHBondContact O-N 3.29Å; V476-R478 VanDerWaalsContact C-N 3.32Å; V476-R478 PolarHBondContact O-N 2.92Å; V476-G479 PolarHBondContact O-N 3.42Å; V476-R481 PolarHBondContact O-NH1 3.32Å
477	E	92.6	Very high	94.6	Very high	101 Å²	101	76 Å²	76	47%	0.472	38%	0.377	S	S	.	.	H	α-helix	trans	-62.8	-37.6	174.9	-173.3	176.9	-165	0	0	112.2	L473 Q475 G479	L473-E477 WeakPolarHBondContact O-CB 3.48Å; L473-E477 PolarHBondContact O-N 3.34Å; Q475-E477 VanDerWaalsContact C-N 3.29Å; Q475-E477 PolarHBondContact O-N 3.16Å; E477-G479 PolarHBondContact O-N 3.09Å
478	R	96.4	Very high	94.5	Very high	186 Å²	186	74.3 Å²	74.3	70%	0.702	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-1.7	173.1	-70.6	173.5	-177.9	170.7	4.3	114.3	E474 Q475 V476	E474-R478 VanDerWaalsContact O-CG 3.31Å; E474-R478 WeakPolarHBondContact O-CG 3.31Å; E474-R478 PolarHBondContact O-N 3.46Å; Q475-R478 CarbonylContact O-C 3.5Å; Q475-R478 WeakPolarHBondContact O-CB 3.46Å; Q475-R478 PolarHBondContact O-N 3.37Å; Q475-R478 VanDerWaalsContact O-N 3.13Å; V476-R478 VanDerWaalsContact C-N 3.32Å; V476-R478 PolarHBondContact O-N 2.92Å
479	G	96.1	Very high	94.6	Very high	50 Å²	50	72.4 Å²	72.4	52%	0.515	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.7	4.3	177.3	0	0	0	0	0	114.8	Q475 V476 E477 R481	Q475-G479 PolarHBondContact O-N 3.5Å; V476-G479 PolarHBondContact O-N 3.42Å; E477-G479 PolarHBondContact O-N 3.09Å; G479-R481 PolarHBondContact O-N 3.45Å
480	Y	98.3	Very high	94.8	Very high	76 Å²	76	74.2 Å²	74.2	30%	0.298	37%	0.37	S	S	.	.			trans	-61.9	138.8	173.3	175.8	-92.7	0	0	0	110.8	Y464 M467 Q475 M482	Y464-Y480 HydrophobicContact CD1-CD1 4.27Å; Y464-Y480 AromaticContact CD1-CE1 3.76Å; Y464-Y480 HydrophobicContact CD1-CE1 3.76Å; Y464-Y480 HydrophobicContact CE1-CD1 4.09Å; Y464-Y480 AromaticContact CE1-CE1 3.87Å; Y464-Y480 HydrophobicContact CE1-CE1 3.87Å; M467-Y480 HydrophobicContact CE-CE1 4.06Å; M467-Y480 HydrophobicContact CE-CE2 4.42Å; M467-Y480 HydrophobicContact SD-CE1 4.45Å; Q475-Y480 HydrophobicContact CB-CD1 4.39Å; Q475-Y480 HydrophobicContact CB-CG 4.3Å; Q475-Y480 WeakPolarHBondContact O-CB 3.37Å; Q475-Y480 PolarHBondContact O-N 3.26Å; Y480-M482 HydrophobicContact CE1-CG 4.46Å
481	R	98.3	Very high	95	Very high	45 Å²	45	68.5 Å²	68.5	17%	0.17	36%	0.355	C	S	.	.			trans	-133.3	151.4	169.9	-61.5	-62.3	179.7	-93	3	108.8	V476 G479 I497 W500	V476-R481 PolarHBondContact O-NH1 3.32Å; G479-R481 PolarHBondContact O-N 3.45Å; R481-I497 HydrophobicContact CB-CD1 3.97Å; R481-I497 HydrophobicContact CG-CD1 4.4Å; R481-W500 HydrophobicContact CB-CE3 4.2Å; R481-W500 HydrophobicContact CG-CE3 4.49Å; R481-W500 VanDerWaalsContact CZ-O 3.31Å; R481-W500 PolarHBondContact NE-O 3.27Å; R481-W500 PolarHBondContact NH2-O 2.86Å
482	M	98.2	Very high	95	Very high	17 Å²	17	65.3 Å²	65.3	8%	0.084	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-61.6	136.8	178.3	-72.4	-176.3	-77.4	0	0	110.7	I451 T454 P463 Y464 Y480 H493 W500	I451-M482 HydrophobicContact CD1-CE 3.55Å; T454-M482 HydrophobicContact CG2-CE 3.8Å; P463-M482 HydrophobicContact CB-CE 4.16Å; P463-M482 HydrophobicContact CB-SD 4.25Å; Y464-M482 HydrophobicContact CD1-CG 3.68Å; Y464-M482 HydrophobicContact CD1-SD 4.19Å; Y464-M482 HydrophobicContact CD2-CE 4.36Å; Y464-M482 HydrophobicContact CD2-SD 4.29Å; Y464-M482 HydrophobicContact CE1-CE 4.36Å; Y464-M482 HydrophobicContact CE1-CG 3.63Å; Y464-M482 HydrophobicContact CE1-SD 4.32Å; Y464-M482 HydrophobicContact CE2-CE 3.96Å; Y464-M482 HydrophobicContact CE2-SD 4.42Å; Y464-M482 HydrophobicContact CG-CG 4.25Å; Y464-M482 HydrophobicContact CG-SD 4.16Å; Y464-M482 PolarHBondContact N-SD 2.91Å; Y480-M482 HydrophobicContact CE1-CG 4.46Å; M482-H493 PolarHBondContact O-NE2 3.08Å; M482-H493 VanDerWaalsContact O-NE2 3.12Å; M482-W500 HydrophobicContact CB-CH2 4.35Å; M482-W500 HydrophobicContact CB-CZ3 4.41Å; M482-W500 HydrophobicContact CE-CH2 3.89Å; M482-W500 HydrophobicContact CE-CZ2 3.89Å
483	P	97.7	Very high	95.1	Very high	90 Å²	90	66.6 Å²	66.6	58%	0.584	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-65.7	162.3	174.8	29.8	-35.6	0	0	0	110.8	P485	P483-P485 WeakPolarHBondContact O-CD 3.18Å
484	C	97.8	Very high	95.4	Very high	54 Å²	54	69.4 Å²	69.4	37%	0.365	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-56.7	122.5	175.7	-172.8	0	0	0	0	110	C488 H493	C484-C488 PolarHBondContact SG-O 2.9Å; C484-H493 VanDerWaalsContact CA-CD2 3.49Å; C484-H493 WeakPolarHBondContact CA-CD2 3.37Å; C484-H493 HydrophobicContact CB-CB 4.13Å; C484-H493 PolarHBondContact N-NE2 2.7Å
485	P	95.2	Very high	95.6	Very high	25 Å²	25	66.2 Å²	66.2	16%	0.162	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-61.7	154.1	176.1	-23.5	34.7	0	0	0	112.1	V457 T458 P483 D487 C488	V457-P485 HydrophobicContact CG2-CB 4.09Å; V457-P485 HydrophobicContact CG2-CG 3.85Å; T458-P485 HydrophobicContact CG2-CB 3.78Å; T458-P485 HydrophobicContact CG2-CG 4.01Å; P483-P485 WeakPolarHBondContact O-CD 3.18Å; P485-D487 PolarHBondContact O-N 2.87Å; P485-C488 HydrophobicContact CB-CB 4Å; P485-C488 HydrophobicContact CG-CB 4.3Å; P485-C488 VanDerWaalsContact O-CB 3.22Å; P485-C488 WeakPolarHBondContact O-CB 3.33Å; P485-C488 PolarHBondContact O-N 3.12Å
486	Q	91.1	Very high	95.7	Very high	162 Å²	162	63.1 Å²	63.1	76%	0.757	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	138.8	172.9	-171.3	179.5	-10.4	0	0	110.4	C488	Q486-C488 PolarHBondContact O-N 2.75Å; Q486-C488 VanDerWaalsContact O-N 3.08Å
487	D	87.2	Confident	95.8	Very high	146 Å²	146	65.5 Å²	65.5	78%	0.781	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	9.7	-179	-49.4	-43.7	0	0	0	115.1	P485	P485-D487 PolarHBondContact O-N 2.87Å
488	C	94.6	Very high	96.1	Very high	12 Å²	12	65 Å²	65	8%	0.081	34%	0.338	C	S	.	.			trans	-82.9	126.7	170.6	-177	0	0	0	0	109.6	V457 C484 P485 Q486	V457-C488 HydrophobicContact CG2-CB 4.35Å; C484-C488 PolarHBondContact SG-O 2.9Å; P485-C488 HydrophobicContact CB-CB 4Å; P485-C488 HydrophobicContact CG-CB 4.3Å; P485-C488 VanDerWaalsContact O-CB 3.22Å; P485-C488 WeakPolarHBondContact O-CB 3.33Å; P485-C488 PolarHBondContact O-N 3.12Å; Q486-C488 PolarHBondContact O-N 2.75Å; Q486-C488 VanDerWaalsContact O-N 3.08Å
489	P	93.8	Very high	96.2	Very high	36 Å²	36	56.1 Å²	56.1	23%	0.234	31%	0.305	C	S	.	.			trans	-61.8	144.8	172.4	-18	28.6	0	0	0	111.5	L361 S491 L492 H493 Y520	L361-P489 HydrophobicContact CD1-CG 4.33Å; L361-P489 HydrophobicContact CD2-CG 3.35Å; L361-P489 HydrophobicContact CG-CG 4.46Å; P489-S491 VanDerWaalsContact C-N 3.31Å; P489-S491 PolarHBondContact O-N 2.85Å; P489-L492 PolarHBondContact O-N 2.9Å; P489-H493 PolarHBondContact O-N 3.36Å; P489-H493 VanDerWaalsContact O-N 3.13Å; P489-Y520 WeakPolarHBondContact CB-OH 3.44Å; P489-Y520 WeakPolarHBondContact CG-OH 3.37Å
490	I	94.5	Very high	96.3	Very high	122 Å²	122	53.9 Å²	53.9	63%	0.626	28%	0.281	S	S	*	.	H	α-helix	trans	-59.2	-42.8	-178.5	-62.8	172	0	0	0	111.1	L492 H493 E494	I490-L492 VanDerWaalsContact C-N 3.29Å; I490-L492 PolarHBondContact O-N 2.8Å; I490-H493 CarbonylContact O-C 3.42Å; I490-H493 PolarHBondContact O-N 2.91Å; I490-H493 VanDerWaalsContact O-N 3.07Å; I490-E494 HydrophobicContact CG2-CG 4.19Å; I490-E494 WeakPolarHBondContact O-CG 3.38Å; I490-E494 PolarHBondContact O-N 3.4Å
491	S	93.4	Very high	96.3	Very high	49 Å²	49	54 Å²	54	34%	0.343	28%	0.283	S	S	.	.	H	α-helix	trans	-59.8	-36.3	179.2	49.8	0	0	0	0	113.3	P489 L495 Y520	P489-S491 VanDerWaalsContact C-N 3.31Å; P489-S491 PolarHBondContact O-N 2.85Å; S491-L495 PolarHBondContact O-N 2.7Å; S491-L495 VanDerWaalsContact O-N 3.11Å; S491-Y520 PolarHBondContact OG-OH 3.43Å
492	L	95.2	Very high	96.2	Very high	4 Å²	4	59.4 Å²	59.4	2%	0.021	31%	0.308	C	S	.	.	H	α-helix	trans	-73.8	-35.4	175.9	-171.3	61.9	0	0	0	111.6	L361 V365 L453 V457 P489 I490 L495 M496 L517 Y520	L361-L492 HydrophobicContact CD1-CD2 4.22Å; V365-L492 HydrophobicContact CG2-CD2 4.33Å; L453-L492 HydrophobicContact CD1-CD1 4.45Å; V457-L492 HydrophobicContact CG1-CD2 3.69Å; P489-L492 PolarHBondContact O-N 2.9Å; I490-L492 VanDerWaalsContact C-N 3.29Å; I490-L492 PolarHBondContact O-N 2.8Å; L492-L495 HydrophobicContact CD1-CD2 4.2Å; L492-L495 WeakPolarHBondContact O-CB 3.46Å; L492-L495 PolarHBondContact O-N 2.87Å; L492-M496 HydrophobicContact CG-CE 4.15Å; L492-M496 WeakPolarHBondContact O-CG 3.49Å; L492-M496 PolarHBondContact O-N 2.94Å; L492-L517 HydrophobicContact CD1-CD2 3.87Å; L492-Y520 HydrophobicContact CB-CE2 4.22Å
493	H	98.2	Very high	96.2	Very high	31 Å²	31	62.4 Å²	62.4	14%	0.144	32%	0.324	C	S	.	.	H	α-helix	trans	-68	-39.6	172.6	-179.9	-112.4	0	0	0	112.1	M482 C484 P489 I490 L495 M496 I497	M482-H493 PolarHBondContact O-NE2 3.08Å; M482-H493 VanDerWaalsContact O-NE2 3.12Å; C484-H493 VanDerWaalsContact CA-CD2 3.49Å; C484-H493 WeakPolarHBondContact CA-CD2 3.37Å; C484-H493 HydrophobicContact CB-CB 4.13Å; C484-H493 PolarHBondContact N-NE2 2.7Å; P489-H493 PolarHBondContact O-N 3.36Å; P489-H493 VanDerWaalsContact O-N 3.13Å; I490-H493 CarbonylContact O-C 3.42Å; I490-H493 PolarHBondContact O-N 2.91Å; I490-H493 VanDerWaalsContact O-N 3.07Å; H493-L495 VanDerWaalsContact C-N 3.27Å; H493-L495 PolarHBondContact O-N 3.44Å; H493-M496 WeakPolarHBondContact O-CA 3.39Å; H493-M496 VanDerWaalsContact O-CB 3.31Å; H493-M496 WeakPolarHBondContact O-CB 3.3Å; H493-M496 PolarHBondContact O-N 3.02Å; H493-I497 WeakPolarHBondContact O-CG1 3.26Å; H493-I497 PolarHBondContact O-N 2.82Å
494	E	97.9	Very high	96.2	Very high	104 Å²	104	59.5 Å²	59.5	49%	0.486	31%	0.305	S	S	.	.	H	α-helix	trans	-57.4	-42.8	172	-75	175.2	171.4	0	0	110.7	I490 M496 I497 H498	I490-E494 HydrophobicContact CG2-CG 4.19Å; I490-E494 WeakPolarHBondContact O-CG 3.38Å; I490-E494 PolarHBondContact O-N 3.4Å; E494-M496 VanDerWaalsContact C-N 3.31Å; E494-M496 PolarHBondContact O-N 2.86Å; E494-I497 WeakPolarHBondContact O-CB 3.38Å; E494-I497 PolarHBondContact O-N 2.88Å; E494-I497 VanDerWaalsContact O-N 3.13Å; E494-H498 PolarHBondContact O-N 3.03Å; E494-H498 PolarHBondContact O-ND1 3.2Å
495	L	97.9	Very high	96.2	Very high	5 Å²	5	63.7 Å²	63.7	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-56.8	-44	173.1	-164.5	73.5	0	0	0	111.9	L453 S491 L492 H493 I497 H498 C499 Y512 L513 F516 L517	L453-L495 HydrophobicContact CD1-CD2 4.01Å; S491-L495 PolarHBondContact O-N 2.7Å; S491-L495 VanDerWaalsContact O-N 3.11Å; L492-L495 HydrophobicContact CD1-CD2 4.2Å; L492-L495 WeakPolarHBondContact O-CB 3.46Å; L492-L495 PolarHBondContact O-N 2.87Å; H493-L495 VanDerWaalsContact C-N 3.27Å; H493-L495 PolarHBondContact O-N 3.44Å; L495-I497 VanDerWaalsContact C-N 3.35Å; L495-I497 PolarHBondContact O-N 2.89Å; L495-H498 PolarHBondContact O-N 2.6Å; L495-C499 PolarHBondContact O-N 2.88Å; L495-C499 PolarHBondContact O-SG 2.89Å; L495-C499 VanDerWaalsContact O-SG 3.39Å; L495-Y512 HydrophobicContact CD1-CE1 4.08Å; L495-L513 HydrophobicContact CD1-CD2 3.73Å; L495-L513 HydrophobicContact CD2-CD2 3.99Å; L495-L513 HydrophobicContact CG-CD2 3.82Å; L495-F516 HydrophobicContact CB-CE1 4.24Å; L495-F516 HydrophobicContact CD1-CD1 3.76Å; L495-F516 HydrophobicContact CD1-CD2 4.36Å; L495-F516 HydrophobicContact CD1-CE1 3.98Å; L495-F516 HydrophobicContact CD1-CG 3.97Å; L495-F516 HydrophobicContact CD1-CZ 4.37Å; L495-F516 HydrophobicContact CD2-CD1 3.58Å; L495-F516 HydrophobicContact CD2-CE1 3.75Å; L495-F516 HydrophobicContact CD2-CG 4.5Å; L495-F516 HydrophobicContact CG-CD1 4.21Å; L495-F516 HydrophobicContact CG-CE1 4.22Å; L495-L517 HydrophobicContact CD2-CD2 3.98Å; L495-L517 HydrophobicContact CD2-CG 4.19Å
496	M	98.6	Very high	96.4	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-60.9	-42.7	175	-59.6	165	-170.7	0	0	111.8	L453 T454 V457 L492 H493 E494 H498 C499 W500	L453-M496 HydrophobicContact CB-CE 3.66Å; L453-M496 HydrophobicContact CB-CG 3.91Å; L453-M496 HydrophobicContact CB-SD 4.46Å; L453-M496 HydrophobicContact CD1-CG 3.99Å; T454-M496 HydrophobicContact CG2-CE 4.36Å; T454-M496 HydrophobicContact CG2-SD 3.66Å; V457-M496 HydrophobicContact CG1-CE 4.33Å; V457-M496 HydrophobicContact CG2-CE 3.99Å; L492-M496 HydrophobicContact CG-CE 4.15Å; L492-M496 WeakPolarHBondContact O-CG 3.49Å; L492-M496 PolarHBondContact O-N 2.94Å; H493-M496 WeakPolarHBondContact O-CA 3.39Å; H493-M496 VanDerWaalsContact O-CB 3.31Å; H493-M496 WeakPolarHBondContact O-CB 3.3Å; H493-M496 PolarHBondContact O-N 3.02Å; E494-M496 VanDerWaalsContact C-N 3.31Å; E494-M496 PolarHBondContact O-N 2.86Å; M496-H498 VanDerWaalsContact C-N 3.31Å; M496-H498 PolarHBondContact O-N 3.45Å; M496-C499 WeakPolarHBondContact O-CB 3.5Å; M496-C499 PolarHBondContact O-N 3.05Å; M496-C499 VanDerWaalsContact O-N 3.15Å; M496-W500 HydrophobicContact CB-CE3 4.24Å; M496-W500 HydrophobicContact CB-CH2 3.66Å; M496-W500 HydrophobicContact CB-CZ2 3.97Å; M496-W500 HydrophobicContact CB-CZ3 3.81Å; M496-W500 HydrophobicContact CG-CH2 4.32Å; M496-W500 VanDerWaalsContact O-CG 3.31Å; M496-W500 PolarHBondContact O-N 2.93Å; M496-W500 HydrophobicContact SD-CH2 4.23Å
497	I	98.6	Very high	96.7	Very high	61 Å²	61	60.6 Å²	60.6	31%	0.313	30%	0.303	S	S	.	.	H	α-helix	trans	-61.8	-38.6	176.9	-65	-64.6	0	0	0	111.4	R481 H493 E494 L495 W500 K501	R481-I497 HydrophobicContact CB-CD1 3.97Å; R481-I497 HydrophobicContact CG-CD1 4.4Å; H493-I497 WeakPolarHBondContact O-CG1 3.26Å; H493-I497 PolarHBondContact O-N 2.82Å; E494-I497 WeakPolarHBondContact O-CB 3.38Å; E494-I497 PolarHBondContact O-N 2.88Å; E494-I497 VanDerWaalsContact O-N 3.13Å; L495-I497 VanDerWaalsContact C-N 3.35Å; L495-I497 PolarHBondContact O-N 2.89Å; I497-W500 HydrophobicContact CD1-CE3 4.07Å; I497-W500 HydrophobicContact CD1-CZ3 4.25Å; I497-W500 CarbonylContact O-C 3.51Å; I497-W500 PolarHBondContact O-N 2.88Å; I497-W500 VanDerWaalsContact O-N 3.17Å; I497-K501 PolarHBondContact O-N 3.05Å
498	H	98.4	Very high	97.3	Very high	90 Å²	90	54.6 Å²	54.6	42%	0.417	27%	0.272	S	S	.	.	H	α-helix	trans	-64.4	-40	173.6	-72.1	84.9	0	0	0	111.9	E494 L495 M496 W500 K501	E494-H498 PolarHBondContact O-N 3.03Å; E494-H498 PolarHBondContact O-ND1 3.2Å; L495-H498 PolarHBondContact O-N 2.6Å; M496-H498 VanDerWaalsContact C-N 3.31Å; M496-H498 PolarHBondContact O-N 3.45Å; H498-W500 PolarHBondContact O-N 3.01Å; H498-K501 VanDerWaalsContact O-CG 3.31Å; H498-K501 WeakPolarHBondContact O-CG 3.41Å; H498-K501 PolarHBondContact O-N 3.38Å
499	C	98.8	Very high	97.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.7	-28.5	172.9	-66.7	0	0	0	0	113	V446 W447 L495 M496 R507	V446-C499 HydrophobicContact CG1-CB 4.09Å; V446-C499 WeakPolarHBondContact O-CB 3.46Å; W447-C499 WeakPolarHBondContact CA-O 3.3Å; L495-C499 PolarHBondContact O-N 2.88Å; L495-C499 PolarHBondContact O-SG 2.89Å; L495-C499 VanDerWaalsContact O-SG 3.39Å; M496-C499 WeakPolarHBondContact O-CB 3.5Å; M496-C499 PolarHBondContact O-N 3.05Å; M496-C499 VanDerWaalsContact O-N 3.15Å; C499-R507 VanDerWaalsContact O-CD 3.31Å; C499-R507 WeakPolarHBondContact O-CD 3.34Å
500	W	98.7	Very high	97.7	Very high	3 Å²	3	54.8 Å²	54.8	1%	0.011	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	22.7	-178.3	-52.9	-37.7	0	0	0	114.7	W447 G450 I451 T454 R481 M482 M496 I497 H498 K502	W447-W500 HydrophobicContact CD2-CB 4.48Å; W447-W500 AromaticContact CD2-CD1 3.71Å; W447-W500 HydrophobicContact CD2-CG 4.43Å; W447-W500 AromaticContact CE2-CD1 3.82Å; W447-W500 HydrophobicContact CE3-CB 4.05Å; W447-W500 HydrophobicContact CE3-CG 4.46Å; W447-W500 AromaticContact CG-CD1 3.97Å; W447-W500 HydrophobicContact CH2-CB 4Å; W447-W500 HydrophobicContact CH2-CG 4.5Å; W447-W500 HydrophobicContact CZ2-CB 4.45Å; W447-W500 HydrophobicContact CZ2-CG 4.48Å; W447-W500 HydrophobicContact CZ3-CB 3.81Å; W447-W500 VanDerWaalsContact CZ3-O 3.31Å; W447-W500 WeakPolarHBondContact CZ3-O 3.41Å; W447-W500 PolarHBondContact O-NE1 3.03Å; G450-W500 VanDerWaalsContact C-CZ2 3.49Å; G450-W500 VanDerWaalsContact O-CZ2 3.27Å; G450-W500 WeakPolarHBondContact O-CZ2 3.33Å; I451-W500 HydrophobicContact CD1-CZ2 3.69Å; I451-W500 HydrophobicContact CG1-CZ2 4.45Å; T454-W500 HydrophobicContact CG2-CH2 3.44Å; T454-W500 VanDerWaalsContact CG2-CH2 3.44Å; T454-W500 HydrophobicContact CG2-CZ2 3.62Å; R481-W500 HydrophobicContact CB-CE3 4.2Å; R481-W500 HydrophobicContact CG-CE3 4.49Å; R481-W500 VanDerWaalsContact CZ-O 3.31Å; R481-W500 PolarHBondContact NE-O 3.27Å; R481-W500 PolarHBondContact NH2-O 2.86Å; M482-W500 HydrophobicContact CB-CH2 4.35Å; M482-W500 HydrophobicContact CB-CZ3 4.41Å; M482-W500 HydrophobicContact CE-CH2 3.89Å; M482-W500 HydrophobicContact CE-CZ2 3.89Å; M496-W500 HydrophobicContact CB-CE3 4.24Å; M496-W500 HydrophobicContact CB-CH2 3.66Å; M496-W500 HydrophobicContact CB-CZ2 3.97Å; M496-W500 HydrophobicContact CB-CZ3 3.81Å; M496-W500 HydrophobicContact CG-CH2 4.32Å; M496-W500 VanDerWaalsContact O-CG 3.31Å; M496-W500 PolarHBondContact O-N 2.93Å; M496-W500 HydrophobicContact SD-CH2 4.23Å; I497-W500 HydrophobicContact CD1-CE3 4.07Å; I497-W500 HydrophobicContact CD1-CZ3 4.25Å; I497-W500 CarbonylContact O-C 3.51Å; I497-W500 PolarHBondContact O-N 2.88Å; I497-W500 VanDerWaalsContact O-N 3.17Å; H498-W500 PolarHBondContact O-N 3.01Å; W500-K502 PolarHBondContact O-N 3.28Å
501	K	98.6	Very high	97.8	Very high	77 Å²	77	55.5 Å²	55.5	34%	0.335	27%	0.273	S	S	.	.			trans	-56.2	140.1	169.4	-72.1	-70.5	-167.9	156.9	0	110.6	I497 H498 E506 R507	I497-K501 PolarHBondContact O-N 3.05Å; H498-K501 VanDerWaalsContact O-CG 3.31Å; H498-K501 WeakPolarHBondContact O-CG 3.41Å; H498-K501 PolarHBondContact O-N 3.38Å; K501-E506 HydrophobicContact CB-CB 3.9Å; K501-E506 HydrophobicContact CG-CB 4.07Å; K501-E506 IonicContact NZ-OE2 3.57Å; K501-R507 HydrophobicContact CB-CG 3.99Å; K501-R507 PolarHBondContact O-NE 3.09Å; K501-R507 PolarHBondContact O-NH2 2.99Å
502	K	96.8	Very high	97.9	Very high	160 Å²	160	59.3 Å²	59.3	70%	0.696	28%	0.28	S	S	*	.	S	Bend	trans	-63.7	-48.5	-176.8	-178.4	178.4	178.2	176.7	0	110.2	W500 P504	W500-K502 PolarHBondContact O-N 3.28Å; K502-P504 WeakPolarHBondContact O-CD 3.48Å
503	D	97.6	Very high	98	Very high	79 Å²	79	59.1 Å²	59.1	42%	0.422	28%	0.279	S	S	.	.	S	Bend	trans	-72.6	121.7	171.8	-170.4	-15.3	0	0	0	109.6	E505 E506	D503-E505 PolarHBondContact O-N 3.23Å; D503-E505 PolarHBondContact OD1-N 3.27Å; D503-E506 HydrophobicContact CB-CB 4.36Å; D503-E506 HydrophobicContact CB-CG 3.98Å; D503-E506 PolarHBondContact O-N 2.66Å
504	P	97.9	Very high	97.9	Very high	30 Å²	30	59.7 Å²	59.7	20%	0.195	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-55.8	-33.5	175.6	-25.1	35.3	0	0	0	114	E433 K443 K502 E506 R507	E433-P504 HydrophobicContact CG-CG 4.07Å; K443-P504 HydrophobicContact CB-CB 3.76Å; K443-P504 WeakPolarHBondContact CD-O 3.21Å; K443-P504 HydrophobicContact CG-CB 4.31Å; K443-P504 WeakPolarHBondContact CG-O 3.39Å; K502-P504 WeakPolarHBondContact O-CD 3.48Å; P504-E506 VanDerWaalsContact C-N 3.31Å; P504-E506 PolarHBondContact O-N 2.77Å; P504-R507 WeakPolarHBondContact O-CB 3.4Å; P504-R507 WeakPolarHBondContact O-CG 3.27Å; P504-R507 PolarHBondContact O-N 3.45Å
505	E	97.6	Very high	97.5	Very high	142 Å²	142	56.2 Å²	56.2	66%	0.664	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-75	-21.4	-175.6	-62.8	-52.9	119	0	0	112.9	D503 R507	D503-E505 PolarHBondContact O-N 3.23Å; D503-E505 PolarHBondContact OD1-N 3.27Å; E505-R507 VanDerWaalsContact C-N 3.26Å; E505-R507 PolarHBondContact O-N 3.4Å
506	E	98.3	Very high	97.2	Very high	117 Å²	117	58.8 Å²	58.8	55%	0.547	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-78.3	-9.1	172.9	-68.8	-170.1	155.3	0	0	113.3	K501 D503 P504	K501-E506 HydrophobicContact CB-CB 3.9Å; K501-E506 HydrophobicContact CG-CB 4.07Å; K501-E506 IonicContact NZ-OE2 3.57Å; D503-E506 HydrophobicContact CB-CB 4.36Å; D503-E506 HydrophobicContact CB-CG 3.98Å; D503-E506 PolarHBondContact O-N 2.66Å; P504-E506 VanDerWaalsContact C-N 3.31Å; P504-E506 PolarHBondContact O-N 2.77Å
507	R	98.7	Very high	97	Very high	4 Å²	4	59 Å²	59	2%	0.015	29%	0.286	C	S	.	.	S	Bend	trans	-77.3	144.6	179.1	-57.4	173.9	-167.3	155.4	9.3	109.6	E433 K443 V446 C499 K501 P504 E505	E433-R507 IonicContact OE1-CZ 3.11Å; E433-R507 IonicContact OE1-NH1 2.78Å; E433-R507 PolarHBondContact OE1-NH1 2.83Å; E433-R507 IonicContact OE1-NH2 3.05Å; E433-R507 PolarHBondContact OE1-NH2 3.17Å; E433-R507 IonicContact OE2-CZ 3.87Å; E433-R507 IonicContact OE2-NH1 3.67Å; E433-R507 IonicContact OE2-NH2 3.77Å; E433-R507 PolarHBondContact OE2-NH2 3.18Å; K443-R507 HydrophobicContact CD-CB 4.32Å; K443-R507 PolarHBondContact NZ-O 2.83Å; K443-R507 WeakPolarHBondContact O-CD 3.44Å; K443-R507 PolarHBondContact O-NH1 3.25Å; V446-R507 HydrophobicContact CB-CB 4.46Å; V446-R507 HydrophobicContact CG1-CB 3.86Å; C499-R507 VanDerWaalsContact O-CD 3.31Å; C499-R507 WeakPolarHBondContact O-CD 3.34Å; K501-R507 HydrophobicContact CB-CG 3.99Å; K501-R507 PolarHBondContact O-NE 3.09Å; K501-R507 PolarHBondContact O-NH2 2.99Å; P504-R507 WeakPolarHBondContact O-CB 3.4Å; P504-R507 WeakPolarHBondContact O-CG 3.27Å; P504-R507 PolarHBondContact O-N 3.45Å; E505-R507 VanDerWaalsContact C-N 3.26Å; E505-R507 PolarHBondContact O-N 3.4Å
508	P	98.4	Very high	96.4	Very high	20 Å²	20	59 Å²	59	13%	0.13	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-63.2	166.8	179.9	27	-34.8	0	0	0	112.4	K443 V446 Y512 L513	K443-P508 PolarHBondContact NZ-O 3.02Å; V446-P508 HydrophobicContact CG1-CG 4.13Å; V446-P508 WeakPolarHBondContact CG2-O 3.47Å; 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 4.33Å; P508-L513 HydrophobicContact CB-CG 4.28Å; P508-L513 HydrophobicContact CG-CD1 4.29Å; P508-L513 HydrophobicContact CG-CD2 3.74Å; P508-L513 HydrophobicContact CG-CG 3.99Å
509	T	98.6	Very high	95.8	Very high	52 Å²	52	57.8 Å²	57.8	32%	0.319	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-82.5	160.6	167.5	58.6	0	0	0	0	110.4	E511 Y512 L513	T509-E511 VanDerWaalsContact C-N 3.27Å; T509-E511 PolarHBondContact O-N 2.99Å; T509-Y512 PolarHBondContact O-N 3.15Å; T509-Y512 PolarHBondContact OG1-N 2.76Å; T509-L513 WeakPolarHBondContact O-CG 3.49Å; T509-L513 PolarHBondContact O-N 3.07Å
510	F	98.6	Very high	95.2	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-69	-29.3	173.8	-82.9	-72	0	0	0	112.2	M375 A376 E379 L388 I442 D445 V446 F449 Y512 L513 Q514	M375-F510 HydrophobicContact CB-CB 4.2Å; M375-F510 HydrophobicContact CB-CD1 3.29Å; M375-F510 HydrophobicContact CB-CD2 3.77Å; M375-F510 HydrophobicContact CB-CE1 3.37Å; M375-F510 HydrophobicContact CB-CE2 3.84Å; M375-F510 HydrophobicContact CB-CG 3.48Å; M375-F510 VanDerWaalsContact CB-CG 3.48Å; M375-F510 HydrophobicContact CB-CZ 3.65Å; M375-F510 HydrophobicContact CE-CD2 4.29Å; M375-F510 HydrophobicContact CE-CE2 3.56Å; M375-F510 HydrophobicContact CE-CZ 3.7Å; M375-F510 HydrophobicContact CG-CD1 4.14Å; M375-F510 HydrophobicContact CG-CE1 3.7Å; M375-F510 HydrophobicContact CG-CE2 4.33Å; M375-F510 HydrophobicContact CG-CZ 3.8Å; A376-F510 HydrophobicContact CB-CB 3.91Å; E379-F510 PolarHBondContact OE2-N 3.28Å; L388-F510 HydrophobicContact CD2-CZ 4.2Å; I442-F510 HydrophobicContact CD1-CD2 3.76Å; I442-F510 HydrophobicContact CD1-CE2 3.69Å; I442-F510 HydrophobicContact CG1-CD2 3.92Å; I442-F510 HydrophobicContact CG1-CE2 4.05Å; D445-F510 HydrophobicContact CB-CE2 3.96Å; D445-F510 HydrophobicContact CB-CZ 4.1Å; V446-F510 HydrophobicContact CB-CE2 4.49Å; V446-F510 HydrophobicContact CG2-CD2 3.87Å; V446-F510 HydrophobicContact CG2-CE2 3.56Å; V446-F510 HydrophobicContact CG2-CG 4.5Å; V446-F510 HydrophobicContact CG2-CZ 3.96Å; F449-F510 HydrophobicContact CB-CE1 3.7Å; F449-F510 HydrophobicContact CB-CZ 3.99Å; F449-F510 HydrophobicContact CD1-CE1 4.31Å; F449-F510 AromaticContact CD2-CE1 3.98Å; F449-F510 HydrophobicContact CD2-CE1 3.98Å; F449-F510 AromaticContact CG-CE1 3.74Å; F449-F510 HydrophobicContact CG-CE1 3.74Å; F510-Y512 VanDerWaalsContact C-N 3.34Å; F510-Y512 PolarHBondContact O-N 2.78Å; F510-L513 HydrophobicContact CD1-CD1 3.8Å; F510-L513 HydrophobicContact CE1-CD1 4.05Å; F510-L513 HydrophobicContact CG-CD1 4.45Å; F510-L513 PolarHBondContact O-N 3.13Å; F510-Q514 VanDerWaalsContact O-CB 3.32Å; F510-Q514 WeakPolarHBondContact O-CB 3.41Å; F510-Q514 PolarHBondContact O-N 3.3Å
511	E	96.4	Very high	94.2	Very high	138 Å²	138	64.8 Å²	64.8	65%	0.645	31%	0.311	S	S	*	.	H	α-helix	trans	-57.3	-45.8	169.9	-176.5	174.6	-150.7	0	0	112	E379 T509 Q514 G515	E379-E511 PolarHBondContact OE2-N 3.43Å; T509-E511 VanDerWaalsContact C-N 3.27Å; T509-E511 PolarHBondContact O-N 2.99Å; E511-Q514 PolarHBondContact O-N 3.29Å; E511-G515 PolarHBondContact O-N 3.01Å; E511-G515 VanDerWaalsContact O-N 3.08Å
512	Y	96.6	Very high	92.8	Very high	128 Å²	128	62.7 Å²	62.7	50%	0.502	31%	0.305	S	S	.	.	H	α-helix	trans	-64.3	-45.8	175.2	174	-90.7	0	0	0	111.8	L495 P508 T509 F510 Q514 G515 F516	L495-Y512 HydrophobicContact CD1-CE1 4.08Å; 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 3.15Å; T509-Y512 PolarHBondContact OG1-N 2.76Å; F510-Y512 VanDerWaalsContact C-N 3.34Å; F510-Y512 PolarHBondContact O-N 2.78Å; Y512-Q514 VanDerWaalsContact C-N 3.31Å; Y512-Q514 PolarHBondContact O-N 3.28Å; Y512-G515 PolarHBondContact O-N 3.25Å; Y512-F516 HydrophobicContact CE1-CB 4.38Å; Y512-F516 WeakPolarHBondContact O-CB 3.5Å; Y512-F516 PolarHBondContact O-N 2.92Å
513	L	97.9	Very high	91	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.5	-42	179.5	-69	171.2	0	0	0	111.7	A372 V446 F449 L495 P508 T509 F510 L517	A372-L513 HydrophobicContact CB-CB 4.4Å; V446-L513 HydrophobicContact CG1-CD1 4.14Å; F449-L513 HydrophobicContact CD1-CD1 3.72Å; F449-L513 HydrophobicContact CE1-CB 4.31Å; F449-L513 HydrophobicContact CE1-CD1 4.04Å; F449-L513 HydrophobicContact CE1-CD2 4.38Å; F449-L513 HydrophobicContact CE1-CG 4.49Å; L495-L513 HydrophobicContact CD1-CD2 3.73Å; L495-L513 HydrophobicContact CD2-CD2 3.99Å; L495-L513 HydrophobicContact CG-CD2 3.82Å; P508-L513 HydrophobicContact CB-CD2 4.33Å; P508-L513 HydrophobicContact CB-CG 4.28Å; P508-L513 HydrophobicContact CG-CD1 4.29Å; P508-L513 HydrophobicContact CG-CD2 3.74Å; P508-L513 HydrophobicContact CG-CG 3.99Å; T509-L513 WeakPolarHBondContact O-CG 3.49Å; T509-L513 PolarHBondContact O-N 3.07Å; F510-L513 HydrophobicContact CD1-CD1 3.8Å; F510-L513 HydrophobicContact CE1-CD1 4.05Å; F510-L513 HydrophobicContact CG-CD1 4.45Å; F510-L513 PolarHBondContact O-N 3.13Å; L513-L517 WeakPolarHBondContact O-CB 3.35Å; L513-L517 WeakPolarHBondContact O-CD1 3.29Å; L513-L517 VanDerWaalsContact O-CG 3.24Å; L513-L517 WeakPolarHBondContact O-CG 3.43Å; L513-L517 PolarHBondContact O-N 2.9Å; L513-L517 VanDerWaalsContact O-N 3.07Å
514	Q	95.9	Very high	88.5	Confident	44 Å²	44	62 Å²	62	21%	0.206	33%	0.327	C	S	.	.	H	α-helix	trans	-58.7	-55.9	174.9	179.9	-172.8	-5.5	0	0	110.3	A372 A373 F510 E511 Y512 F516 L517 E518	A372-Q514 HydrophobicContact CB-CB 4.09Å; A373-Q514 HydrophobicContact CB-CG 4.1Å; F510-Q514 VanDerWaalsContact O-CB 3.32Å; F510-Q514 WeakPolarHBondContact O-CB 3.41Å; F510-Q514 PolarHBondContact O-N 3.3Å; E511-Q514 PolarHBondContact O-N 3.29Å; Y512-Q514 VanDerWaalsContact C-N 3.31Å; Y512-Q514 PolarHBondContact O-N 3.28Å; Q514-F516 VanDerWaalsContact C-N 3.34Å; Q514-F516 PolarHBondContact O-N 2.83Å; Q514-L517 PolarHBondContact O-N 3.37Å; Q514-E518 HydrophobicContact CG-CG 4.29Å; Q514-E518 WeakPolarHBondContact CG-OE1 3.37Å; Q514-E518 PolarHBondContact NE2-OE1 3.47Å; Q514-E518 WeakPolarHBondContact O-CB 2.94Å; Q514-E518 WeakPolarHBondContact O-CG 3.12Å; Q514-E518 PolarHBondContact O-N 2.99Å
515	G	88.4	Confident	86.5	Confident	30 Å²	30	64.7 Å²	64.7	31%	0.309	34%	0.337	S	S	.	.	H	α-helix	trans	-58.9	-43.8	-178.7	0	0	0	0	0	112.8	E511 Y512 L517 E518 D519	E511-G515 PolarHBondContact O-N 3.01Å; E511-G515 VanDerWaalsContact O-N 3.08Å; Y512-G515 PolarHBondContact O-N 3.25Å; G515-L517 PolarHBondContact O-N 3.48Å; G515-E518 PolarHBondContact O-N 2.78Å; G515-D519 PolarHBondContact O-N 3.42Å; G515-D519 VanDerWaalsContact O-N 3.1Å
516	F	92.3	Very high	84.7	Confident	60 Å²	60	61.8 Å²	61.8	26%	0.263	33%	0.33	S	S	.	.	H	α-helix	trans	-59.4	-43.9	177	179.9	-86	0	0	0	112.6	L495 Y512 Q514 Y520	L495-F516 HydrophobicContact CB-CE1 4.24Å; L495-F516 HydrophobicContact CD1-CD1 3.76Å; L495-F516 HydrophobicContact CD1-CD2 4.36Å; L495-F516 HydrophobicContact CD1-CE1 3.98Å; L495-F516 HydrophobicContact CD1-CG 3.97Å; L495-F516 HydrophobicContact CD1-CZ 4.37Å; L495-F516 HydrophobicContact CD2-CD1 3.58Å; L495-F516 HydrophobicContact CD2-CE1 3.75Å; L495-F516 HydrophobicContact CD2-CG 4.5Å; L495-F516 HydrophobicContact CG-CD1 4.21Å; L495-F516 HydrophobicContact CG-CE1 4.22Å; Y512-F516 HydrophobicContact CE1-CB 4.38Å; Y512-F516 WeakPolarHBondContact O-CB 3.5Å; Y512-F516 PolarHBondContact O-N 2.92Å; Q514-F516 VanDerWaalsContact C-N 3.34Å; Q514-F516 PolarHBondContact O-N 2.83Å; F516-Y520 HydrophobicContact CD1-CD2 4.25Å; F516-Y520 AromaticContact CE1-CD2 3.58Å; F516-Y520 HydrophobicContact CE1-CD2 3.58Å; F516-Y520 AromaticContact CE1-CE2 3.84Å; F516-Y520 HydrophobicContact CE1-CE2 3.84Å; F516-Y520 HydrophobicContact CZ-CD2 4.1Å; F516-Y520 HydrophobicContact CZ-CE2 4.15Å; F516-Y520 WeakPolarHBondContact O-CA 3.46Å; F516-Y520 PolarHBondContact O-N 2.76Å; F516-Y520 VanDerWaalsContact O-N 3.15Å
517	L	93.4	Very high	83.3	Confident	4 Å²	4	61 Å²	61	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-76.3	-36.5	-177.1	-69.6	166.4	0	0	0	112.4	V365 A368 A369 A372 F449 L492 L495 L513 Q514 G515 D519 Y520	V365-L517 HydrophobicContact CG1-CD2 4.15Å; A368-L517 HydrophobicContact CB-CD1 3.88Å; A368-L517 HydrophobicContact CB-CD2 4.29Å; A369-L517 HydrophobicContact CB-CB 3.77Å; A372-L517 HydrophobicContact CB-CD1 4.13Å; F449-L517 HydrophobicContact CE1-CD1 3.92Å; F449-L517 HydrophobicContact CZ-CD1 3.59Å; L492-L517 HydrophobicContact CD1-CD2 3.87Å; L495-L517 HydrophobicContact CD2-CD2 3.98Å; L495-L517 HydrophobicContact CD2-CG 4.19Å; L513-L517 WeakPolarHBondContact O-CB 3.35Å; L513-L517 WeakPolarHBondContact O-CD1 3.29Å; L513-L517 VanDerWaalsContact O-CG 3.24Å; L513-L517 WeakPolarHBondContact O-CG 3.43Å; L513-L517 PolarHBondContact O-N 2.9Å; L513-L517 VanDerWaalsContact O-N 3.07Å; Q514-L517 PolarHBondContact O-N 3.37Å; G515-L517 PolarHBondContact O-N 3.48Å; L517-D519 VanDerWaalsContact C-N 3.31Å; L517-D519 PolarHBondContact O-N 2.91Å; L517-Y520 WeakPolarHBondContact O-CB 3.29Å; L517-Y520 PolarHBondContact O-N 3.02Å
518	E	87.3	Confident	82.2	Confident	60 Å²	60	62.9 Å²	62.9	28%	0.28	33%	0.334	S	S	.	.	H	α-helix	trans	-63	-39.6	175.1	-73.8	-179.7	178.1	0	0	111.5	K157 A369 Q514 G515	K157-E518 WeakPolarHBondContact CE-O 3.43Å; K157-E518 HydrophobicContact CG-CB 4.19Å; K157-E518 HydrophobicContact CG-CG 4.14Å; K157-E518 PolarHBondContact NZ-O 2.89Å; A369-E518 HydrophobicContact CB-CG 4.06Å; Q514-E518 HydrophobicContact CG-CG 4.29Å; Q514-E518 WeakPolarHBondContact CG-OE1 3.37Å; Q514-E518 PolarHBondContact NE2-OE1 3.47Å; Q514-E518 WeakPolarHBondContact O-CB 2.94Å; Q514-E518 WeakPolarHBondContact O-CG 3.12Å; Q514-E518 PolarHBondContact O-N 2.99Å; G515-E518 PolarHBondContact O-N 2.78Å
519	D	84.6	Confident	81.4	Confident	66 Å²	66	64.7 Å²	64.7	35%	0.353	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	5.6	-178.3	-75.7	-33.1	0	0	0	114.9	G515 L517 F521 T522 A523	G515-D519 PolarHBondContact O-N 3.42Å; G515-D519 VanDerWaalsContact O-N 3.1Å; L517-D519 VanDerWaalsContact C-N 3.31Å; L517-D519 PolarHBondContact O-N 2.91Å; D519-F521 PolarHBondContact O-N 3.23Å; D519-T522 WeakPolarHBondContact CA-OG1 3.28Å; D519-T522 PolarHBondContact O-N 2.81Å; D519-T522 PolarHBondContact OD1-OG1 3.42Å; D519-A523 PolarHBondContact O-N 3.12Å
520	Y	85.9	Confident	80.1	Confident	40 Å²	40	65 Å²	65	16%	0.157	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-33.4	-170.9	-170.9	-94.1	0	0	0	114.3	V365 P489 S491 L492 F516 L517	V365-Y520 HydrophobicContact CG1-CD1 4.08Å; V365-Y520 HydrophobicContact CG1-CG 3.94Å; V365-Y520 HydrophobicContact CG2-CD1 4.2Å; V365-Y520 HydrophobicContact CG2-CE1 4.33Å; P489-Y520 WeakPolarHBondContact CB-OH 3.44Å; P489-Y520 WeakPolarHBondContact CG-OH 3.37Å; S491-Y520 PolarHBondContact OG-OH 3.43Å; L492-Y520 HydrophobicContact CB-CE2 4.22Å; F516-Y520 HydrophobicContact CD1-CD2 4.25Å; F516-Y520 AromaticContact CE1-CD2 3.58Å; F516-Y520 HydrophobicContact CE1-CD2 3.58Å; F516-Y520 AromaticContact CE1-CE2 3.84Å; F516-Y520 HydrophobicContact CE1-CE2 3.84Å; F516-Y520 HydrophobicContact CZ-CD2 4.1Å; F516-Y520 HydrophobicContact CZ-CE2 4.15Å; F516-Y520 WeakPolarHBondContact O-CA 3.46Å; F516-Y520 PolarHBondContact O-N 2.76Å; F516-Y520 VanDerWaalsContact O-N 3.15Å; L517-Y520 WeakPolarHBondContact O-CB 3.29Å; L517-Y520 PolarHBondContact O-N 3.02Å
521	F	78.8	Confident	78.2	Confident	109 Å²	109	65.9 Å²	65.9	48%	0.478	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-7	177.6	-60.6	-74.7	0	0	0	114.2	L361 P362 V365 D519	L361-F521 HydrophobicContact CD2-CZ 4.21Å; L361-F521 HydrophobicContact CG-CZ 4.23Å; P362-F521 HydrophobicContact CB-CE2 4.03Å; P362-F521 HydrophobicContact CB-CZ 4.26Å; P362-F521 HydrophobicContact CG-CE2 4.3Å; P362-F521 HydrophobicContact CG-CZ 4.04Å; V365-F521 HydrophobicContact CB-CE2 3.97Å; V365-F521 HydrophobicContact CG1-CE2 4.06Å; V365-F521 HydrophobicContact CG2-CE2 4.14Å; V365-F521 HydrophobicContact CG2-CZ 4.26Å; D519-F521 PolarHBondContact O-N 3.23Å
522	T	69.4	Low	76.1	Confident	33 Å²	33	65.7 Å²	65.7	20%	0.202	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-3.3	-169.7	42.7	0	0	0	0	114.8	D519 T524 E525	D519-T522 WeakPolarHBondContact CA-OG1 3.28Å; D519-T522 PolarHBondContact O-N 2.81Å; D519-T522 PolarHBondContact OD1-OG1 3.42Å; T522-T524 PolarHBondContact O-N 2.91Å; T522-E525 PolarHBondContact O-N 3.42Å; T522-E525 VanDerWaalsContact O-N 3.07Å
523	A	58	Low	73.7	Confident	90 Å²	90	66.3 Å²	66.3	74%	0.744	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-6.4	-172.8	0	0	0	0	0	116.9	D519	D519-A523 PolarHBondContact O-N 3.12Å
524	T	45.7	Very low	71.3	Confident	135 Å²	135	69 Å²	69	83%	0.828	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	-2.4	178.9	53.7	0	0	0	0	114.7	T522	T522-T524 PolarHBondContact O-N 2.91Å
525	E	55.9	Low	70	Confident	87 Å²	87	70.3 Å²	70.3	41%	0.407	39%	0.391	S	S	.	.	S	Bend	trans	-109.4	147.5	-175.5	-64.3	-166	-171.8	0	0	113.4	K196 T522 Q527	K196-E525 WeakPolarHBondContact CE-OE1 3.48Å; K196-E525 IonicContact NZ-OE1 2.71Å; K196-E525 PolarHBondContact NZ-OE1 2.87Å; K196-E525 IonicContact NZ-OE2 2.7Å; K196-E525 PolarHBondContact NZ-OE2 2.79Å; T522-E525 PolarHBondContact O-N 3.42Å; T522-E525 VanDerWaalsContact O-N 3.07Å; E525-Q527 PolarHBondContact O-N 3.39Å
526	P	60	Low	69.1	Low	80 Å²	80	72.4 Å²	72.4	52%	0.519	40%	0.395	S	S	.	.			trans	-63	129.1	173.3	26.8	-32.8	0	0	0	110	Y528	P526-Y528 PolarHBondContact O-N 2.82Å
527	Q	68.8	Low	67.8	Low	102 Å²	102	73.1 Å²	73.1	48%	0.477	40%	0.402	S	S	.	.	S	Bend	trans	-60.3	-28.7	-177.5	-70.9	-175.7	-5.2	0	0	113.5	R156 E525	R156-Q527 VanDerWaalsContact NH1-CB 3.34Å; R156-Q527 PolarHBondContact NH1-O 2.72Å; R156-Q527 PolarHBondContact NH2-O 2.83Å; E525-Q527 PolarHBondContact O-N 3.39Å
528	Y	75.4	Confident	66.3	Low	42 Å²	42	77.1 Å²	77.1	17%	0.165	43%	0.425	C	S	.	.	S	Bend	trans	-130.7	144.4	175	-74.2	-81.7	0	0	0	109.7	S178 T180 S186 H202 K204 P526	S178-Y528 PolarHBondContact OG-OH 3.44Å; T180-Y528 HydrophobicContact CG2-CE2 4.16Å; T180-Y528 WeakPolarHBondContact OG1-CE2 3.47Å; T180-Y528 PolarHBondContact OG1-OH 3.43Å; S186-Y528 WeakPolarHBondContact OG-CE1 3.5Å; S186-Y528 PolarHBondContact OG-OH 3.2Å; H202-Y528 HydrophobicContact CB-CD1 4.08Å; H202-Y528 HydrophobicContact CB-CE1 4.21Å; K204-Y528 HydrophobicContact CB-CD1 3.75Å; K204-Y528 HydrophobicContact CB-CE1 3.93Å; K204-Y528 HydrophobicContact CB-CG 4.24Å; K204-Y528 HydrophobicContact CG-CE1 4.48Å; P526-Y528 PolarHBondContact O-N 2.82Å
529	Q	81.3	Confident	65	Low	58 Å²	58	78.2 Å²	78.2	27%	0.271	43%	0.434	S	S	.	.			trans	-69.1	134.9	172.3	-62.6	-59	-37.1	0	0	110	K201 H202 Y203	K201-Q529 HydrophobicContact CB-CG 4.31Å; K201-Q529 HydrophobicContact CG-CG 4.38Å; H202-Q529 PolarHBondContact O-N 2.65Å; Y203-Q529 HydrophobicContact CD1-CB 3.81Å; Y203-Q529 HydrophobicContact CD1-CG 4.44Å; Y203-Q529 HydrophobicContact CE1-CB 3.56Å; Y203-Q529 HydrophobicContact CE1-CG 3.92Å
530	P	71.1	Confident	63.7	Low	59 Å²	59	79 Å²	79	38%	0.383	44%	0.439	S	S	.	.			trans	-66.8	137.6	-179.3	27	-33	0	0	0	110.6	D532 L534	P530-D532 VanDerWaalsContact C-N 3.31Å; P530-L534 WeakPolarHBondContact O-CG 3.44Å
531	G	59.4	Low	62.1	Low	19 Å²	19	81.8 Å²	81.8	20%	0.196	46%	0.46	C	S	.	.	S	Bend	trans	-74.9	-20.3	176.2	0	0	0	0	0	114	N533	G531-N533 PolarHBondContact O-N 2.93Å
532	D	52.4	Low	60.8	Low	133 Å²	133	79.7 Å²	79.7	71%	0.711	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-14.5	-169.5	-59.9	-41.1	0	0	0	114	P530	P530-D532 VanDerWaalsContact C-N 3.31Å
533	N	45.7	Very low	60.1	Low	142 Å²	142	83.6 Å²	83.6	76%	0.759	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	8.4	177.9	-68.4	-19.3	0	0	0	113.2	G531	G531-N533 PolarHBondContact O-N 2.93Å
534	L	47.3	Very low	60.3	Low	56 Å²	56	83 Å²	83	29%	0.293	46%	0.455	S	S	.	.			trans	-102.7	0	-175.7	-54.9	175.2	0	0	0	112.3	Y203 I215 R218 G237 P530	Y203-L534 HydrophobicContact CD1-CD1 4.12Å; Y203-L534 HydrophobicContact CE1-CD1 4.08Å; I215-L534 HydrophobicContact CG2-CD1 4.28Å; R218-L534 PolarHBondContact NH1-O 2.87Å; G237-L534 WeakPolarHBondContact O-CD2 3.45Å; P530-L534 WeakPolarHBondContact O-CG 3.44Å

Retrieved 534 of 534 residues in 562.5 ms (Link to these results)

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