A0A913KUT9_SCHMA Loading...

Tyrosine-protein kinase AlphaSync

AlphaFold DB , UniProt , Accession A0A913KUT9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 565 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	31.5	Very low	24.5	Very low	216 Å²	216	152.9 Å²	152.9	100%	1.064	85%	0.849	S	S	*	*				0	117.2	0	-67.8	-174.7	-162.5	0	0	108.6	I3	M1-I3 PolarHBondContact O-N 3.12Å
2	G	22.4	Very low	24.7	Very low	77 Å²	77	157 Å²	157	79%	0.794	85%	0.851	S	S	*	*			trans	-63.8	128.1	169.5	0	0	0	0	0	109.2	C4	G2-C4 PolarHBondContact O-N 2.81Å
3	I	24.6	Very low	25.1	Very low	167 Å²	167	160.7 Å²	160.7	86%	0.856	86%	0.86	S	S	*	*			trans	-74.3	92.3	168.7	-64	175.2	0	0	0	105.8	M1 L5	M1-I3 PolarHBondContact O-N 3.12Å; I3-L5 PolarHBondContact O-N 3Å
4	C	21.4	Very low	25.6	Very low	107 Å²	107	154.2 Å²	154.2	72%	0.723	85%	0.85	S	S	*	*			trans	-59.9	113.4	165.4	-170	0	0	0	0	107.8	G2 C6	G2-C4 PolarHBondContact O-N 2.81Å; C4-C6 PolarHBondContact O-N 3.25Å
5	L	22.3	Very low	26	Very low	160 Å²	160	156.9 Å²	156.9	84%	0.838	85%	0.854	S	S	*	*			trans	-63.9	96.3	167	-85.5	153.7	0	0	0	108.5	I3 L7	I3-L5 PolarHBondContact O-N 3Å; L5-L7 PolarHBondContact O-N 3.31Å
6	C	23	Very low	26.2	Very low	114 Å²	114	160.4 Å²	160.4	77%	0.77	85%	0.85	S	S	*	*			trans	-70.9	95.3	164.6	-93.8	0	0	0	0	109.1	C4 Q8	C4-C6 PolarHBondContact O-N 3.25Å; C6-Q8 PolarHBondContact O-N 3.18Å
7	L	21.6	Very low	26.4	Very low	168 Å²	168	160 Å²	160	88%	0.88	85%	0.849	S	S	*	*			trans	-63.4	96.5	156.1	-77.6	162.7	0	0	0	108.5	L5 R9	L5-L7 PolarHBondContact O-N 3.31Å; L7-R9 PolarHBondContact O-N 2.99Å
8	Q	24.2	Very low	26.4	Very low	190 Å²	190	155.3 Å²	155.3	89%	0.888	85%	0.845	S	S	*	*			trans	-75.6	103	163.6	-89	-175.2	-26.8	0	0	109.3	C6 S10	C6-Q8 PolarHBondContact O-N 3.18Å; Q8-S10 PolarHBondContact O-N 2.58Å
9	R	22.6	Very low	26.1	Very low	245 Å²	245	151.2 Å²	151.2	93%	0.925	84%	0.843	S	S	*	*			trans	-62.2	121.9	152.9	-91.8	179.8	169.7	-179.5	-1.8	108.2	L7	L7-R9 PolarHBondContact O-N 2.99Å
10	S	27	Very low	26.1	Very low	111 Å²	111	149.3 Å²	149.3	78%	0.776	84%	0.84	S	S	*	*			trans	-116.6	122	159.3	-143.7	0	0	0	0	107.9	Q8	Q8-S10 PolarHBondContact O-N 2.58Å
11	P	29	Very low	26	Very low	127 Å²	127	150.6 Å²	150.6	83%	0.825	84%	0.839	S	S	*	*			trans	-77.7	132.7	-178	28.9	-28.3	0	0	0	111
12	K	27.2	Very low	25.6	Very low	202 Å²	202	151.6 Å²	151.6	88%	0.878	83%	0.833	S	S	*	*			trans	-64.7	150.9	176.1	-73.9	-177.4	172.7	-177.9	0	112.6
13	Q	30.2	Very low	25.6	Very low	205 Å²	205	158.5 Å²	158.5	96%	0.958	84%	0.836	S	S	*	*			trans	-150.5	133.7	137.7	-103.6	-176.6	5.7	0	0	111
14	G	31.7	Very low	25.5	Very low	70 Å²	70	159.4 Å²	159.4	72%	0.722	84%	0.842	S	S	*	*			trans	128.9	85.8	154.3	0	0	0	0	0	118.6
15	Q	31.7	Very low	25.5	Very low	195 Å²	195	158 Å²	158	91%	0.911	85%	0.845	S	S	*	*			trans	60.8	158.7	146.1	-68.1	179.7	-20	0	0	120
16	R	28.2	Very low	25.6	Very low	212 Å²	212	155.8 Å²	155.8	80%	0.8	84%	0.843	S	S	*	*			cis	-162.4	142.4	-48.1	-118.1	-171.6	-163	-177.7	4.3	104.3
17	D	30	Very low	25.6	Very low	154 Å²	154	157.2 Å²	157.2	82%	0.824	85%	0.849	S	S	*	*			trans	68.8	139.2	158.4	-55.4	-28.6	0	0	0	122.2
18	G	26.3	Very low	25.9	Very low	76 Å²	76	154.8 Å²	154.8	78%	0.784	84%	0.843	S	S	*	*			trans	114.6	96.2	152.8	0	0	0	0	0	115.4
19	G	21.5	Very low	26.1	Very low	77 Å²	77	152 Å²	152	79%	0.794	84%	0.839	S	S	*	*			trans	-61.6	157.8	178.9	0	0	0	0	0	114.6
20	S	25.1	Very low	26.4	Very low	113 Å²	113	146.8 Å²	146.8	79%	0.79	83%	0.834	S	S	*	*			trans	-159.3	137	160.1	-77.2	0	0	0	0	111.9
21	H	24.1	Very low	26.4	Very low	177 Å²	177	146.4 Å²	146.4	82%	0.819	84%	0.838	S	S	*	*			trans	-53.4	148.5	174.3	-67.7	-97.8	0	0	0	114.2
22	Y	23.5	Very low	26.3	Very low	237 Å²	237	147.9 Å²	147.9	93%	0.929	84%	0.839	S	S	*	*			trans	-93.4	113.9	164.7	-70.6	-79.7	0	0	0	110.1
23	Y	22.1	Very low	26.2	Very low	222 Å²	222	145.5 Å²	145.5	87%	0.871	84%	0.836	S	S	*	*			trans	-96.5	138	160.9	-96.6	-90	0	0	0	109.2
24	L	22.2	Very low	25.9	Very low	185 Å²	185	140.7 Å²	140.7	97%	0.969	83%	0.831	S	S	*	*			trans	-89	118.7	166.9	-102.7	140.4	0	0	0	108.9
25	G	22.2	Very low	25.6	Very low	77 Å²	77	142.1 Å²	142.1	79%	0.794	84%	0.836	S	S	*	*			trans	-147.6	117.5	172.5	0	0	0	0	0	109.7
26	S	24.1	Very low	25.2	Very low	115 Å²	115	142.2 Å²	142.2	80%	0.804	83%	0.834	S	S	*	*			trans	-84.8	147.3	-174.7	44.6	0	0	0	0	113.9
27	T	23.2	Very low	25	Very low	144 Å²	144	143.1 Å²	143.1	88%	0.883	84%	0.839	S	S	*	*			trans	-160.7	155.5	133	34.1	0	0	0	0	110.9
28	P	27.5	Very low	24.7	Very low	116 Å²	116	143.1 Å²	143.1	75%	0.753	84%	0.838	S	S	*	*			trans	-111	148	-147.7	37.6	-27.3	0	0	0	114.7
29	T	28.9	Very low	24.5	Very low	132 Å²	132	150.1 Å²	150.1	81%	0.81	84%	0.842	S	S	*	*			trans	-152.7	115.7	155.6	33.8	0	0	0	0	112
30	T	27.9	Very low	24.7	Very low	135 Å²	135	154.6 Å²	154.6	83%	0.828	84%	0.842	S	S	*	*	S	Bend	trans	51.7	123.6	144.1	53.2	0	0	0	0	122.3
31	A	28.5	Very low	24.6	Very low	104 Å²	104	156.1 Å²	156.1	86%	0.86	84%	0.837	S	S	*	*			trans	86.8	68.9	154.1	0	0	0	0	0	118
32	D	25.5	Very low	24.5	Very low	157 Å²	157	153.8 Å²	153.8	84%	0.84	84%	0.835	S	S	*	*			trans	-68.6	129.9	155.5	-90.1	-41.6	0	0	0	111.1
33	N	25.3	Very low	24.5	Very low	152 Å²	152	151 Å²	151	81%	0.813	83%	0.828	S	S	*	*			trans	169.9	86.3	132	-87.5	-14.1	0	0	0	110.4
34	A	24.2	Very low	24.5	Very low	104 Å²	104	148.6 Å²	148.6	86%	0.86	83%	0.825	S	S	*	*	S	Bend	trans	169.7	91.2	150.5	0	0	0	0	0	109.3
35	A	25.3	Very low	24.6	Very low	100 Å²	100	146.2 Å²	146.2	83%	0.826	82%	0.818	S	S	*	*			trans	160.4	78.2	152.6	0	0	0	0	0	110.3
36	K	24.1	Very low	24.7	Very low	198 Å²	198	148 Å²	148	86%	0.861	81%	0.814	S	S	*	*			trans	-147.3	45.9	164.3	-99.7	-167.4	-174.1	173.6	0	112.7
37	Y	24.2	Very low	24.8	Very low	231 Å²	231	149.5 Å²	149.5	91%	0.906	81%	0.813	S	S	*	*			trans	-151.2	99.1	158.7	-74.4	-72.6	0	0	0	108.6
38	L	23.7	Very low	24.9	Very low	153 Å²	153	150.1 Å²	150.1	80%	0.801	81%	0.811	S	S	*	*			trans	177.8	83	157.6	-99.3	155.7	0	0	0	107.8
39	Y	22.5	Very low	24.8	Very low	224 Å²	224	147.7 Å²	147.7	88%	0.878	81%	0.807	S	S	*	*			trans	-128.7	78.6	152.3	-108.1	-84.3	0	0	0	106.4	Q41	Y39-Q41 PolarHBondContact O-N 3Å
40	H	24.7	Very low	24.6	Very low	170 Å²	170	146.9 Å²	146.9	79%	0.787	81%	0.806	S	S	*	*			trans	-73	102.6	154.2	-93.7	-68.9	0	0	0	106.4	T42	H40-T42 PolarHBondContact O-N 2.91Å
41	Q	22.9	Very low	24.5	Very low	145 Å²	145	147.8 Å²	147.8	68%	0.678	81%	0.806	S	S	*	*			trans	-70.7	105.1	156.5	-79.5	-175.3	-10.4	0	0	107	Y39 F43	Y39-Q41 PolarHBondContact O-N 3Å; Q41-F43 PolarHBondContact O-N 2.91Å
42	T	22.4	Very low	24.4	Very low	129 Å²	129	147.6 Å²	147.6	79%	0.791	81%	0.805	S	S	*	*			trans	-58.8	110.9	159.2	44.1	0	0	0	0	108	H40 E44	H40-T42 PolarHBondContact O-N 2.91Å; T42-E44 PolarHBondContact O-N 2.65Å
43	F	23.3	Very low	24.4	Very low	179 Å²	179	147.3 Å²	147.3	79%	0.785	80%	0.803	S	S	*	*			trans	-70.7	115.4	163.8	-80.4	-87	0	0	0	107.9	Q41 V45	Q41-F43 PolarHBondContact O-N 2.91Å; F43-V45 PolarHBondContact O-N 3.35Å
44	E	22.1	Very low	24.4	Very low	170 Å²	170	146.9 Å²	146.9	79%	0.794	81%	0.806	S	S	*	*			trans	-60.3	115.2	163.4	-81	-177.4	151.3	0	0	108.5	T42 T46	T42-E44 PolarHBondContact O-N 2.65Å; E44-T46 VanDerWaalsContact C-N 3.26Å; E44-T46 PolarHBondContact O-N 3.09Å
45	V	23.6	Very low	24.5	Very low	135 Å²	135	145.8 Å²	145.8	82%	0.818	80%	0.797	S	S	*	*			trans	-68.3	92	162.8	178.4	0	0	0	0	106.6	F43 N47	F43-V45 PolarHBondContact O-N 3.35Å; V45-N47 PolarHBondContact O-N 3.26Å
46	T	25.7	Very low	24.6	Very low	116 Å²	116	146.3 Å²	146.3	71%	0.712	79%	0.792	S	S	*	*			trans	-81	103.1	161.4	45	0	0	0	0	107.5	E44 N48	E44-T46 VanDerWaalsContact C-N 3.26Å; E44-T46 PolarHBondContact O-N 3.09Å; T46-N48 PolarHBondContact O-N 2.68Å; T46-N48 VanDerWaalsContact O-N 3.11Å
47	N	25	Very low	24.7	Very low	146 Å²	146	142.8 Å²	142.8	78%	0.781	79%	0.787	S	S	*	*			trans	-64.7	104.6	173.8	-147.1	0.7	0	0	0	108.1	V45	V45-N47 PolarHBondContact O-N 3.26Å
48	N	26.4	Very low	24.8	Very low	157 Å²	157	138.1 Å²	138.1	84%	0.84	78%	0.778	S	S	*	*			trans	-154.1	100.7	162.8	-96.1	-21.5	0	0	0	110.4	T46	T46-N48 PolarHBondContact O-N 2.68Å; T46-N48 VanDerWaalsContact O-N 3.11Å
49	G	24.2	Very low	25.2	Very low	65 Å²	65	135.4 Å²	135.4	67%	0.67	77%	0.767	S	S	*	*				59.9	112.4	129.7	0	0	0	0	0	119.5
50	S	24.9	Very low	25.4	Very low	114 Å²	114	131.2 Å²	131.2	80%	0.797	76%	0.76	S	S	*	*			trans	83.4	124.6	144.7	66.8	0	0	0	0	120.2
51	N	26.4	Very low	25.4	Very low	154 Å²	154	131 Å²	131	82%	0.824	76%	0.76	S	S	*	*			trans	76.6	84.8	159.3	-62	-9.4	0	0	0	118.6
52	A	25.4	Very low	25.7	Very low	101 Å²	101	127.7 Å²	127.7	84%	0.835	75%	0.749	S	S	*	*			trans	-81.7	98.7	146	0	0	0	0	0	108.2
53	D	26.1	Very low	25.8	Very low	150 Å²	150	126.5 Å²	126.5	80%	0.802	74%	0.742	S	S	*	*			trans	-170.6	101	158.5	-97.4	-27.4	0	0	0	107.9
54	T	25.9	Very low	26.1	Very low	143 Å²	143	122 Å²	122	88%	0.877	73%	0.729	S	S	*	*			trans	-179.3	105.8	144.3	21.7	0	0	0	0	109.8
55	A	25.5	Very low	26.4	Very low	82 Å²	82	123.2 Å²	123.2	68%	0.678	73%	0.727	S	S	*	*			trans	-61.9	137.2	158.7	0	0	0	0	0	109	T57	A55-T57 PolarHBondContact O-N 2.87Å
56	P	28.8	Very low	26.6	Very low	110 Å²	110	122.8 Å²	122.8	71%	0.714	72%	0.721	S	S	*	*			trans	-74.8	100.6	178.5	29.5	-30.4	0	0	0	109
57	T	25.2	Very low	26.6	Very low	125 Å²	125	125.4 Å²	125.4	77%	0.767	72%	0.723	S	S	*	*			trans	-77.1	135.2	170.6	50.1	0	0	0	0	110.7	A55	A55-T57 PolarHBondContact O-N 2.87Å
58	N	25.9	Very low	26.6	Very low	132 Å²	132	122.4 Å²	122.4	71%	0.706	71%	0.712	S	S	*	*			trans	71	96.9	172.6	-85.7	-30.1	0	0	0	117.7
59	V	32.2	Very low	26.7	Very low	96 Å²	96	119.1 Å²	119.1	58%	0.582	70%	0.699	S	S	*	*			trans	-115.9	86.8	153.1	-167.1	0	0	0	0	107.6
60	N	26.3	Very low	26.7	Very low	136 Å²	136	124.5 Å²	124.5	73%	0.727	70%	0.704	S	S	*	*			trans	-93.5	95.5	171.4	-77.4	-22.4	0	0	0	108.7
61	E	25.8	Very low	26.7	Very low	166 Å²	166	125.6 Å²	125.6	78%	0.776	70%	0.701	S	S	*	*			trans	154.2	116.9	152.7	-90.7	-179.6	168.1	0	0	108
62	V	29.1	Very low	26.9	Very low	76 Å²	76	123.6 Å²	123.6	46%	0.461	70%	0.699	S	S	.	*			trans	-118	116.8	-174.2	-179.7	0	0	0	0	108.8	V64	V62-V64 HydrophobicContact CG1-CG2 4.48Å
63	T	25	Very low	26.9	Very low	103 Å²	103	125.6 Å²	125.6	63%	0.632	70%	0.695	S	S	*	*			trans	-102.6	113.7	170.3	-42.6	0	0	0	0	108.4
64	V	28.3	Very low	26.8	Very low	85 Å²	85	122.8 Å²	122.8	52%	0.515	69%	0.693	S	S	.	*			trans	-76.2	123.2	-179.8	-179.3	0	0	0	0	109.4	V62	V62-V64 HydrophobicContact CG1-CG2 4.48Å
65	Y	28.8	Very low	26.8	Very low	195 Å²	195	123.5 Å²	123.5	77%	0.765	69%	0.689	S	S	*	*			trans	-104.7	117.1	171.5	-126	-87.9	0	0	0	109.6
66	N	27.6	Very low	26.7	Very low	126 Å²	126	123.4 Å²	123.4	67%	0.674	68%	0.684	S	S	*	*			trans	-76.6	125.6	165.7	-76.2	-22.4	0	0	0	108	C68	N66-C68 PolarHBondContact O-N 2.85Å
67	F	26.6	Very low	26.6	Very low	172 Å²	172	129.7 Å²	129.7	75%	0.754	69%	0.693	S	S	*	*			trans	-58.2	103	166.3	-105	-91.2	0	0	0	108.1
68	C	25.3	Very low	26.4	Very low	82 Å²	82	130.5 Å²	130.5	55%	0.554	69%	0.693	S	S	*	*			trans	-82.5	125	172.5	-159.8	0	0	0	0	107	N66 K70	N66-C68 PolarHBondContact O-N 2.85Å; C68-K70 PolarHBondContact O-N 3.03Å
69	P	27.1	Very low	26.4	Very low	88 Å²	88	127.8 Å²	127.8	57%	0.571	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-71.8	21.1	-174.9	31	-37.1	0	0	0	113.5	N71	P69-N71 VanDerWaalsContact C-N 3.34Å; P69-N71 PolarHBondContact O-N 3.14Å
70	K	25.6	Very low	26	Very low	178 Å²	178	126.8 Å²	126.8	77%	0.774	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-83.2	-3.9	-172.7	-73	-173.5	176.5	-178.4	0	114.5	C68	C68-K70 PolarHBondContact O-N 3.03Å
71	N	24.4	Very low	26	Very low	138 Å²	138	124.3 Å²	124.3	74%	0.738	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-140.8	43.2	178.9	-89.6	-13.5	0	0	0	113.4	P69 L73	P69-N71 VanDerWaalsContact C-N 3.34Å; P69-N71 PolarHBondContact O-N 3.14Å; N71-L73 PolarHBondContact O-N 3.03Å
72	S	30.2	Very low	26.1	Very low	111 Å²	111	120.2 Å²	120.2	78%	0.776	65%	0.648	S	S	*	*			trans	-72.4	77.5	153.7	48.7	0	0	0	0	108.3	A74	S72-A74 PolarHBondContact O-N 3.14Å
73	L	25.2	Very low	26	Very low	144 Å²	144	121.9 Å²	121.9	75%	0.754	65%	0.652	S	S	*	*			trans	-57.8	106.5	172.3	-83.7	158.2	0	0	0	108.9	N71 I75	N71-L73 PolarHBondContact O-N 3.03Å; L73-I75 PolarHBondContact O-N 2.87Å
74	A	23.8	Very low	26.5	Very low	91 Å²	91	121.7 Å²	121.7	75%	0.752	64%	0.644	S	S	*	*			trans	35.2	75.9	149.2	0	0	0	0	0	115.8	S72 S76	S72-A74 PolarHBondContact O-N 3.14Å; A74-S76 PolarHBondContact O-N 2.77Å
75	I	25.7	Very low	26.8	Very low	157 Å²	157	120 Å²	120	81%	0.805	63%	0.631	S	S	*	*			trans	-68.4	118.5	152.7	-61.9	176	0	0	0	106.3	L73	L73-I75 PolarHBondContact O-N 2.87Å
76	S	23.8	Very low	27	Very low	80 Å²	80	112.2 Å²	112.2	56%	0.559	61%	0.607	S	S	*	*			trans	-47.1	137.8	-179.6	177.8	0	0	0	0	112	A74 N78	A74-S76 PolarHBondContact O-N 2.77Å; S76-N78 PolarHBondContact O-N 3Å
77	R	26	Very low	27.3	Very low	243 Å²	243	107.3 Å²	107.3	92%	0.917	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	7.3	179	-84.9	178.6	171.3	159.4	-2.6	115.2
78	N	22.7	Very low	27.8	Very low	141 Å²	141	101.9 Å²	101.9	75%	0.754	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.5	47.5	-176.3	-75.1	-26	0	0	0	112.9	S76	S76-N78 PolarHBondContact O-N 3Å
79	V	24	Very low	28.7	Very low	75 Å²	75	100.3 Å²	100.3	46%	0.455	56%	0.556	S	S	.	*			trans	-153.2	80.3	158.9	-170.6	0	0	0	0	107.8
80	V	24	Very low	29.6	Very low	76 Å²	76	98.5 Å²	98.5	46%	0.461	55%	0.548	S	S	.	.			trans	-127	68.7	174.3	-169	0	0	0	0	108.7	T211	V80-T211 HydrophobicContact CB-CG2 4.19Å; V80-T211 HydrophobicContact CG1-CG2 3.61Å
81	T	26.5	Very low	30.8	Very low	84 Å²	84	91.3 Å²	91.3	52%	0.515	52%	0.517	S	S	.	.	S	Bend	trans	-136.2	3.7	169.7	31.5	0	0	0	0	111.9	R545	T81-R545 VanDerWaalsContact CG2-NH2 3.34Å; T81-R545 PolarHBondContact O-NH1 3.19Å; T81-R545 PolarHBondContact O-NH2 2.95Å
82	D	29	Very low	32.2	Very low	80 Å²	80	85.9 Å²	85.9	43%	0.428	49%	0.488	S	S	.	.			trans	-114.4	52.3	-171	-61.4	-13.9	0	0	0	111.6	A86	D82-A86 WeakPolarHBondContact O-CB 3.37Å
83	M	26.8	Very low	33.6	Very low	111 Å²	111	85 Å²	85	55%	0.547	48%	0.475	S	S	.	.			trans	-130.1	8.9	-174.9	-83.4	-155.8	88.1	0	0	117.6
84	H	34.2	Very low	35	Very low	99 Å²	99	80.6 Å²	80.6	46%	0.458	46%	0.459	S	S	.	.	S	Bend	trans	-93.7	-14.3	-175.4	-97.1	113.9	0	0	0	116.5
85	M	36.5	Very low	36.8	Very low	49 Å²	49	76.3 Å²	76.3	24%	0.241	42%	0.424	C	S	.	.	S	Bend	trans	-151.1	-17.3	172.2	-89.3	-62.7	-62.3	0	0	111.7	C87 V88 A89 P349	M85-C87 PolarHBondContact O-N 3.2Å; M85-C87 VanDerWaalsContact O-N 3.09Å; M85-V88 PolarHBondContact O-N 2.82Å; M85-A89 PolarHBondContact O-N 2.83Å; M85-A89 VanDerWaalsContact O-N 3.07Å; M85-P349 HydrophobicContact CE-CG 4.3Å; M85-P349 HydrophobicContact CG-CG 4.27Å; M85-P349 WeakPolarHBondContact SD-CD 3.31Å; M85-P349 HydrophobicContact SD-CG 3.74Å
86	A	32.1	Very low	38.4	Very low	31 Å²	31	70.4 Å²	70.4	26%	0.256	40%	0.395	S	S	.	.	H	α-helix	trans	-55	-12.3	161.2	0	0	0	0	0	112.9	D82 A90	D82-A86 WeakPolarHBondContact O-CB 3.37Å; A86-A90 WeakPolarHBondContact O-CA 3.41Å; A86-A90 WeakPolarHBondContact O-CB 3.34Å; A86-A90 PolarHBondContact O-N 2.93Å
87	C	34.5	Very low	40	Very low	23 Å²	23	69.7 Å²	69.7	16%	0.155	39%	0.39	C	S	.	.	H	α-helix	trans	-74.2	-43	173	-155	0	0	0	0	112.1	M85 Q91 D183	M85-C87 PolarHBondContact O-N 3.2Å; M85-C87 VanDerWaalsContact O-N 3.09Å; C87-Q91 WeakPolarHBondContact O-CA 3.28Å; C87-Q91 WeakPolarHBondContact O-CB 3.43Å; C87-Q91 WeakPolarHBondContact O-CG 3.47Å; C87-Q91 PolarHBondContact O-N 3Å; C87-D183 WeakPolarHBondContact CB-OD2 3.24Å
88	V	37.4	Very low	41.2	Very low	59 Å²	59	60.4 Å²	60.4	36%	0.358	37%	0.365	S	S	.	.	H	α-helix	trans	-75.1	-43.8	173.8	179.4	0	0	0	0	110.7	M85 Q91 N92	M85-V88 PolarHBondContact O-N 2.82Å; V88-Q91 PolarHBondContact O-N 3.04Å; V88-N92 VanDerWaalsContact O-CB 3.24Å; V88-N92 WeakPolarHBondContact O-CB 3.38Å; V88-N92 VanDerWaalsContact O-CG 3.23Å; V88-N92 PolarHBondContact O-N 3.43Å
89	A	43.4	Very low	42.8	Very low	48 Å²	48	56 Å²	56	40%	0.397	34%	0.341	S	S	.	.	H	α-helix	trans	-67	-38	176.5	0	0	0	0	0	111.9	M85 N93	M85-A89 PolarHBondContact O-N 2.83Å; M85-A89 VanDerWaalsContact O-N 3.07Å; A89-N93 VanDerWaalsContact O-CB 3.27Å; A89-N93 WeakPolarHBondContact O-CB 3.22Å; A89-N93 PolarHBondContact O-N 3.29Å; A89-N93 PolarHBondContact O-ND2 2.81Å
90	A	44.8	Very low	43.8	Very low	50 Å²	50	56.6 Å²	56.6	41%	0.413	35%	0.349	S	S	.	.	H	α-helix	trans	-79.9	-24.7	173.2	0	0	0	0	0	113.3	A86 A94	A86-A90 WeakPolarHBondContact O-CA 3.41Å; A86-A90 WeakPolarHBondContact O-CB 3.34Å; A86-A90 PolarHBondContact O-N 2.93Å; A90-A94 WeakPolarHBondContact O-CA 3.45Å; A90-A94 WeakPolarHBondContact O-CB 3.47Å; A90-A94 PolarHBondContact O-N 2.97Å
91	Q	51.3	Low	44.6	Very low	27 Å²	27	57.6 Å²	57.6	13%	0.126	36%	0.355	C	S	.	.	H	α-helix	trans	-66.5	-47.3	165.9	-89.4	-176.6	-22.9	0	0	109.6	C87 V88 N93 A94 I95 L170	C87-Q91 WeakPolarHBondContact O-CA 3.28Å; C87-Q91 WeakPolarHBondContact O-CB 3.43Å; C87-Q91 WeakPolarHBondContact O-CG 3.47Å; C87-Q91 PolarHBondContact O-N 3Å; V88-Q91 PolarHBondContact O-N 3.04Å; Q91-N93 PolarHBondContact O-N 3.09Å; Q91-A94 PolarHBondContact O-N 3.4Å; Q91-I95 WeakPolarHBondContact O-CB 3.32Å; Q91-I95 WeakPolarHBondContact O-CD1 3.19Å; Q91-I95 WeakPolarHBondContact O-CG1 3.38Å; Q91-I95 PolarHBondContact O-N 3.16Å; Q91-L170 HydrophobicContact CG-CD1 4.27Å
92	N	55.1	Low	45.1	Very low	24 Å²	24	60.8 Å²	60.8	13%	0.128	37%	0.366	C	S	.	.	H	α-helix	trans	-59.3	-48	174.3	-75.3	-4.6	0	0	0	110	V88 A94 I95 T96 W150	V88-N92 VanDerWaalsContact O-CB 3.24Å; V88-N92 WeakPolarHBondContact O-CB 3.38Å; V88-N92 VanDerWaalsContact O-CG 3.23Å; V88-N92 PolarHBondContact O-N 3.43Å; N92-A94 VanDerWaalsContact C-N 3.33Å; N92-A94 PolarHBondContact O-N 3.09Å; N92-I95 PolarHBondContact O-N 2.71Å; N92-T96 VanDerWaalsContact O-CB 3.29Å; N92-T96 WeakPolarHBondContact O-CB 3.49Å; N92-T96 PolarHBondContact O-N 3.12Å; N92-T96 PolarHBondContact O-OG1 2.71Å; N92-W150 HydrophobicContact CB-CZ2 4.28Å; N92-W150 WeakPolarHBondContact OD1-CH2 3.35Å
93	N	58	Low	45.3	Very low	92 Å²	92	62.1 Å²	62.1	49%	0.492	38%	0.382	S	S	.	.	H	α-helix	trans	-62.9	-37.9	175.4	-70.4	-21.6	0	0	0	112	A89 Q91 S97	A89-N93 VanDerWaalsContact O-CB 3.27Å; A89-N93 WeakPolarHBondContact O-CB 3.22Å; A89-N93 PolarHBondContact O-N 3.29Å; A89-N93 PolarHBondContact O-ND2 2.81Å; Q91-N93 PolarHBondContact O-N 3.09Å; N93-S97 WeakPolarHBondContact O-CA 3.42Å; N93-S97 WeakPolarHBondContact O-CB 3.49Å; N93-S97 PolarHBondContact O-N 3.1Å; N93-S97 PolarHBondContact O-OG 3.42Å
94	A	56.2	Low	45.7	Very low	52 Å²	52	63.3 Å²	63.3	43%	0.43	40%	0.398	S	S	.	.	H	α-helix	trans	-67.5	-40.9	177.2	0	0	0	0	0	111.2	A90 Q91 N92 A98	A90-A94 WeakPolarHBondContact O-CA 3.45Å; A90-A94 WeakPolarHBondContact O-CB 3.47Å; A90-A94 PolarHBondContact O-N 2.97Å; Q91-A94 PolarHBondContact O-N 3.4Å; N92-A94 VanDerWaalsContact C-N 3.33Å; N92-A94 PolarHBondContact O-N 3.09Å; A94-A98 WeakPolarHBondContact O-CB 3.21Å; A94-A98 PolarHBondContact O-N 3.12Å
95	I	60	Low	45.6	Very low	2 Å²	2	63.9 Å²	63.9	1%	0.01	41%	0.413	C	S	.	.	H	α-helix	trans	-66	-51.8	175.1	-67.2	164.1	0	0	0	109.5	Q91 N92 S97 A98 I99 V115 V117 W150 L170	Q91-I95 WeakPolarHBondContact O-CB 3.32Å; Q91-I95 WeakPolarHBondContact O-CD1 3.19Å; Q91-I95 WeakPolarHBondContact O-CG1 3.38Å; Q91-I95 PolarHBondContact O-N 3.16Å; N92-I95 PolarHBondContact O-N 2.71Å; I95-S97 VanDerWaalsContact C-N 3.3Å; I95-S97 PolarHBondContact O-N 2.83Å; I95-A98 PolarHBondContact O-N 2.7Å; I95-A98 VanDerWaalsContact O-N 3.16Å; I95-I99 HydrophobicContact CG2-CD1 3.7Å; I95-I99 HydrophobicContact CG2-CG1 4.47Å; I95-I99 WeakPolarHBondContact O-CD1 3.33Å; I95-I99 WeakPolarHBondContact O-CG1 3.25Å; I95-I99 PolarHBondContact O-N 2.98Å; I95-V115 HydrophobicContact CG1-CG1 4.22Å; I95-V115 HydrophobicContact CG2-CG1 4.36Å; I95-V117 HydrophobicContact CD1-CG1 4.46Å; I95-W150 HydrophobicContact CB-CH2 3.67Å; I95-W150 HydrophobicContact CB-CZ2 3.94Å; I95-W150 HydrophobicContact CB-CZ3 4.27Å; I95-W150 HydrophobicContact CD1-CH2 3.33Å; I95-W150 HydrophobicContact CD1-CZ2 4.4Å; I95-W150 HydrophobicContact CD1-CZ3 3.59Å; I95-W150 HydrophobicContact CG1-CH2 4.08Å; I95-W150 HydrophobicContact CG1-CZ3 4.47Å; I95-W150 HydrophobicContact CG2-CD2 4.3Å; I95-W150 HydrophobicContact CG2-CE3 4.07Å; I95-W150 HydrophobicContact CG2-CH2 3.49Å; I95-W150 VanDerWaalsContact CG2-CH2 3.49Å; I95-W150 HydrophobicContact CG2-CZ2 3.69Å; I95-W150 HydrophobicContact CG2-CZ3 3.69Å; I95-L170 HydrophobicContact CD1-CD2 3.72Å; I95-L170 HydrophobicContact CD1-CG 3.9Å; I95-L170 HydrophobicContact CG1-CD1 4.48Å; I95-L170 HydrophobicContact CG1-CD2 3.54Å; I95-L170 HydrophobicContact CG1-CG 4.03Å
96	T	60.3	Low	45.5	Very low	32 Å²	32	64.8 Å²	64.8	20%	0.196	44%	0.435	C	S	.	.	H	α-helix	trans	-58.2	-41.2	176.7	-59	0	0	0	0	111.6	N92 I99 S100	N92-T96 VanDerWaalsContact O-CB 3.29Å; N92-T96 WeakPolarHBondContact O-CB 3.49Å; N92-T96 PolarHBondContact O-N 3.12Å; N92-T96 PolarHBondContact O-OG1 2.71Å; T96-I99 PolarHBondContact O-N 3.49Å; T96-S100 WeakPolarHBondContact O-CB 3.19Å; T96-S100 PolarHBondContact O-N 3.46Å; T96-S100 PolarHBondContact O-OG 2.93Å
97	S	56.4	Low	45.6	Very low	65 Å²	65	71 Å²	71	46%	0.455	47%	0.47	S	S	.	.	H	α-helix	trans	-68	-41.2	175.9	-62.1	0	0	0	0	112.1	N93 I95 I99 S100 T101	N93-S97 WeakPolarHBondContact O-CA 3.42Å; N93-S97 WeakPolarHBondContact O-CB 3.49Å; N93-S97 PolarHBondContact O-N 3.1Å; N93-S97 PolarHBondContact O-OG 3.42Å; I95-S97 VanDerWaalsContact C-N 3.3Å; I95-S97 PolarHBondContact O-N 2.83Å; S97-I99 VanDerWaalsContact C-N 3.26Å; S97-I99 PolarHBondContact O-N 3.25Å; S97-S100 PolarHBondContact O-N 3.38Å; S97-T101 WeakPolarHBondContact O-CB 3.29Å; S97-T101 VanDerWaalsContact O-CG2 3.32Å; S97-T101 WeakPolarHBondContact O-CG2 3.41Å; S97-T101 PolarHBondContact O-N 3.11Å; S97-T101 PolarHBondContact O-OG1 3.09Å
98	A	52.1	Low	45.6	Very low	48 Å²	48	72.6 Å²	72.6	40%	0.397	49%	0.49	S	S	.	.	H	α-helix	trans	-63.8	-33.2	175.1	0	0	0	0	0	111.9	A94 I95 V115	A94-A98 WeakPolarHBondContact O-CB 3.21Å; A94-A98 PolarHBondContact O-N 3.12Å; I95-A98 PolarHBondContact O-N 2.7Å; I95-A98 VanDerWaalsContact O-N 3.16Å; A98-V115 HydrophobicContact CB-CG2 4.22Å
99	I	56.1	Low	45.6	Very low	49 Å²	49	77.3 Å²	77.3	25%	0.251	52%	0.519	S	S	.	.	H	α-helix	trans	-72.5	-38.4	174.4	-65.2	162.4	0	0	0	111.5	I95 T96 S97 V141	I95-I99 HydrophobicContact CG2-CD1 3.7Å; I95-I99 HydrophobicContact CG2-CG1 4.47Å; I95-I99 WeakPolarHBondContact O-CD1 3.33Å; I95-I99 WeakPolarHBondContact O-CG1 3.25Å; I95-I99 PolarHBondContact O-N 2.98Å; T96-I99 PolarHBondContact O-N 3.49Å; S97-I99 VanDerWaalsContact C-N 3.26Å; S97-I99 PolarHBondContact O-N 3.25Å; I99-V141 HydrophobicContact CD1-CG1 3.59Å; I99-V141 HydrophobicContact CG1-CG1 4.44Å
100	S	45.4	Very low	45.1	Very low	88 Å²	88	83.7 Å²	83.7	62%	0.615	54%	0.541	S	S	*	.	H	α-helix	trans	-86	-19	-169.2	-56.9	0	0	0	0	115.5	T96 S97 M102	T96-S100 WeakPolarHBondContact O-CB 3.19Å; T96-S100 PolarHBondContact O-N 3.46Å; T96-S100 PolarHBondContact O-OG 2.93Å; S97-S100 PolarHBondContact O-N 3.38Å; S100-M102 PolarHBondContact O-N 3.31Å
101	T	41.2	Very low	45.2	Very low	96 Å²	96	83.4 Å²	83.4	59%	0.589	54%	0.538	S	S	*	.	S	Bend	trans	-89	12	-165.9	43.2	0	0	0	0	116.8	S97	S97-T101 WeakPolarHBondContact O-CB 3.29Å; S97-T101 VanDerWaalsContact O-CG2 3.32Å; S97-T101 WeakPolarHBondContact O-CG2 3.41Å; S97-T101 PolarHBondContact O-N 3.11Å; S97-T101 PolarHBondContact O-OG1 3.09Å
102	M	36.1	Very low	45	Very low	151 Å²	151	91.3 Å²	91.3	74%	0.744	57%	0.566	S	S	*	*			trans	-120.7	97.6	-172.7	-64.9	-91.9	93.6	0	0	112.9	S100	S100-M102 PolarHBondContact O-N 3.31Å
103	S	33.4	Very low	45	Very low	108 Å²	108	94.6 Å²	94.6	76%	0.755	59%	0.589	S	S	*	*			trans	-69.1	141.2	171.7	-55.2	0	0	0	0	112	S105	S103-S105 PolarHBondContact O-N 2.99Å; S103-S105 VanDerWaalsContact O-N 3.15Å
104	P	34.8	Very low	45.7	Very low	136 Å²	136	92.3 Å²	92.3	88%	0.883	58%	0.577	S	S	*	*			trans	-84.4	89.6	174.6	33.1	-29.5	0	0	0	109.6
105	S	32.1	Very low	47.2	Very low	112 Å²	112	90.8 Å²	90.8	78%	0.783	56%	0.562	S	S	*	*			trans	-132.8	102.5	165.9	62.2	0	0	0	0	110.1	S103	S103-S105 PolarHBondContact O-N 2.99Å; S103-S105 VanDerWaalsContact O-N 3.15Å
106	G	35.3	Very low	48.7	Very low	68 Å²	68	93 Å²	93	70%	0.701	57%	0.572	S	S	*	*	S	Bend	trans	148.1	110.4	171.8	0	0	0	0	0	111.9	G108	G106-G108 PolarHBondContact O-N 2.82Å
107	T	33.1	Very low	50.3	Low	160 Å²	160	91.4 Å²	91.4	98%	0.982	56%	0.563	S	S	*	*	S	Bend	trans	-56.2	100	171.4	45.3	0	0	0	0	110.9
108	G	35.5	Very low	51.9	Low	57 Å²	57	92.1 Å²	92.1	59%	0.588	56%	0.556	S	S	*	*	S	Bend	trans	168.5	117.6	173.8	0	0	0	0	0	106.8	G106 Q110	G106-G108 PolarHBondContact O-N 2.82Å; G108-Q110 PolarHBondContact O-N 3.43Å
109	V	36.6	Very low	53.8	Low	158 Å²	158	89.9 Å²	89.9	96%	0.958	54%	0.537	S	S	*	.			trans	-67.9	79.2	175.9	-177.4	0	0	0	0	107.6	A111	V109-A111 PolarHBondContact O-N 3.28Å
110	Q	33	Very low	55.3	Low	183 Å²	183	89.5 Å²	89.5	86%	0.855	54%	0.535	S	S	*	.			trans	-78.7	115.1	163.7	-77.6	-170.3	-9	0	0	106.5	G108 R112	G108-Q110 PolarHBondContact O-N 3.43Å; Q110-R112 PolarHBondContact O-N 2.8Å
111	A	46.7	Very low	57.4	Low	43 Å²	43	86.8 Å²	86.8	36%	0.355	51%	0.511	S	S	.	.			trans	-51.1	126.3	175.9	0	0	0	0	0	109.6	V109 P113	V109-A111 PolarHBondContact O-N 3.28Å; A111-P113 WeakPolarHBondContact O-CD 3.41Å
112	R	48.4	Very low	59.8	Low	193 Å²	193	83.4 Å²	83.4	73%	0.728	49%	0.492	S	S	*	.			trans	-55.8	124.1	176.6	-78.4	-179.1	175.1	178.2	-1.4	108.7	Q110 L114	Q110-R112 PolarHBondContact O-N 2.8Å; R112-L114 PolarHBondContact O-N 2.9Å
113	P	54.4	Low	62.6	Low	93 Å²	93	76.8 Å²	76.8	60%	0.604	46%	0.459	S	S	*	.			trans	-65.3	108.7	171.7	24.9	-29.5	0	0	0	107.9	A111	A111-P113 WeakPolarHBondContact O-CD 3.41Å
114	L	73.4	Confident	65.4	Low	44 Å²	44	78.9 Å²	78.9	23%	0.23	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-81.4	130.9	178.9	-65.8	166	0	0	0	109	R112 Q116 Y140 V141 I142	R112-L114 PolarHBondContact O-N 2.9Å; L114-Q116 PolarHBondContact O-N 2.91Å; L114-Y140 HydrophobicContact CB-CD1 4.01Å; L114-Y140 HydrophobicContact CB-CG 4.34Å; L114-Y140 HydrophobicContact CD1-CG 4.46Å; L114-V141 VanDerWaalsContact CD2-O 3.26Å; L114-V141 WeakPolarHBondContact CD2-O 3.21Å; L114-I142 HydrophobicContact CD2-CB 4.25Å; L114-I142 HydrophobicContact CD2-CG1 3.87Å
115	V	87.6	Confident	68	Low	20 Å²	20	73.4 Å²	73.4	12%	0.121	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	119.6	175.6	179.1	0	0	0	0	108.3	I95 A98 V117 Y140 V141 L170	I95-V115 HydrophobicContact CG1-CG1 4.22Å; I95-V115 HydrophobicContact CG2-CG1 4.36Å; A98-V115 HydrophobicContact CB-CG2 4.22Å; V115-V117 HydrophobicContact CG1-CG1 4.13Å; V115-Y140 WeakPolarHBondContact O-CA 3.39Å; V115-V141 HydrophobicContact CB-CB 4.35Å; V115-V141 PolarHBondContact O-N 2.68Å; V115-L170 HydrophobicContact CG1-CD2 3.49Å; V115-L170 VanDerWaalsContact CG1-CD2 3.49Å
116	Q	91.7	Very high	70.6	Confident	48 Å²	48	71.5 Å²	71.5	22%	0.224	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	125.7	176.6	-167	-176.9	43.1	0	0	109.8	L114 I138 M139 Y140 N171	L114-Q116 PolarHBondContact O-N 2.91Å; Q116-I138 HydrophobicContact CG-CG2 3.63Å; Q116-M139 WeakPolarHBondContact CA-O 3.48Å; Q116-Y140 HydrophobicContact CB-CD1 4.23Å; Q116-Y140 HydrophobicContact CB-CE1 4.06Å; Q116-Y140 HydrophobicContact CG-CD1 4.31Å; Q116-Y140 HydrophobicContact CG-CE1 3.9Å; Q116-Y140 PolarHBondContact NE2-OH 2.96Å; Q116-N171 VanDerWaalsContact CD-ND2 3.33Å; Q116-N171 HydrophobicContact CG-CB 4.06Å; Q116-N171 PolarHBondContact O-N 2.86Å; Q116-N171 PolarHBondContact OE1-ND2 3.26Å
117	V	92.5	Very high	73	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	153.9	177.9	-59.2	0	0	0	0	110.5	I95 V115 M139 V141 I163 V168 C169	I95-V117 HydrophobicContact CD1-CG1 4.46Å; V115-V117 HydrophobicContact CG1-CG1 4.13Å; V117-M139 HydrophobicContact CG2-CB 3.87Å; V117-M139 PolarHBondContact N-O 2.75Å; V117-M139 PolarHBondContact O-N 2.91Å; V117-V141 HydrophobicContact CB-CG2 4.42Å; V117-V141 HydrophobicContact CG1-CG2 3.7Å; V117-V141 HydrophobicContact CG2-CG2 3.81Å; V117-I163 HydrophobicContact CG2-CD1 4.31Å; V117-V168 HydrophobicContact CB-CB 3.96Å; V117-V168 HydrophobicContact CB-CG2 4.07Å; V117-V168 HydrophobicContact CG1-CG2 4.33Å; V117-V168 HydrophobicContact CG2-CB 3.98Å; V117-V168 HydrophobicContact CG2-CG1 4.11Å; V117-V168 HydrophobicContact CG2-CG2 4.06Å; V117-C169 CarbonylContact C-O 3.58Å; V117-C169 WeakPolarHBondContact CA-O 3.3Å; V117-C169 VanDerWaalsContact CB-O 3.31Å; V117-C169 WeakPolarHBondContact CB-O 3.36Å
118	R	91.5	Very high	75.6	Confident	80 Å²	80	72.3 Å²	72.3	30%	0.302	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	134.2	176	173.9	-177	-69.8	-110.8	-2.2	109	I120 D137 I138 V168 C169 N171	R118-I120 PolarHBondContact O-N 2.84Å; R118-D137 CarbonylContact C-O 3.55Å; R118-D137 WeakPolarHBondContact CA-O 3.44Å; R118-I138 HydrophobicContact CB-CD1 3.81Å; R118-I138 HydrophobicContact CG-CD1 4.01Å; R118-V168 CarbonylContact O-C 3.55Å; R118-V168 WeakPolarHBondContact O-CA 3.37Å; R118-C169 PolarHBondContact N-O 2.91Å; R118-C169 PolarHBondContact O-N 2.86Å; R118-N171 HydrophobicContact CB-CB 4.05Å; R118-N171 PolarHBondContact NE-OD1 3.46Å; R118-N171 PolarHBondContact NH2-OD1 2.9Å
119	A	92	Very high	78.3	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	122	172.3	0	0	0	0	0	111	F133 Q134 G136 D137 M139	A119-F133 HydrophobicContact CB-CD2 3.48Å; A119-F133 VanDerWaalsContact CB-CD2 3.48Å; A119-F133 HydrophobicContact CB-CE2 3.75Å; A119-F133 HydrophobicContact CB-CG 4.5Å; A119-Q134 WeakPolarHBondContact CB-O 3.33Å; A119-G136 PolarHBondContact O-N 2.89Å; A119-D137 HydrophobicContact CB-CB 4.36Å; A119-D137 PolarHBondContact N-O 2.95Å; A119-M139 HydrophobicContact CB-CE 3.85Å
120	I	87.8	Confident	81.1	Confident	42 Å²	42	66 Å²	66	22%	0.215	33%	0.327	C	S	.	.	S	Bend	trans	-93.1	-16.8	173.5	51	166.7	0	0	0	112.2	R118 K135 Y167 C169	R118-I120 PolarHBondContact O-N 2.84Å; I120-K135 WeakPolarHBondContact O-CD 3.27Å; I120-K135 VanDerWaalsContact O-CE 3.32Å; I120-K135 WeakPolarHBondContact O-CE 3.19Å; I120-K135 WeakPolarHBondContact O-CG 3.2Å; I120-Y167 VanDerWaalsContact CG1-C 3.49Å; I120-Y167 WeakPolarHBondContact CG1-O 3.43Å; I120-Y167 PolarHBondContact N-O 3.17Å; I120-C169 HydrophobicContact CG2-CB 4.01Å
121	Y	88.5	Confident	84	Confident	30 Å²	30	57.5 Å²	57.5	12%	0.118	29%	0.287	C	S	.	.	S	Bend	trans	-134.4	158.2	171.3	-51	-80.1	0	0	0	110.4	F133 Y167 H279 Y281 R282 P283	Y121-F133 VanDerWaalsContact O-CE2 3.25Å; Y121-F133 WeakPolarHBondContact O-CE2 3.23Å; Y121-Y167 HydrophobicContact CD2-CD1 4.28Å; Y121-Y167 HydrophobicContact CD2-CD2 4.38Å; Y121-Y167 HydrophobicContact CD2-CG 4.15Å; Y121-Y167 HydrophobicContact CG-CD1 4.36Å; Y121-Y167 HydrophobicContact CG-CE1 4.46Å; Y121-H279 HydrophobicContact CE1-CB 3.84Å; Y121-Y281 WeakPolarHBondContact CE1-O 3.28Å; Y121-R282 HydrophobicContact CD1-CG 4.07Å; Y121-P283 HydrophobicContact CD2-CG 4.21Å; Y121-P283 HydrophobicContact CE2-CG 3.7Å; Y121-P283 VanDerWaalsContact CZ-CD 3.48Å
122	S	92.3	Very high	86.4	Confident	26 Å²	26	58.2 Å²	58.2	18%	0.182	29%	0.289	C	S	.	.			trans	-78.3	142.1	166.4	-56.3	0	0	0	0	110.5	F133 Q134 K135 R282	S122-F133 CarbonylContact C-O 3.49Å; S122-F133 WeakPolarHBondContact CA-O 3.47Å; S122-Q134 PolarHBondContact OG-OE1 2.88Å; S122-K135 PolarHBondContact OG-N 3.21Å; S122-R282 PolarHBondContact O-NH1 3.27Å
123	Y	93.2	Very high	88.7	Confident	12 Å²	12	49.2 Å²	49.2	5%	0.047	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-130.6	132	178.6	178.6	-115.4	0	0	0	111	D130 L131 S132 F133 W149 P164 Y167 V285	Y123-D130 HydrophobicContact CE1-CB 4.2Å; Y123-D130 PolarHBondContact OH-OD2 2.92Å; Y123-L131 WeakPolarHBondContact CD1-O 3.25Å; Y123-S132 WeakPolarHBondContact O-CA 3.45Å; Y123-F133 HydrophobicContact CD1-CD1 4.21Å; Y123-F133 AromaticContact CD1-CE1 3.61Å; Y123-F133 HydrophobicContact CD1-CE1 3.61Å; Y123-F133 HydrophobicContact CD1-CZ 4.12Å; Y123-F133 AromaticContact CG-CE1 3.98Å; Y123-F133 HydrophobicContact CG-CE1 3.98Å; Y123-F133 HydrophobicContact CG-CZ 4.02Å; Y123-F133 PolarHBondContact N-O 2.63Å; Y123-F133 PolarHBondContact O-N 2.86Å; Y123-F133 VanDerWaalsContact O-O 3.1Å; Y123-W149 HydrophobicContact CE1-CZ3 4.46Å; Y123-W149 WeakPolarHBondContact OH-CH2 3.24Å; Y123-P164 HydrophobicContact CD1-CG 4.09Å; Y123-P164 HydrophobicContact CD2-CG 3.86Å; Y123-P164 HydrophobicContact CE1-CG 4.23Å; Y123-P164 HydrophobicContact CE2-CG 4.04Å; Y123-P164 HydrophobicContact CG-CG 3.91Å; Y123-Y167 HydrophobicContact CD2-CD1 4.4Å; Y123-Y167 HydrophobicContact CD2-CE1 4.29Å; Y123-Y167 HydrophobicContact CG-CD1 4.47Å; Y123-V285 HydrophobicContact CD2-CG2 4.35Å; Y123-V285 HydrophobicContact CE2-CG1 4.34Å; Y123-V285 HydrophobicContact CE2-CG2 4.19Å
124	Q	92.6	Very high	90.7	Very high	152 Å²	152	50.4 Å²	50.4	71%	0.71	25%	0.253	S	S	*	.			trans	-108.1	118	171.7	-177.1	174.1	4.8	0	0	107.9
125	G	90.4	Very high	91.5	Very high	21 Å²	21	52.2 Å²	52.2	22%	0.216	26%	0.259	C	S	.	.			trans	-57.3	139.7	179.9	0	0	0	0	0	112.2	D130 S132	G125-D130 VanDerWaalsContact CA-CB 3.49Å; G125-S132 PolarHBondContact N-OG 2.85Å
126	H	85.7	Confident	91.6	Very high	71 Å²	71	52.6 Å²	52.6	33%	0.329	27%	0.267	S	S	.	.	S	Bend	trans	-105.3	-26.2	177.3	-64.7	-55.8	0	0	0	112	D130 W316 V320	H126-D130 PolarHBondContact N-OD2 3.1Å; H126-W316 HydrophobicContact CB-CH2 3.88Å; H126-W316 HydrophobicContact CB-CZ3 3.93Å; H126-W316 AromaticContact CD2-CZ3 3.76Å; H126-W316 AromaticContact CG-CZ3 3.88Å; H126-V320 WeakPolarHBondContact NE2-CG2 3.49Å
127	N	86.3	Confident	91.7	Very high	42 Å²	42	52 Å²	52	23%	0.225	27%	0.265	C	S	.	.	S	Bend	trans	-99.7	158.8	172.4	-45.9	-69.2	0	0	0	110.5	D129 D130 R288	N127-D129 PolarHBondContact O-N 2.9Å; N127-D130 PolarHBondContact N-OD2 2.87Å; N127-D130 PolarHBondContact ND2-OD1 3.13Å; N127-D130 VanDerWaalsContact ND2-OD1 3.09Å; N127-D130 PolarHBondContact ND2-OD2 3.31Å; N127-D130 WeakPolarHBondContact O-CB 3.24Å; N127-D130 PolarHBondContact O-N 3.32Å; N127-R288 PolarHBondContact ND2-NE 3.4Å; N127-R288 VanDerWaalsContact ND2-NE 3.11Å
128	Q	87.5	Confident	91.9	Very high	204 Å²	204	53.4 Å²	53.4	95%	0.953	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-27.4	-175.2	-170.4	174.4	6.7	0	0	113.5
129	D	92.9	Very high	92.1	Very high	68 Å²	68	49.6 Å²	49.6	36%	0.364	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	10.9	-179	58	-30.3	0	0	0	113	N127 G161 Y162 R288	N127-D129 PolarHBondContact O-N 2.9Å; D129-G161 CarbonylContact O-C 3.51Å; D129-G161 WeakPolarHBondContact O-CA 3.48Å; D129-Y162 HydrophobicContact CB-CD2 4.45Å; D129-Y162 PolarHBondContact O-N 3.43Å; D129-Y162 WeakPolarHBondContact OD2-CE2 3.33Å; D129-R288 IonicContact OD1-CZ 3.42Å; D129-R288 IonicContact OD1-NH1 3.01Å; D129-R288 PolarHBondContact OD1-NH1 2.99Å; D129-R288 VanDerWaalsContact OD1-NH1 3.09Å; D129-R288 IonicContact OD1-NH2 2.65Å; D129-R288 PolarHBondContact OD1-NH2 3.12Å; D129-R288 IonicContact OD2-CZ 3.19Å; D129-R288 IonicContact OD2-NH1 3.49Å; D129-R288 PolarHBondContact OD2-NH1 3.11Å; D129-R288 IonicContact OD2-NH2 3.35Å; D129-R288 PolarHBondContact OD2-NH2 3.39Å
130	D	93.8	Very high	92.2	Very high	15 Å²	15	51.2 Å²	51.2	8%	0.08	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-74.5	139.2	167	-68.2	-12.8	0	0	0	110.1	Y123 G125 H126 N127 Y162 R288	Y123-D130 HydrophobicContact CE1-CB 4.2Å; Y123-D130 PolarHBondContact OH-OD2 2.92Å; G125-D130 VanDerWaalsContact CA-CB 3.49Å; H126-D130 PolarHBondContact N-OD2 3.1Å; N127-D130 PolarHBondContact N-OD2 2.87Å; N127-D130 PolarHBondContact ND2-OD1 3.13Å; N127-D130 VanDerWaalsContact ND2-OD1 3.09Å; N127-D130 PolarHBondContact ND2-OD2 3.31Å; N127-D130 WeakPolarHBondContact O-CB 3.24Å; N127-D130 PolarHBondContact O-N 3.32Å; D130-Y162 WeakPolarHBondContact CA-O 3.31Å; D130-R288 IonicContact OD1-NE 3.09Å
131	L	95.7	Very high	92.5	Very high	4 Å²	4	49.4 Å²	49.4	2%	0.021	26%	0.255	C	S	.	.			trans	-88.8	114.3	171.6	178.4	63.2	0	0	0	109.1	Y123 F133 M139 H154 M159 Y162 I163	Y123-L131 WeakPolarHBondContact CD1-O 3.25Å; L131-F133 VanDerWaalsContact O-CD1 3.23Å; L131-F133 WeakPolarHBondContact O-CD1 3.25Å; L131-M139 HydrophobicContact CD2-CG 4.42Å; L131-M139 HydrophobicContact CD2-SD 4Å; L131-H154 HydrophobicContact CD1-CB 4.38Å; L131-H154 HydrophobicContact CD2-CB 4.22Å; L131-M159 HydrophobicContact CD1-CB 3.91Å; L131-M159 HydrophobicContact CD1-CE 4Å; L131-Y162 PolarHBondContact N-O 2.95Å; L131-I163 HydrophobicContact CB-CG2 3.79Å; L131-I163 HydrophobicContact CD2-CG2 3.94Å; L131-I163 HydrophobicContact CG-CG2 4.19Å
132	S	96.1	Very high	92.6	Very high	57 Å²	57	50.1 Å²	50.1	40%	0.399	26%	0.261	S	S	.	.			trans	-78.1	141.8	170.6	-60.2	0	0	0	0	110.9	Y123 G125	Y123-S132 WeakPolarHBondContact O-CA 3.45Å; G125-S132 PolarHBondContact N-OG 2.85Å
133	F	96.4	Very high	92.3	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.018	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-152	159.4	-179.1	54.6	-95.1	0	0	0	111.9	A119 Y121 S122 Y123 L131 D137 M139 I163 P164 Y167 V168	A119-F133 HydrophobicContact CB-CD2 3.48Å; A119-F133 VanDerWaalsContact CB-CD2 3.48Å; A119-F133 HydrophobicContact CB-CE2 3.75Å; A119-F133 HydrophobicContact CB-CG 4.5Å; Y121-F133 VanDerWaalsContact O-CE2 3.25Å; Y121-F133 WeakPolarHBondContact O-CE2 3.23Å; S122-F133 CarbonylContact C-O 3.49Å; S122-F133 WeakPolarHBondContact CA-O 3.47Å; Y123-F133 HydrophobicContact CD1-CD1 4.21Å; Y123-F133 AromaticContact CD1-CE1 3.61Å; Y123-F133 HydrophobicContact CD1-CE1 3.61Å; Y123-F133 HydrophobicContact CD1-CZ 4.12Å; Y123-F133 AromaticContact CG-CE1 3.98Å; Y123-F133 HydrophobicContact CG-CE1 3.98Å; Y123-F133 HydrophobicContact CG-CZ 4.02Å; Y123-F133 PolarHBondContact N-O 2.63Å; Y123-F133 PolarHBondContact O-N 2.86Å; Y123-F133 VanDerWaalsContact O-O 3.1Å; L131-F133 VanDerWaalsContact O-CD1 3.23Å; L131-F133 WeakPolarHBondContact O-CD1 3.25Å; F133-D137 HydrophobicContact CB-CB 4.28Å; F133-M139 HydrophobicContact CB-CE 4.27Å; F133-M139 HydrophobicContact CB-SD 4.13Å; F133-M139 HydrophobicContact CD1-CE 4Å; F133-M139 HydrophobicContact CD1-SD 3.74Å; F133-M139 HydrophobicContact CD2-CE 3.9Å; F133-M139 HydrophobicContact CE1-CE 4.3Å; F133-M139 HydrophobicContact CE1-SD 4.29Å; F133-M139 HydrophobicContact CE2-CE 4.17Å; F133-M139 HydrophobicContact CG-CE 3.8Å; F133-M139 HydrophobicContact CG-SD 3.93Å; F133-M139 HydrophobicContact CZ-CE 4.36Å; F133-I163 HydrophobicContact CD1-CG2 3.84Å; F133-I163 HydrophobicContact CE1-CB 3.75Å; F133-I163 HydrophobicContact CE1-CG2 3.51Å; F133-I163 HydrophobicContact CZ-CB 4.44Å; F133-P164 HydrophobicContact CZ-CG 4.46Å; F133-Y167 HydrophobicContact CE2-CD1 4.48Å; F133-Y167 HydrophobicContact CZ-CD1 4.46Å; F133-V168 HydrophobicContact CZ-CG1 4.46Å
134	Q	95.8	Very high	91.5	Very high	119 Å²	119	52.5 Å²	52.5	56%	0.556	29%	0.286	S	S	*	.			trans	-99	155.4	173.4	-61.4	-55.9	-34.8	0	0	111.6	A119 S122 G136 D137	A119-Q134 WeakPolarHBondContact CB-O 3.33Å; S122-Q134 PolarHBondContact OG-OE1 2.88Å; Q134-G136 PolarHBondContact O-N 2.85Å; Q134-D137 PolarHBondContact N-OD2 3.05Å; Q134-D137 VanDerWaalsContact O-CB 3.27Å; Q134-D137 WeakPolarHBondContact O-CB 3.41Å; Q134-D137 VanDerWaalsContact O-CG 3.24Å; Q134-D137 PolarHBondContact O-N 3.17Å; Q134-D137 VanDerWaalsContact O-N 3.1Å
135	K	90.8	Very high	90.4	Very high	81 Å²	81	49.7 Å²	49.7	35%	0.352	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	130.8	170.1	-179.2	177.1	-179.3	-172.3	0	109.9	I120 S122 D179	I120-K135 WeakPolarHBondContact O-CD 3.27Å; I120-K135 VanDerWaalsContact O-CE 3.32Å; I120-K135 WeakPolarHBondContact O-CE 3.19Å; I120-K135 WeakPolarHBondContact O-CG 3.2Å; S122-K135 PolarHBondContact OG-N 3.21Å; K135-D179 WeakPolarHBondContact CE-OD1 3.25Å; K135-D179 IonicContact NZ-OD1 3.45Å; K135-D179 PolarHBondContact NZ-OD1 2.89Å
136	G	89.9	Confident	89.7	Confident	28 Å²	28	51.1 Å²	51.1	29%	0.289	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.1	-16.4	-178.8	0	0	0	0	0	114.4	A119 Q134	A119-G136 PolarHBondContact O-N 2.89Å; Q134-G136 PolarHBondContact O-N 2.85Å
137	D	95.1	Very high	89.3	Confident	36 Å²	36	52.3 Å²	52.3	19%	0.193	29%	0.289	C	S	.	.			trans	-59.9	143.6	179.2	-71.1	-6.8	0	0	0	111.2	R118 A119 F133 Q134 H154	R118-D137 CarbonylContact C-O 3.55Å; R118-D137 WeakPolarHBondContact CA-O 3.44Å; A119-D137 HydrophobicContact CB-CB 4.36Å; A119-D137 PolarHBondContact N-O 2.95Å; F133-D137 HydrophobicContact CB-CB 4.28Å; Q134-D137 PolarHBondContact N-OD2 3.05Å; Q134-D137 VanDerWaalsContact O-CB 3.27Å; Q134-D137 WeakPolarHBondContact O-CB 3.41Å; Q134-D137 VanDerWaalsContact O-CG 3.24Å; Q134-D137 PolarHBondContact O-N 3.17Å; Q134-D137 VanDerWaalsContact O-N 3.1Å; D137-H154 VanDerWaalsContact CG-NE2 3.34Å; D137-H154 IonicContact OD2-CD2 2.7Å; D137-H154 IonicContact OD2-NE2 3.6Å; D137-H154 PolarHBondContact OD2-NE2 2.94Å; D137-H154 VanDerWaalsContact OD2-NE2 3.12Å
138	I	94.9	Very high	89.3	Confident	30 Å²	30	51 Å²	51	15%	0.154	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	133.4	178.9	-58.7	-58.1	0	0	0	109.3	Q116 R118 A155 N171	Q116-I138 HydrophobicContact CG-CG2 3.63Å; R118-I138 HydrophobicContact CB-CD1 3.81Å; R118-I138 HydrophobicContact CG-CD1 4.01Å; I138-A155 HydrophobicContact CB-CB 4.07Å; I138-A155 HydrophobicContact CG2-CB 4.06Å; I138-A155 WeakPolarHBondContact O-CB 3.28Å; I138-A155 PolarHBondContact O-N 3.31Å; I138-N171 HydrophobicContact CD1-CB 4.47Å
139	M	96.3	Very high	89.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	156.4	-179	-67.9	168.6	-78.5	0	0	110.7	Q116 V117 A119 L131 F133 A152 R153 I163 V168	Q116-M139 WeakPolarHBondContact CA-O 3.48Å; V117-M139 HydrophobicContact CG2-CB 3.87Å; V117-M139 PolarHBondContact N-O 2.75Å; V117-M139 PolarHBondContact O-N 2.91Å; A119-M139 HydrophobicContact CB-CE 3.85Å; L131-M139 HydrophobicContact CD2-CG 4.42Å; L131-M139 HydrophobicContact CD2-SD 4Å; F133-M139 HydrophobicContact CB-CE 4.27Å; F133-M139 HydrophobicContact CB-SD 4.13Å; F133-M139 HydrophobicContact CD1-CE 4Å; F133-M139 HydrophobicContact CD1-SD 3.74Å; F133-M139 HydrophobicContact CD2-CE 3.9Å; F133-M139 HydrophobicContact CE1-CE 4.3Å; F133-M139 HydrophobicContact CE1-SD 4.29Å; F133-M139 HydrophobicContact CE2-CE 4.17Å; F133-M139 HydrophobicContact CG-CE 3.8Å; F133-M139 HydrophobicContact CG-SD 3.93Å; F133-M139 HydrophobicContact CZ-CE 4.36Å; M139-A152 HydrophobicContact CB-CB 4.3Å; M139-R153 CarbonylContact C-O 3.56Å; M139-R153 WeakPolarHBondContact CA-O 3.26Å; M139-I163 HydrophobicContact CE-CD1 4.44Å; M139-I163 HydrophobicContact SD-CD1 4.17Å; M139-I163 HydrophobicContact SD-CG2 3.9Å; M139-V168 HydrophobicContact CE-CG1 3.59Å
140	Y	95	Very high	89.4	Confident	34 Å²	34	38.3 Å²	38.3	13%	0.133	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	115.1	176.1	-66.8	-75.8	0	0	0	109	L114 V115 Q116 I142 A152 R153 A155	L114-Y140 HydrophobicContact CB-CD1 4.01Å; L114-Y140 HydrophobicContact CB-CG 4.34Å; L114-Y140 HydrophobicContact CD1-CG 4.46Å; V115-Y140 WeakPolarHBondContact O-CA 3.39Å; Q116-Y140 HydrophobicContact CB-CD1 4.23Å; Q116-Y140 HydrophobicContact CB-CE1 4.06Å; Q116-Y140 HydrophobicContact CG-CD1 4.31Å; Q116-Y140 HydrophobicContact CG-CE1 3.9Å; Q116-Y140 PolarHBondContact NE2-OH 2.96Å; Y140-I142 PolarHBondContact O-N 2.73Å; Y140-A152 CarbonylContact O-C 3.49Å; Y140-A152 VanDerWaalsContact O-CA 3.24Å; Y140-A152 WeakPolarHBondContact O-CA 3.47Å; Y140-R153 PolarHBondContact N-O 2.91Å; Y140-R153 PolarHBondContact O-N 3.43Å; Y140-A155 HydrophobicContact CD2-CB 4.24Å; Y140-A155 HydrophobicContact CE2-CB 3.69Å
141	V	92.5	Very high	89.4	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.018	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	124.5	177.7	-177.1	0	0	0	0	109.2	I99 L114 V115 V117 W150	I99-V141 HydrophobicContact CD1-CG1 3.59Å; I99-V141 HydrophobicContact CG1-CG1 4.44Å; L114-V141 VanDerWaalsContact CD2-O 3.26Å; L114-V141 WeakPolarHBondContact CD2-O 3.21Å; V115-V141 HydrophobicContact CB-CB 4.35Å; V115-V141 PolarHBondContact O-N 2.68Å; V117-V141 HydrophobicContact CB-CG2 4.42Å; V117-V141 HydrophobicContact CG1-CG2 3.7Å; V117-V141 HydrophobicContact CG2-CG2 3.81Å; V141-W150 HydrophobicContact CG1-CB 3.94Å; V141-W150 HydrophobicContact CG1-CD2 4.43Å; V141-W150 HydrophobicContact CG1-CE3 4.43Å; V141-W150 HydrophobicContact CG1-CG 4.27Å; V141-W150 HydrophobicContact CG2-CE3 3.93Å
142	I	91.2	Very high	89.4	Confident	46 Å²	46	39.5 Å²	39.5	24%	0.236	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-44.3	-177.4	-61.8	169.6	0	0	0	110.7	L114 Y140 F151 R153	L114-I142 HydrophobicContact CD2-CB 4.25Å; L114-I142 HydrophobicContact CD2-CG1 3.87Å; Y140-I142 PolarHBondContact O-N 2.73Å; I142-F151 HydrophobicContact CB-CD1 4.23Å; I142-F151 HydrophobicContact CD1-CD1 4.09Å; I142-F151 HydrophobicContact CD1-CE1 4.19Å; I142-F151 PolarHBondContact N-O 3.24Å; I142-R153 HydrophobicContact CD1-CB 3.91Å
143	S	87.1	Confident	89.4	Confident	47 Å²	47	39 Å²	39	33%	0.329	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	160.2	-179.5	55.4	0	0	0	0	111.1	F151	S143-F151 PolarHBondContact N-O 2.92Å; S143-F151 PolarHBondContact O-N 3.11Å
144	G	76.3	Confident	89.5	Confident	41 Å²	41	39.2 Å²	39.2	42%	0.423	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	142.3	171.3	0	0	0	0	0	111.8
145	M	69	Low	89.5	Confident	92 Å²	92	35.3 Å²	35.3	45%	0.453	21%	0.205	S	C	.	.	S	Bend	trans	-92.1	-38.9	164.6	172.8	-178.3	151.3	0	0	110.6	W149 Y162 R288	M145-W149 PolarHBondContact N-O 3.18Å; M145-Y162 HydrophobicContact CB-CD1 4.39Å; M145-Y162 HydrophobicContact CB-CE1 3.82Å; M145-Y162 HydrophobicContact SD-CE1 4.18Å; M145-R288 HydrophobicContact CE-CB 4.41Å
146	S	75.7	Confident	89.7	Confident	52 Å²	52	37.8 Å²	37.8	36%	0.364	22%	0.222	S	C	.	.	S	Bend	trans	-152.7	-179.6	175	64.7	0	0	0	0	109.6	A148 W149 W150	S146-A148 PolarHBondContact O-N 2.82Å; S146-A148 PolarHBondContact OG-N 2.82Å; S146-W149 PolarHBondContact N-O 3.36Å; S146-W149 PolarHBondContact O-N 2.91Å; S146-W149 PolarHBondContact OG-N 3.35Å; S146-W150 PolarHBondContact O-NE1 2.91Å
147	D	77.6	Confident	90	Very high	96 Å²	96	40.4 Å²	40.4	51%	0.513	23%	0.233	S	C	.	.	S	Bend	trans	-63.2	-23.2	172.5	-64.4	-34.1	0	0	0	112.7	S165	D147-S165 WeakPolarHBondContact O-CB 3.47Å; D147-S165 PolarHBondContact O-OG 3.01Å
148	A	84.9	Confident	89.9	Confident	14 Å²	14	40.8 Å²	40.8	12%	0.116	25%	0.246	C	C	.	.	S	Bend	trans	-93.2	-24.5	-178.7	0	0	0	0	0	113.8	S146 P164 S165	S146-A148 PolarHBondContact O-N 2.82Å; S146-A148 PolarHBondContact OG-N 2.82Å; A148-P164 WeakPolarHBondContact O-CA 3.11Å; A148-S165 WeakPolarHBondContact CA-OG 3.42Å; A148-S165 PolarHBondContact O-N 2.83Å; A148-S165 PolarHBondContact O-OG 2.96Å
149	W	90	Very high	90	Very high	6 Å²	6	44.5 Å²	44.5	2%	0.023	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	122.4	-170.5	-70.6	96.4	0	0	0	112.4	Y123 M145 S146 V285 Q286 F287 R288	Y123-W149 HydrophobicContact CE1-CZ3 4.46Å; Y123-W149 WeakPolarHBondContact OH-CH2 3.24Å; M145-W149 PolarHBondContact N-O 3.18Å; S146-W149 PolarHBondContact N-O 3.36Å; S146-W149 PolarHBondContact O-N 2.91Å; S146-W149 PolarHBondContact OG-N 3.35Å; W149-V285 HydrophobicContact CH2-CG1 3.72Å; W149-V285 HydrophobicContact CZ2-CG1 3.45Å; W149-V285 VanDerWaalsContact CZ2-CG1 3.45Å; W149-Q286 WeakPolarHBondContact CZ2-O 3.36Å; W149-Q286 PolarHBondContact NE1-O 3.16Å; W149-Q286 VanDerWaalsContact NE1-O 3.11Å; W149-F287 PolarHBondContact NE1-O 2.73Å; W149-R288 HydrophobicContact CD2-CG 3.68Å; W149-R288 VanDerWaalsContact CE2-CG 3.48Å; W149-R288 HydrophobicContact CE3-CG 4.06Å; W149-R288 HydrophobicContact CG-CG 4.14Å; W149-R288 HydrophobicContact CH2-CG 3.98Å; W149-R288 HydrophobicContact CZ2-CG 3.63Å; W149-R288 HydrophobicContact CZ3-CG 4.19Å
150	W	92.9	Very high	90	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	145	179.2	-60.1	-20.6	0	0	0	111.3	N92 I95 V141 S146 Y162 I163 S165 V168	N92-W150 HydrophobicContact CB-CZ2 4.28Å; N92-W150 WeakPolarHBondContact OD1-CH2 3.35Å; I95-W150 HydrophobicContact CB-CH2 3.67Å; I95-W150 HydrophobicContact CB-CZ2 3.94Å; I95-W150 HydrophobicContact CB-CZ3 4.27Å; I95-W150 HydrophobicContact CD1-CH2 3.33Å; I95-W150 HydrophobicContact CD1-CZ2 4.4Å; I95-W150 HydrophobicContact CD1-CZ3 3.59Å; I95-W150 HydrophobicContact CG1-CH2 4.08Å; I95-W150 HydrophobicContact CG1-CZ3 4.47Å; I95-W150 HydrophobicContact CG2-CD2 4.3Å; I95-W150 HydrophobicContact CG2-CE3 4.07Å; I95-W150 HydrophobicContact CG2-CH2 3.49Å; I95-W150 VanDerWaalsContact CG2-CH2 3.49Å; I95-W150 HydrophobicContact CG2-CZ2 3.69Å; I95-W150 HydrophobicContact CG2-CZ3 3.69Å; V141-W150 HydrophobicContact CG1-CB 3.94Å; V141-W150 HydrophobicContact CG1-CD2 4.43Å; V141-W150 HydrophobicContact CG1-CE3 4.43Å; V141-W150 HydrophobicContact CG1-CG 4.27Å; V141-W150 HydrophobicContact CG2-CE3 3.93Å; S146-W150 PolarHBondContact O-NE1 2.91Å; W150-Y162 CarbonylContact O-C 3.54Å; W150-Y162 VanDerWaalsContact O-CA 3.31Å; W150-Y162 WeakPolarHBondContact O-CA 3.49Å; W150-I163 HydrophobicContact CB-CG1 4.18Å; W150-I163 PolarHBondContact N-O 3.28Å; W150-I163 WeakPolarHBondContact O-CG1 3.49Å; W150-I163 PolarHBondContact O-N 3.47Å; W150-S165 VanDerWaalsContact CE2-CB 3.42Å; W150-S165 VanDerWaalsContact CZ2-CB 3.46Å; W150-V168 HydrophobicContact CE3-CG2 4.1Å; W150-V168 HydrophobicContact CZ3-CG2 3.72Å
151	F	94	Very high	90	Very high	43 Å²	43	45.7 Å²	45.7	19%	0.189	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	121.7	171.1	-163.6	-102.7	0	0	0	109.1	I142 S143 Y162	I142-F151 HydrophobicContact CB-CD1 4.23Å; I142-F151 HydrophobicContact CD1-CD1 4.09Å; I142-F151 HydrophobicContact CD1-CE1 4.19Å; I142-F151 PolarHBondContact N-O 3.24Å; S143-F151 PolarHBondContact N-O 2.92Å; S143-F151 PolarHBondContact O-N 3.11Å; F151-Y162 HydrophobicContact CB-CD1 4.13Å; F151-Y162 HydrophobicContact CB-CE1 3.93Å; F151-Y162 AromaticContact CD2-CD1 3.97Å; F151-Y162 HydrophobicContact CD2-CD1 3.97Å; F151-Y162 AromaticContact CD2-CD2 3.98Å; F151-Y162 HydrophobicContact CD2-CD2 3.98Å; F151-Y162 AromaticContact CD2-CE1 3.82Å; F151-Y162 HydrophobicContact CD2-CE1 3.82Å; F151-Y162 AromaticContact CD2-CE2 3.86Å; F151-Y162 HydrophobicContact CD2-CE2 3.86Å; F151-Y162 HydrophobicContact CD2-CG 4.06Å; F151-Y162 AromaticContact CD2-CZ 3.78Å; F151-Y162 HydrophobicContact CE2-CD2 4.38Å; F151-Y162 HydrophobicContact CE2-CE2 4.22Å; F151-Y162 HydrophobicContact CG-CE1 4.35Å
152	A	95.6	Very high	90.2	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	163.8	-174.8	0	0	0	0	0	111.9	M139 Y140 S160 G161 I163	M139-A152 HydrophobicContact CB-CB 4.3Å; Y140-A152 CarbonylContact O-C 3.49Å; Y140-A152 VanDerWaalsContact O-CA 3.24Å; Y140-A152 WeakPolarHBondContact O-CA 3.47Å; A152-S160 WeakPolarHBondContact O-CA 3.36Å; A152-G161 PolarHBondContact N-O 2.88Å; A152-G161 PolarHBondContact O-N 2.98Å; A152-I163 HydrophobicContact CB-CD1 3.53Å; A152-I163 HydrophobicContact CB-CG1 3.83Å; A152-I163 HydrophobicContact CB-CG2 4.22Å
153	R	96.8	Very high	90.3	Very high	46 Å²	46	46 Å²	46	17%	0.174	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	127.5	171.6	-176.6	174.5	64.1	-169.5	-1.8	110	M139 Y140 I142 G158 M159 S160	M139-R153 CarbonylContact C-O 3.56Å; M139-R153 WeakPolarHBondContact CA-O 3.26Å; Y140-R153 PolarHBondContact N-O 2.91Å; Y140-R153 PolarHBondContact O-N 3.43Å; I142-R153 HydrophobicContact CD1-CB 3.91Å; R153-G158 WeakPolarHBondContact CG-O 3.44Å; R153-M159 CarbonylContact C-O 3.54Å; R153-M159 VanDerWaalsContact CA-O 3.32Å; R153-M159 WeakPolarHBondContact CA-O 3.44Å; R153-S160 WeakPolarHBondContact CB-OG 3.4Å; R153-S160 WeakPolarHBondContact CG-OG 3.16Å
154	H	97.5	Very high	90.6	Very high	9 Å²	9	43.8 Å²	43.8	4%	0.042	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	132.1	173.9	-165.7	-63.8	0	0	0	110.6	L131 D137 D156 T157 G158 M159	L131-H154 HydrophobicContact CD1-CB 4.38Å; L131-H154 HydrophobicContact CD2-CB 4.22Å; D137-H154 VanDerWaalsContact CG-NE2 3.34Å; D137-H154 IonicContact OD2-CD2 2.7Å; D137-H154 IonicContact OD2-NE2 3.6Å; D137-H154 PolarHBondContact OD2-NE2 2.94Å; D137-H154 VanDerWaalsContact OD2-NE2 3.12Å; H154-D156 IonicContact CE1-OD2 3.16Å; H154-D156 PolarHBondContact ND1-N 3.19Å; H154-T157 VanDerWaalsContact CB-OG1 3.25Å; H154-T157 WeakPolarHBondContact CB-OG1 3.5Å; H154-T157 VanDerWaalsContact CG-OG1 3.32Å; H154-T157 PolarHBondContact ND1-N 2.73Å; H154-G158 WeakPolarHBondContact O-CA 3.36Å; H154-G158 PolarHBondContact O-N 3.49Å; H154-G158 VanDerWaalsContact O-N 3.09Å; H154-M159 PolarHBondContact N-O 2.75Å
155	A	95.8	Very high	91.3	Very high	38 Å²	38	42 Å²	42	31%	0.314	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-47.3	-176.2	0	0	0	0	0	112.1	I138 Y140	I138-A155 HydrophobicContact CB-CB 4.07Å; I138-A155 HydrophobicContact CG2-CB 4.06Å; I138-A155 WeakPolarHBondContact O-CB 3.28Å; I138-A155 PolarHBondContact O-N 3.31Å; Y140-A155 HydrophobicContact CD2-CB 4.24Å; Y140-A155 HydrophobicContact CE2-CB 3.69Å
156	D	95.4	Very high	92.2	Very high	133 Å²	133	39.3 Å²	39.3	71%	0.711	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-45.5	-175.5	-54.7	-41.6	0	0	0	114.2	H154	H154-D156 IonicContact CE1-OD2 3.16Å; H154-D156 PolarHBondContact ND1-N 3.19Å
157	T	95.9	Very high	92.9	Very high	82 Å²	82	37.7 Å²	37.7	50%	0.503	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-17	-176.1	67.4	0	0	0	0	113.4	H154 M159	H154-T157 VanDerWaalsContact CB-OG1 3.25Å; H154-T157 WeakPolarHBondContact CB-OG1 3.5Å; H154-T157 VanDerWaalsContact CG-OG1 3.32Å; H154-T157 PolarHBondContact ND1-N 2.73Å; T157-M159 PolarHBondContact O-N 3.25Å; T157-M159 VanDerWaalsContact O-N 3.12Å; T157-M159 PolarHBondContact OG1-N 3.26Å
158	G	94.4	Very high	93.5	Very high	45 Å²	45	33.5 Å²	33.5	46%	0.464	19%	0.192	S	C	.	.			trans	69.5	-2.1	-175	0	0	0	0	0	114.8	R153 H154	R153-G158 WeakPolarHBondContact CG-O 3.44Å; H154-G158 WeakPolarHBondContact O-CA 3.36Å; H154-G158 PolarHBondContact O-N 3.49Å; H154-G158 VanDerWaalsContact O-N 3.09Å
159	M	96.3	Very high	93.7	Very high	107 Å²	107	33.1 Å²	33.1	53%	0.527	19%	0.188	S	C	.	.			trans	-67.4	147.4	178.5	-61.9	-164.4	-43.2	0	0	111.1	L131 R153 H154 T157	L131-M159 HydrophobicContact CD1-CB 3.91Å; L131-M159 HydrophobicContact CD1-CE 4Å; R153-M159 CarbonylContact C-O 3.54Å; R153-M159 VanDerWaalsContact CA-O 3.32Å; R153-M159 WeakPolarHBondContact CA-O 3.44Å; H154-M159 PolarHBondContact N-O 2.75Å; T157-M159 PolarHBondContact O-N 3.25Å; T157-M159 VanDerWaalsContact O-N 3.12Å; T157-M159 PolarHBondContact OG1-N 3.26Å
160	S	95.8	Very high	93.6	Very high	58 Å²	58	34.2 Å²	34.2	41%	0.406	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	148.9	176.6	-65.6	0	0	0	0	111.6	A152 R153	A152-S160 WeakPolarHBondContact O-CA 3.36Å; R153-S160 WeakPolarHBondContact CB-OG 3.4Å; R153-S160 WeakPolarHBondContact CG-OG 3.16Å
161	G	96.1	Very high	93.2	Very high	1 Å²	1	36 Å²	36	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.4	-179.5	178.5	0	0	0	0	0	111.4	D129 A152	D129-G161 CarbonylContact O-C 3.51Å; D129-G161 WeakPolarHBondContact O-CA 3.48Å; A152-G161 PolarHBondContact N-O 2.88Å; A152-G161 PolarHBondContact O-N 2.98Å
162	Y	95.1	Very high	92.6	Very high	55 Å²	55	36.2 Å²	36.2	22%	0.216	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	138.7	179.1	-69.1	-78.6	0	0	0	112.2	D129 D130 L131 M145 W150 F151	D129-Y162 HydrophobicContact CB-CD2 4.45Å; D129-Y162 PolarHBondContact O-N 3.43Å; D129-Y162 WeakPolarHBondContact OD2-CE2 3.33Å; D130-Y162 WeakPolarHBondContact CA-O 3.31Å; L131-Y162 PolarHBondContact N-O 2.95Å; M145-Y162 HydrophobicContact CB-CD1 4.39Å; M145-Y162 HydrophobicContact CB-CE1 3.82Å; M145-Y162 HydrophobicContact SD-CE1 4.18Å; W150-Y162 CarbonylContact O-C 3.54Å; W150-Y162 VanDerWaalsContact O-CA 3.31Å; W150-Y162 WeakPolarHBondContact O-CA 3.49Å; F151-Y162 HydrophobicContact CB-CD1 4.13Å; F151-Y162 HydrophobicContact CB-CE1 3.93Å; F151-Y162 AromaticContact CD2-CD1 3.97Å; F151-Y162 HydrophobicContact CD2-CD1 3.97Å; F151-Y162 AromaticContact CD2-CD2 3.98Å; F151-Y162 HydrophobicContact CD2-CD2 3.98Å; F151-Y162 AromaticContact CD2-CE1 3.82Å; F151-Y162 HydrophobicContact CD2-CE1 3.82Å; F151-Y162 AromaticContact CD2-CE2 3.86Å; F151-Y162 HydrophobicContact CD2-CE2 3.86Å; F151-Y162 HydrophobicContact CD2-CG 4.06Å; F151-Y162 AromaticContact CD2-CZ 3.78Å; F151-Y162 HydrophobicContact CE2-CD2 4.38Å; F151-Y162 HydrophobicContact CE2-CE2 4.22Å; F151-Y162 HydrophobicContact CG-CE1 4.35Å
163	I	95.2	Very high	91.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.8	177	62.5	166.8	0	0	0	110.1	V117 L131 F133 M139 W150 A152 S165 V168	V117-I163 HydrophobicContact CG2-CD1 4.31Å; L131-I163 HydrophobicContact CB-CG2 3.79Å; L131-I163 HydrophobicContact CD2-CG2 3.94Å; L131-I163 HydrophobicContact CG-CG2 4.19Å; F133-I163 HydrophobicContact CD1-CG2 3.84Å; F133-I163 HydrophobicContact CE1-CB 3.75Å; F133-I163 HydrophobicContact CE1-CG2 3.51Å; F133-I163 HydrophobicContact CZ-CB 4.44Å; M139-I163 HydrophobicContact CE-CD1 4.44Å; M139-I163 HydrophobicContact SD-CD1 4.17Å; M139-I163 HydrophobicContact SD-CG2 3.9Å; W150-I163 HydrophobicContact CB-CG1 4.18Å; W150-I163 PolarHBondContact N-O 3.28Å; W150-I163 WeakPolarHBondContact O-CG1 3.49Å; W150-I163 PolarHBondContact O-N 3.47Å; A152-I163 HydrophobicContact CB-CD1 3.53Å; A152-I163 HydrophobicContact CB-CG1 3.83Å; A152-I163 HydrophobicContact CB-CG2 4.22Å; I163-S165 PolarHBondContact O-N 2.87Å; I163-V168 HydrophobicContact CD1-CG1 3.93Å; I163-V168 HydrophobicContact CD1-CG2 4.29Å
164	P	92.9	Very high	90.9	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	125.9	170.3	18.7	-19.5	0	0	0	110.6	Y123 F133 A148 N166 Y167 V285	Y123-P164 HydrophobicContact CD1-CG 4.09Å; Y123-P164 HydrophobicContact CD2-CG 3.86Å; Y123-P164 HydrophobicContact CE1-CG 4.23Å; Y123-P164 HydrophobicContact CE2-CG 4.04Å; Y123-P164 HydrophobicContact CG-CG 3.91Å; F133-P164 HydrophobicContact CZ-CG 4.46Å; A148-P164 WeakPolarHBondContact O-CA 3.11Å; P164-N166 VanDerWaalsContact C-N 3.28Å; P164-N166 WeakPolarHBondContact CB-OD1 3.43Å; P164-N166 PolarHBondContact O-N 2.94Å; P164-Y167 HydrophobicContact CB-CD2 4.06Å; P164-Y167 HydrophobicContact CB-CG 4.32Å; P164-Y167 HydrophobicContact CG-CD1 4.32Å; P164-Y167 HydrophobicContact CG-CD2 3.96Å; P164-Y167 HydrophobicContact CG-CG 3.8Å; P164-Y167 PolarHBondContact O-N 2.87Å; P164-Y167 VanDerWaalsContact O-N 3.1Å; P164-V285 HydrophobicContact CB-CG1 4.07Å; P164-V285 HydrophobicContact CB-CG2 4.19Å; P164-V285 HydrophobicContact CG-CG1 4.34Å; P164-V285 HydrophobicContact CG-CG2 4.12Å
165	S	90.7	Very high	90	Very high	3 Å²	3	41 Å²	41	2%	0.021	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-62.4	-35.2	-177.2	61.9	0	0	0	0	112.3	D147 A148 W150 I163 Y167 V168	D147-S165 WeakPolarHBondContact O-CB 3.47Å; D147-S165 PolarHBondContact O-OG 3.01Å; A148-S165 WeakPolarHBondContact CA-OG 3.42Å; A148-S165 PolarHBondContact O-N 2.83Å; A148-S165 PolarHBondContact O-OG 2.96Å; W150-S165 VanDerWaalsContact CE2-CB 3.42Å; W150-S165 VanDerWaalsContact CZ2-CB 3.46Å; I163-S165 PolarHBondContact O-N 2.87Å; S165-Y167 PolarHBondContact O-N 3.1Å; S165-V168 WeakPolarHBondContact O-CG2 3.26Å; S165-V168 PolarHBondContact O-N 3.34Å
166	N	87.3	Confident	89.3	Confident	37 Å²	37	40 Å²	40	20%	0.198	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-73.5	0.2	177.7	67.1	-22.4	0	0	0	114.4	P164 P284	P164-N166 VanDerWaalsContact C-N 3.28Å; P164-N166 WeakPolarHBondContact CB-OD1 3.43Å; P164-N166 PolarHBondContact O-N 2.94Å; N166-P284 PolarHBondContact ND2-O 2.76Å
167	Y	91.6	Very high	88.7	Confident	18 Å²	18	34.2 Å²	34.2	7%	0.071	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-101.9	-1.2	176.1	-85.1	-128.8	0	0	0	113.5	I120 Y121 Y123 F133 P164 S165 P283 V285	I120-Y167 VanDerWaalsContact CG1-C 3.49Å; I120-Y167 WeakPolarHBondContact CG1-O 3.43Å; I120-Y167 PolarHBondContact N-O 3.17Å; Y121-Y167 HydrophobicContact CD2-CD1 4.28Å; Y121-Y167 HydrophobicContact CD2-CD2 4.38Å; Y121-Y167 HydrophobicContact CD2-CG 4.15Å; Y121-Y167 HydrophobicContact CG-CD1 4.36Å; Y121-Y167 HydrophobicContact CG-CE1 4.46Å; Y123-Y167 HydrophobicContact CD2-CD1 4.4Å; Y123-Y167 HydrophobicContact CD2-CE1 4.29Å; Y123-Y167 HydrophobicContact CG-CD1 4.47Å; F133-Y167 HydrophobicContact CE2-CD1 4.48Å; F133-Y167 HydrophobicContact CZ-CD1 4.46Å; P164-Y167 HydrophobicContact CB-CD2 4.06Å; P164-Y167 HydrophobicContact CB-CG 4.32Å; P164-Y167 HydrophobicContact CG-CD1 4.32Å; P164-Y167 HydrophobicContact CG-CD2 3.96Å; P164-Y167 HydrophobicContact CG-CG 3.8Å; P164-Y167 PolarHBondContact O-N 2.87Å; P164-Y167 VanDerWaalsContact O-N 3.1Å; S165-Y167 PolarHBondContact O-N 3.1Å; Y167-P283 HydrophobicContact CD2-CG 4.19Å; Y167-P283 HydrophobicContact CE2-CG 3.83Å; Y167-P283 VanDerWaalsContact CE2-O 3.22Å; Y167-P283 WeakPolarHBondContact CE2-O 3.35Å; Y167-P283 PolarHBondContact OH-O 3.39Å; Y167-V285 HydrophobicContact CD2-CG2 4.03Å; Y167-V285 HydrophobicContact CE1-CG2 4.3Å; Y167-V285 HydrophobicContact CE2-CG2 3.32Å; Y167-V285 VanDerWaalsContact CZ-CG2 3.49Å
168	V	90.4	Very high	88.2	Confident	8 Å²	8	31.5 Å²	31.5	5%	0.048	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	157.6	-178.8	-60.1	0	0	0	0	110.9	V117 R118 F133 M139 W150 I163 S165	V117-V168 HydrophobicContact CB-CB 3.96Å; V117-V168 HydrophobicContact CB-CG2 4.07Å; V117-V168 HydrophobicContact CG1-CG2 4.33Å; V117-V168 HydrophobicContact CG2-CB 3.98Å; V117-V168 HydrophobicContact CG2-CG1 4.11Å; V117-V168 HydrophobicContact CG2-CG2 4.06Å; R118-V168 CarbonylContact O-C 3.55Å; R118-V168 WeakPolarHBondContact O-CA 3.37Å; F133-V168 HydrophobicContact CZ-CG1 4.46Å; M139-V168 HydrophobicContact CE-CG1 3.59Å; W150-V168 HydrophobicContact CE3-CG2 4.1Å; W150-V168 HydrophobicContact CZ3-CG2 3.72Å; I163-V168 HydrophobicContact CD1-CG1 3.93Å; I163-V168 HydrophobicContact CD1-CG2 4.29Å; S165-V168 WeakPolarHBondContact O-CG2 3.26Å; S165-V168 PolarHBondContact O-N 3.34Å
169	C	87.8	Confident	87.7	Confident	5 Å²	5	32.9 Å²	32.9	3%	0.034	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	163.6	169.2	70.3	0	0	0	0	109.6	V117 R118 I120 N171	V117-C169 CarbonylContact C-O 3.58Å; V117-C169 WeakPolarHBondContact CA-O 3.3Å; V117-C169 VanDerWaalsContact CB-O 3.31Å; V117-C169 WeakPolarHBondContact CB-O 3.36Å; R118-C169 PolarHBondContact N-O 2.91Å; R118-C169 PolarHBondContact O-N 2.86Å; I120-C169 HydrophobicContact CG2-CB 4.01Å; C169-N171 PolarHBondContact O-N 2.85Å
170	L	87.6	Confident	87.5	Confident	30 Å²	30	28 Å²	28	16%	0.157	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	136.8	167.7	-71.8	175.3	0	0	0	110.2	Q91 I95 V115 D172 S177	Q91-L170 HydrophobicContact CG-CD1 4.27Å; I95-L170 HydrophobicContact CD1-CD2 3.72Å; I95-L170 HydrophobicContact CD1-CG 3.9Å; I95-L170 HydrophobicContact CG1-CD1 4.48Å; I95-L170 HydrophobicContact CG1-CD2 3.54Å; I95-L170 HydrophobicContact CG1-CG 4.03Å; V115-L170 HydrophobicContact CG1-CD2 3.49Å; V115-L170 VanDerWaalsContact CG1-CD2 3.49Å; L170-D172 PolarHBondContact O-N 3.32Å; L170-S177 WeakPolarHBondContact O-CB 3.48Å
171	N	85.8	Confident	87.3	Confident	36 Å²	36	26.5 Å²	26.5	19%	0.193	15%	0.152	C	C	.	.			trans	-98	63.1	173.8	-171.1	61.6	0	0	0	109.9	Q116 R118 I138 C169	Q116-N171 VanDerWaalsContact CD-ND2 3.33Å; Q116-N171 HydrophobicContact CG-CB 4.06Å; Q116-N171 PolarHBondContact O-N 2.86Å; Q116-N171 PolarHBondContact OE1-ND2 3.26Å; R118-N171 HydrophobicContact CB-CB 4.05Å; R118-N171 PolarHBondContact NE-OD1 3.46Å; R118-N171 PolarHBondContact NH2-OD1 2.9Å; I138-N171 HydrophobicContact CD1-CB 4.47Å; C169-N171 PolarHBondContact O-N 2.85Å
172	D	81	Confident	86.9	Confident	49 Å²	49	27.2 Å²	27.2	26%	0.262	15%	0.154	S	C	.	.	S	Bend	trans	-100.6	0.3	-175.5	57.6	10.5	0	0	0	113.6	L170 L174	L170-D172 PolarHBondContact O-N 3.32Å; D172-L174 HydrophobicContact CB-CG 4.47Å; D172-L174 PolarHBondContact O-N 3.38Å; D172-L174 WeakPolarHBondContact OD1-CB 3.22Å; D172-L174 WeakPolarHBondContact OD1-CG 3.33Å; D172-L174 PolarHBondContact OD1-N 2.92Å; D172-L174 VanDerWaalsContact OD2-CD1 3.28Å; D172-L174 WeakPolarHBondContact OD2-CD1 3.31Å
173	G	75.6	Confident	86.4	Confident	61 Å²	61	25.8 Å²	25.8	63%	0.629	15%	0.15	S	C	*	.	S	Bend	trans	74.7	7.6	-176.5	0	0	0	0	0	114
174	L	80.4	Confident	86	Confident	89 Å²	89	26.9 Å²	26.9	47%	0.466	16%	0.156	S	C	.	.	S	Bend	trans	-73.1	161.7	170.8	-65.1	-177.1	0	0	0	110.8	D172 T176 S177	D172-L174 HydrophobicContact CB-CG 4.47Å; D172-L174 PolarHBondContact O-N 3.38Å; D172-L174 WeakPolarHBondContact OD1-CB 3.22Å; D172-L174 WeakPolarHBondContact OD1-CG 3.33Å; D172-L174 PolarHBondContact OD1-N 2.92Å; D172-L174 VanDerWaalsContact OD2-CD1 3.28Å; D172-L174 WeakPolarHBondContact OD2-CD1 3.31Å; L174-T176 PolarHBondContact O-N 2.84Å; L174-S177 WeakPolarHBondContact O-CB 3.47Å; L174-S177 PolarHBondContact O-N 2.91Å; L174-S177 PolarHBondContact O-OG 2.84Å
175	P	79.9	Confident	85.7	Confident	5 Å²	5	27.2 Å²	27.2	3%	0.032	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-54.3	-30	178.7	-28.7	38.8	0	0	0	113.5	S177 L178 W181 Y214 I255	P175-S177 PolarHBondContact O-N 2.81Å; P175-S177 VanDerWaalsContact O-N 3.16Å; P175-L178 HydrophobicContact CB-CD1 4.42Å; P175-L178 VanDerWaalsContact O-CB 3.23Å; P175-L178 WeakPolarHBondContact O-CB 3.15Å; P175-L178 WeakPolarHBondContact O-CG 3.49Å; P175-L178 PolarHBondContact O-N 2.94Å; P175-W181 HydrophobicContact CB-CE3 3.8Å; P175-W181 HydrophobicContact CB-CZ3 3.91Å; P175-W181 VanDerWaalsContact O-CB 3.22Å; P175-W181 WeakPolarHBondContact O-CB 3.32Å; P175-Y214 HydrophobicContact CB-CE1 4.31Å; P175-Y214 HydrophobicContact CG-CE1 4.14Å; P175-Y214 HydrophobicContact CG-CE2 4.02Å; P175-I255 HydrophobicContact CB-CD1 3.86Å; P175-I255 HydrophobicContact CG-CB 4.33Å; P175-I255 HydrophobicContact CG-CD1 3.32Å; P175-I255 HydrophobicContact CG-CG1 3.85Å
176	T	81	Confident	85.7	Confident	18 Å²	18	33.2 Å²	33.2	11%	0.11	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-58.1	-22.6	176.1	48.5	0	0	0	0	114.2	L174 W181	L174-T176 PolarHBondContact O-N 2.84Å; T176-W181 HydrophobicContact CG2-CD2 4.33Å; T176-W181 HydrophobicContact CG2-CZ2 3.9Å
177	S	81.8	Confident	85.7	Confident	10 Å²	10	32.9 Å²	32.9	7%	0.07	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-87.4	-4.3	176.7	69.9	0	0	0	0	114.2	L170 L174 P175	L170-S177 WeakPolarHBondContact O-CB 3.48Å; L174-S177 WeakPolarHBondContact O-CB 3.47Å; L174-S177 PolarHBondContact O-N 2.91Å; L174-S177 PolarHBondContact O-OG 2.84Å; P175-S177 PolarHBondContact O-N 2.81Å; P175-S177 VanDerWaalsContact O-N 3.16Å
178	L	85.4	Confident	85.6	Confident	25 Å²	25	33 Å²	33	13%	0.131	18%	0.179	C	C	.	.	S	Bend	trans	-82.3	143.4	-177.1	-59.8	179.7	0	0	0	112	P175 A180 W181 I255 Q256 I259	P175-L178 HydrophobicContact CB-CD1 4.42Å; P175-L178 VanDerWaalsContact O-CB 3.23Å; P175-L178 WeakPolarHBondContact O-CB 3.15Å; P175-L178 WeakPolarHBondContact O-CG 3.49Å; P175-L178 PolarHBondContact O-N 2.94Å; L178-A180 PolarHBondContact O-N 2.96Å; L178-W181 HydrophobicContact CB-CB 4.48Å; L178-W181 VanDerWaalsContact O-CB 3.26Å; L178-W181 WeakPolarHBondContact O-CB 3.18Å; L178-W181 PolarHBondContact O-N 3.27Å; L178-I255 HydrophobicContact CD1-CB 4.04Å; L178-I255 HydrophobicContact CD1-CG2 3.67Å; L178-Q256 HydrophobicContact CD2-CB 4.28Å; L178-Q256 VanDerWaalsContact CD2-OE1 3.24Å; L178-I259 HydrophobicContact CD1-CD1 4Å
179	D	84.6	Confident	85.6	Confident	75 Å²	75	32.7 Å²	32.7	40%	0.401	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-18.7	171.6	-82.8	-24	0	0	0	114.2	K135 H279	K135-D179 WeakPolarHBondContact CE-OD1 3.25Å; K135-D179 IonicContact NZ-OD1 3.45Å; K135-D179 PolarHBondContact NZ-OD1 2.89Å; D179-H279 PolarHBondContact O-CE1 3.06Å
180	A	91.5	Very high	85.9	Confident	3 Å²	3	34.6 Å²	34.6	3%	0.025	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-4.2	176.6	0	0	0	0	0	112.8	L178 Y182 Y203 L204 I205 I259 P276	L178-A180 PolarHBondContact O-N 2.96Å; A180-Y182 WeakPolarHBondContact O-CD2 3.47Å; A180-Y203 HydrophobicContact CB-CD2 4.05Å; A180-Y203 HydrophobicContact CB-CE2 3.53Å; A180-L204 CarbonylContact O-C 3.56Å; A180-L204 VanDerWaalsContact O-CA 3.31Å; A180-L204 WeakPolarHBondContact O-CA 3.49Å; A180-L204 WeakPolarHBondContact O-CB 3.44Å; A180-I205 HydrophobicContact CB-CG1 4.19Å; A180-I205 PolarHBondContact O-N 2.95Å; A180-I259 HydrophobicContact CB-CD1 4.4Å; A180-P276 HydrophobicContact CB-CB 4.21Å
181	W	90.8	Very high	85.9	Confident	28 Å²	28	34.7 Å²	34.7	11%	0.106	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-78.5	135	-174.3	-178.7	-100.6	0	0	0	113.3	P175 T176 L178 I205 P207 Y214 H279	P175-W181 HydrophobicContact CB-CE3 3.8Å; P175-W181 HydrophobicContact CB-CZ3 3.91Å; P175-W181 VanDerWaalsContact O-CB 3.22Å; P175-W181 WeakPolarHBondContact O-CB 3.32Å; T176-W181 HydrophobicContact CG2-CD2 4.33Å; T176-W181 HydrophobicContact CG2-CZ2 3.9Å; L178-W181 HydrophobicContact CB-CB 4.48Å; L178-W181 VanDerWaalsContact O-CB 3.26Å; L178-W181 WeakPolarHBondContact O-CB 3.18Å; L178-W181 PolarHBondContact O-N 3.27Å; W181-I205 CarbonylContact C-O 3.56Å; W181-I205 WeakPolarHBondContact CA-O 3.44Å; W181-I205 HydrophobicContact CE3-CB 4.11Å; W181-I205 HydrophobicContact CE3-CG2 3.72Å; W181-I205 HydrophobicContact CZ3-CG2 3.79Å; W181-P207 HydrophobicContact CH2-CG 3.75Å; W181-P207 HydrophobicContact CZ2-CG 3.77Å; W181-Y214 AromaticContact CH2-CD1 3.66Å; W181-Y214 HydrophobicContact CH2-CD1 3.66Å; W181-Y214 AromaticContact CH2-CE1 3.66Å; W181-Y214 HydrophobicContact CH2-CE1 3.66Å; W181-Y214 AromaticContact CZ3-CD1 3.45Å; W181-Y214 HydrophobicContact CZ3-CD1 3.45Å; W181-Y214 VanDerWaalsContact CZ3-CD1 3.45Å; W181-Y214 AromaticContact CZ3-CE1 3.69Å; W181-Y214 HydrophobicContact CZ3-CE1 3.69Å; W181-Y214 HydrophobicContact CZ3-CG 4.48Å; W181-H279 PolarHBondContact O-NE2 2.76Å
182	Y	89	Confident	86.2	Confident	16 Å²	16	34.3 Å²	34.3	6%	0.063	18%	0.181	C	C	.	.			trans	-137.7	125.8	170.2	-72.5	-102.4	0	0	0	109.6	A180 I184 K192 L204 I205 R206 P207 C277 P278 H279	A180-Y182 WeakPolarHBondContact O-CD2 3.47Å; Y182-I184 HydrophobicContact CD1-CD1 4.01Å; Y182-I184 HydrophobicContact CG-CD1 3.97Å; Y182-I184 PolarHBondContact O-N 2.7Å; Y182-K192 HydrophobicContact CD1-CD 3.75Å; Y182-K192 HydrophobicContact CE1-CD 3.59Å; Y182-L204 HydrophobicContact CD2-CB 3.61Å; Y182-L204 HydrophobicContact CD2-CD2 4.09Å; Y182-L204 HydrophobicContact CD2-CG 4.34Å; Y182-L204 HydrophobicContact CE2-CB 4.01Å; Y182-L204 HydrophobicContact CE2-CD2 4.45Å; Y182-L204 HydrophobicContact CG-CB 4.5Å; Y182-L204 HydrophobicContact CG-CD2 4.33Å; Y182-I205 PolarHBondContact N-O 2.98Å; Y182-R206 VanDerWaalsContact O-CA 3.24Å; Y182-R206 WeakPolarHBondContact O-CA 2.86Å; Y182-R206 WeakPolarHBondContact O-CB 3.38Å; Y182-P207 WeakPolarHBondContact O-CD 3.42Å; Y182-C277 HydrophobicContact CE2-CB 3.94Å; Y182-C277 PolarHBondContact OH-O 2.89Å; Y182-P278 PolarHBondContact OH-O 3.26Å; Y182-H279 AromaticContact CE1-CD2 3.75Å; Y182-H279 AromaticContact CE1-NE2 3.77Å; Y182-H279 AromaticContact CE2-CE1 3.52Å; Y182-H279 AromaticContact CE2-NE2 3.62Å; Y182-H279 AromaticContact CZ-CD2 3.64Å; Y182-H279 AromaticContact CZ-CE1 3.56Å; Y182-H279 AromaticContact CZ-CG 3.84Å; Y182-H279 AromaticContact CZ-ND1 3.83Å; Y182-H279 AromaticContact CZ-NE2 3.45Å; Y182-H279 WeakPolarHBondContact OH-CA 3.24Å; Y182-H279 PolarHBondContact OH-N 2.83Å; Y182-H279 VanDerWaalsContact OH-N 3.15Å; Y182-H279 PolarHBondContact OH-ND1 3.17Å
183	D	84.4	Confident	86.8	Confident	25 Å²	25	32 Å²	32	13%	0.134	17%	0.169	C	C	.	.			trans	-82.3	71.1	172.2	-165.6	23.3	0	0	0	109.9	C87 P207	C87-D183 WeakPolarHBondContact CB-OD2 3.24Å; D183-P207 WeakPolarHBondContact OD1-CG 3.49Å
184	I	86.6	Confident	87.6	Confident	23 Å²	23	32.2 Å²	32.2	12%	0.118	16%	0.156	C	C	.	.			trans	-140.6	154.5	-172.5	65.6	-176.8	0	0	0	112.2	Y182 E188 A189 K192 L204 R206	Y182-I184 HydrophobicContact CD1-CD1 4.01Å; Y182-I184 HydrophobicContact CG-CD1 3.97Å; Y182-I184 PolarHBondContact O-N 2.7Å; I184-E188 HydrophobicContact CB-CB 4.02Å; I184-E188 HydrophobicContact CB-CG 3.77Å; I184-E188 HydrophobicContact CD1-CB 4.42Å; I184-E188 HydrophobicContact CD1-CG 3.98Å; I184-E188 HydrophobicContact CG1-CG 4.38Å; I184-E188 HydrophobicContact CG2-CB 4.5Å; I184-E188 HydrophobicContact CG2-CG 3.72Å; I184-A189 HydrophobicContact CD1-CB 3.87Å; I184-A189 HydrophobicContact CG1-CB 4.26Å; I184-K192 HydrophobicContact CD1-CD 3.98Å; I184-L204 HydrophobicContact CD1-CD1 4.47Å; I184-L204 HydrophobicContact CD1-CD2 4.1Å; I184-R206 HydrophobicContact CG1-CB 4.33Å; I184-R206 WeakPolarHBondContact O-CB 3.43Å; I184-R206 VanDerWaalsContact O-CD 3.31Å; I184-R206 WeakPolarHBondContact O-CD 3.29Å
185	G	87.3	Confident	88	Confident	8 Å²	8	30.6 Å²	30.6	8%	0.082	15%	0.147	C	C	.	.			trans	-70.8	177.6	171.4	0	0	0	0	0	113.8	A189	G185-A189 WeakPolarHBondContact O-CB 3.44Å; G185-A189 PolarHBondContact O-N 2.87Å; G185-A189 VanDerWaalsContact O-N 3.16Å
186	R	89.4	Confident	88.3	Confident	128 Å²	128	37.4 Å²	37.4	48%	0.483	19%	0.188	S	C	.	.	H	α-helix	trans	-60.9	-49.7	-179.9	-177.1	-175.4	-67.6	-159.9	-1.1	112.3	E188 A189 D190 H232	R186-E188 PolarHBondContact O-N 3.19Å; R186-A189 WeakPolarHBondContact O-CB 3.4Å; R186-A189 PolarHBondContact O-N 2.96Å; R186-A189 VanDerWaalsContact O-N 3.16Å; R186-D190 PolarHBondContact O-N 3.18Å; R186-H232 WeakPolarHBondContact CG-NE2 3.4Å
187	R	88.3	Confident	88.8	Confident	30 Å²	30	39.8 Å²	39.8	11%	0.113	22%	0.216	C	C	.	.	H	α-helix	trans	-63.3	-43.7	-175.1	-174.1	178.7	-79	-84.3	-7.1	112.1	A189 D190 R191 D393 D397 F551	R187-A189 VanDerWaalsContact C-N 3.29Å; R187-A189 PolarHBondContact O-N 2.95Å; R187-D190 WeakPolarHBondContact O-CB 3.16Å; R187-D190 PolarHBondContact O-N 3.42Å; R187-D190 VanDerWaalsContact O-N 3.13Å; R187-R191 PolarHBondContact O-N 2.89Å; R187-D393 IonicContact CZ-OD1 2.69Å; R187-D393 IonicContact NH1-OD1 3.63Å; R187-D393 PolarHBondContact NH1-OD1 3.44Å; R187-D393 IonicContact NH1-OD2 3.73Å; R187-D393 IonicContact NH2-OD1 3.47Å; R187-D397 WeakPolarHBondContact CD-OD1 3.41Å; R187-D397 VanDerWaalsContact CG-OD1 3.3Å; R187-D397 WeakPolarHBondContact CG-OD1 3.37Å; R187-F551 PolarHBondContact NE-O 2.99Å
188	E	88.2	Confident	89.4	Confident	22 Å²	22	40.3 Å²	40.3	10%	0.103	22%	0.218	C	C	.	.	H	α-helix	trans	-64.8	-34.1	175.4	178.7	62.7	-176.1	0	0	112.2	I184 R186 D190 R191 K192 R350	I184-E188 HydrophobicContact CB-CB 4.02Å; I184-E188 HydrophobicContact CB-CG 3.77Å; I184-E188 HydrophobicContact CD1-CB 4.42Å; I184-E188 HydrophobicContact CD1-CG 3.98Å; I184-E188 HydrophobicContact CG1-CG 4.38Å; I184-E188 HydrophobicContact CG2-CB 4.5Å; I184-E188 HydrophobicContact CG2-CG 3.72Å; R186-E188 PolarHBondContact O-N 3.19Å; E188-D190 VanDerWaalsContact C-N 3.35Å; E188-R191 IonicContact OE1-CZ 3.68Å; E188-R191 IonicContact OE1-NE 2.9Å; E188-R191 PolarHBondContact OE1-NE 3.22Å; E188-R191 IonicContact OE1-NH2 3.86Å; E188-R191 PolarHBondContact OE1-NH2 3.5Å; E188-R191 IonicContact OE2-CZ 3.46Å; E188-R191 IonicContact OE2-NE 2.95Å; E188-R191 PolarHBondContact OE2-NE 2.87Å; E188-R191 IonicContact OE2-NH2 3.41Å; E188-K192 WeakPolarHBondContact O-CG 3.36Å; E188-K192 PolarHBondContact O-N 3.3Å; E188-K192 WeakPolarHBondContact OE1-CE 3.34Å; E188-K192 IonicContact OE1-NZ 3.96Å; E188-K192 PolarHBondContact OE1-NZ 3.24Å; E188-R350 IonicContact OE1-NH2 2.65Å; E188-R350 PolarHBondContact OE1-NH2 3.32Å; E188-R350 IonicContact OE2-NH2 2.69Å; E188-R350 PolarHBondContact OE2-NH2 3.32Å
189	A	92.3	Very high	89.9	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.6	-40.6	172.8	0	0	0	0	0	112	I184 G185 R186 R187 K192 L193 L204	I184-A189 HydrophobicContact CD1-CB 3.87Å; I184-A189 HydrophobicContact CG1-CB 4.26Å; G185-A189 WeakPolarHBondContact O-CB 3.44Å; G185-A189 PolarHBondContact O-N 2.87Å; G185-A189 VanDerWaalsContact O-N 3.16Å; R186-A189 WeakPolarHBondContact O-CB 3.4Å; R186-A189 PolarHBondContact O-N 2.96Å; R186-A189 VanDerWaalsContact O-N 3.16Å; R187-A189 VanDerWaalsContact C-N 3.29Å; R187-A189 PolarHBondContact O-N 2.95Å; A189-K192 PolarHBondContact O-N 3.34Å; A189-L193 WeakPolarHBondContact O-CB 3.21Å; A189-L193 VanDerWaalsContact O-CG 3.31Å; A189-L193 WeakPolarHBondContact O-CG 3.39Å; A189-L193 PolarHBondContact O-N 3.34Å; A189-L204 HydrophobicContact CB-CD1 3.83Å; A189-L204 HydrophobicContact CB-CD2 4.03Å; A189-L204 HydrophobicContact CB-CG 4.42Å
190	D	92.1	Very high	90.5	Very high	45 Å²	45	43 Å²	43	24%	0.241	23%	0.231	C	C	.	.	H	α-helix	trans	-62	-49.6	176.6	-70.6	-2.9	0	0	0	110.8	R186 R187 E188 K192 L193 L194 V230 H232	R186-D190 PolarHBondContact O-N 3.18Å; R187-D190 WeakPolarHBondContact O-CB 3.16Å; R187-D190 PolarHBondContact O-N 3.42Å; R187-D190 VanDerWaalsContact O-N 3.13Å; E188-D190 VanDerWaalsContact C-N 3.35Å; D190-K192 VanDerWaalsContact C-N 3.35Å; D190-K192 PolarHBondContact O-N 3.4Å; D190-L193 PolarHBondContact O-N 2.79Å; D190-L194 HydrophobicContact CB-CD1 4.39Å; D190-L194 VanDerWaalsContact O-CB 3.26Å; D190-L194 WeakPolarHBondContact O-CB 3.47Å; D190-L194 WeakPolarHBondContact O-CG 3.32Å; D190-L194 PolarHBondContact O-N 3.47Å; D190-V230 HydrophobicContact CB-CG2 4.37Å; D190-V230 WeakPolarHBondContact OD1-CB 3.28Å; D190-V230 VanDerWaalsContact OD1-CG1 3.27Å; D190-V230 WeakPolarHBondContact OD1-CG1 3.39Å; D190-H232 IonicContact OD1-CE1 3.67Å; D190-H232 PolarHBondContact OD1-CE1 3.25Å; D190-H232 IonicContact OD1-NE2 3.74Å; D190-H232 PolarHBondContact OD1-NE2 2.8Å; D190-H232 IonicContact OD2-NE2 3.38Å
191	R	89.2	Confident	90.7	Very high	33 Å²	33	42.8 Å²	42.8	13%	0.125	23%	0.23	C	C	.	.	H	α-helix	trans	-52.3	-51.8	176	-169.1	-172.2	71.1	82.7	-2	111.7	R187 E188 L193 L194 L195 D397 D429	R187-R191 PolarHBondContact O-N 2.89Å; E188-R191 IonicContact OE1-CZ 3.68Å; E188-R191 IonicContact OE1-NE 2.9Å; E188-R191 PolarHBondContact OE1-NE 3.22Å; E188-R191 IonicContact OE1-NH2 3.86Å; E188-R191 PolarHBondContact OE1-NH2 3.5Å; E188-R191 IonicContact OE2-CZ 3.46Å; E188-R191 IonicContact OE2-NE 2.95Å; E188-R191 PolarHBondContact OE2-NE 2.87Å; E188-R191 IonicContact OE2-NH2 3.41Å; R191-L193 PolarHBondContact O-N 2.8Å; R191-L194 PolarHBondContact O-N 3.15Å; R191-L195 PolarHBondContact O-N 3.44Å; R191-D397 WeakPolarHBondContact CD-OD2 3.21Å; R191-D429 IonicContact CZ-OD2 3.05Å; R191-D429 PolarHBondContact NH1-O 2.9Å; R191-D429 IonicContact NH1-OD2 3.12Å; R191-D429 PolarHBondContact NH1-OD2 2.81Å; R191-D429 IonicContact NH2-OD2 2.94Å; R191-D429 PolarHBondContact NH2-OD2 3.26Å
192	K	91.3	Very high	91.1	Very high	27 Å²	27	41.5 Å²	41.5	12%	0.117	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-42.8	-179.3	-72.9	-171.6	-174.8	-55.3	0	112.8	Y182 I184 E188 A189 D190 N198	Y182-K192 HydrophobicContact CD1-CD 3.75Å; Y182-K192 HydrophobicContact CE1-CD 3.59Å; I184-K192 HydrophobicContact CD1-CD 3.98Å; E188-K192 WeakPolarHBondContact O-CG 3.36Å; E188-K192 PolarHBondContact O-N 3.3Å; E188-K192 WeakPolarHBondContact OE1-CE 3.34Å; E188-K192 IonicContact OE1-NZ 3.96Å; E188-K192 PolarHBondContact OE1-NZ 3.24Å; A189-K192 PolarHBondContact O-N 3.34Å; D190-K192 VanDerWaalsContact C-N 3.35Å; D190-K192 PolarHBondContact O-N 3.4Å; K192-N198 PolarHBondContact O-ND2 3.14Å
193	L	94	Very high	91.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-73.4	-32.2	-177.8	-74.8	171.9	0	0	0	112.5	A189 D190 R191 L195 N198 T202 L204 R219 V230 C277	A189-L193 WeakPolarHBondContact O-CB 3.21Å; A189-L193 VanDerWaalsContact O-CG 3.31Å; A189-L193 WeakPolarHBondContact O-CG 3.39Å; A189-L193 PolarHBondContact O-N 3.34Å; D190-L193 PolarHBondContact O-N 2.79Å; R191-L193 PolarHBondContact O-N 2.8Å; L193-L195 VanDerWaalsContact C-N 3.35Å; L193-N198 PolarHBondContact O-ND2 3.27Å; L193-T202 HydrophobicContact CD2-CG2 3.82Å; L193-L204 HydrophobicContact CD1-CD2 4.08Å; L193-L204 HydrophobicContact CD1-CG 4.09Å; L193-L204 HydrophobicContact CD2-CD2 4.21Å; L193-L204 HydrophobicContact CD2-CG 4.45Å; L193-L204 HydrophobicContact CG-CD2 3.85Å; L193-L204 HydrophobicContact CG-CG 4.3Å; L193-R219 HydrophobicContact CB-CB 4.36Å; L193-R219 VanDerWaalsContact O-CD 3.29Å; L193-R219 WeakPolarHBondContact O-CD 3.46Å; L193-R219 PolarHBondContact O-NH1 3.37Å; L193-V230 HydrophobicContact CB-CG2 3.75Å; L193-V230 HydrophobicContact CD1-CG1 3.58Å; L193-V230 HydrophobicContact CD1-CG2 4.11Å; L193-C277 HydrophobicContact CD2-CB 3.86Å
194	L	92.4	Very high	92.1	Very high	67 Å²	67	40.3 Å²	40.3	35%	0.351	22%	0.219	S	C	.	.	H	α-helix	trans	-80.6	-10.8	-179.2	-67.7	173.6	0	0	0	114	D190 R191 V196 R219 W228 V230	D190-L194 HydrophobicContact CB-CD1 4.39Å; D190-L194 VanDerWaalsContact O-CB 3.26Å; D190-L194 WeakPolarHBondContact O-CB 3.47Å; D190-L194 WeakPolarHBondContact O-CG 3.32Å; D190-L194 PolarHBondContact O-N 3.47Å; R191-L194 PolarHBondContact O-N 3.15Å; L194-V196 PolarHBondContact O-N 3.46Å; L194-R219 PolarHBondContact O-NH1 3.3Å; L194-W228 HydrophobicContact CD2-CB 3.83Å; L194-V230 HydrophobicContact CD1-CG2 4.44Å; L194-V230 HydrophobicContact CD2-CG2 4.01Å; L194-V230 HydrophobicContact CG-CG2 3.88Å
195	L	88.5	Confident	92.5	Very high	55 Å²	55	39.2 Å²	39.2	29%	0.288	21%	0.213	S	C	.	.	S	Bend	trans	-47.6	136.2	173.1	-74.4	176.5	0	0	0	112.4	R191 L193 G197 N198 R219	R191-L195 PolarHBondContact O-N 3.44Å; L193-L195 VanDerWaalsContact C-N 3.35Å; L195-G197 PolarHBondContact O-N 3.14Å; L195-N198 PolarHBondContact O-N 2.65Å; L195-R219 PolarHBondContact O-NH1 3.26Å
196	V	87.2	Confident	92.8	Very high	147 Å²	147	39.2 Å²	39.2	89%	0.891	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	136.1	179.9	-179.5	0	0	0	0	109.9	L194	L194-V196 PolarHBondContact O-N 3.46Å
197	G	90.6	Very high	92.8	Very high	68 Å²	68	34.4 Å²	34.4	70%	0.701	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	104.2	-22.5	-179.9	0	0	0	0	0	114.5	L195 P199	L195-G197 PolarHBondContact O-N 3.14Å; G197-P199 WeakPolarHBondContact O-CD 3.22Å
198	N	93.4	Very high	92.7	Very high	21 Å²	21	34 Å²	34	11%	0.112	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-70.4	127.2	174.2	-69	-25.7	0	0	0	110.8	K192 L193 L195 T202 R219 P278	K192-N198 PolarHBondContact O-ND2 3.14Å; L193-N198 PolarHBondContact O-ND2 3.27Å; L195-N198 PolarHBondContact O-N 2.65Å; N198-T202 HydrophobicContact CB-CG2 4.14Å; N198-R219 WeakPolarHBondContact O-CD 3.44Å; N198-R219 PolarHBondContact O-NE 3.5Å; N198-R219 VanDerWaalsContact O-NE 3.09Å; N198-R219 PolarHBondContact O-NH1 3.15Å; N198-P278 WeakPolarHBondContact OD1-CD 3.48Å
199	P	95.9	Very high	92.2	Very high	58 Å²	58	37.6 Å²	37.6	38%	0.377	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-73.8	164.7	179	29.6	-35.9	0	0	0	113	G197 G201 T202 I275	G197-P199 WeakPolarHBondContact O-CD 3.22Å; P199-G201 PolarHBondContact O-N 3.27Å; P199-T202 WeakPolarHBondContact CD-OG1 3.34Å; P199-T202 WeakPolarHBondContact O-CB 3.5Å; P199-T202 PolarHBondContact O-N 2.66Å; P199-T202 VanDerWaalsContact O-N 3.14Å; P199-T202 PolarHBondContact O-OG1 2.87Å; P199-I275 HydrophobicContact CG-CD1 3.72Å; P199-I275 HydrophobicContact CG-CG1 3.94Å
200	K	97.2	Very high	91.2	Very high	98 Å²	98	42.1 Å²	42.1	43%	0.426	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	139	169.1	-179.2	173	176.1	170.9	0	110.3	T202 W228 C271 S274	K200-T202 VanDerWaalsContact C-N 3.29Å; K200-W228 HydrophobicContact CB-CH2 3.98Å; K200-W228 HydrophobicContact CB-CZ3 3.91Å; K200-C271 HydrophobicContact CG-CB 4.41Å; K200-S274 WeakPolarHBondContact O-CB 3.4Å; K200-S274 PolarHBondContact O-OG 3.25Å
201	G	97.4	Very high	90.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	83	0.8	-177.1	0	0	0	0	0	114.4	P199 Y203 R219 R272 S274	P199-G201 PolarHBondContact O-N 3.27Å; G201-Y203 PolarHBondContact O-N 2.96Å; G201-R219 PolarHBondContact N-O 2.79Å; G201-R272 WeakPolarHBondContact CA-O 3.37Å; G201-S274 WeakPolarHBondContact CA-OG 3.24Å; G201-S274 PolarHBondContact O-N 3.2Å; G201-S274 PolarHBondContact O-OG 3.42Å
202	T	98.1	Very high	89.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.288	C	S	.	.			trans	-58.1	134.5	170.5	-58.2	0	0	0	0	108.9	L193 N198 P199 K200 V218 R219 S274 I275 C277	L193-T202 HydrophobicContact CD2-CG2 3.82Å; N198-T202 HydrophobicContact CB-CG2 4.14Å; P199-T202 WeakPolarHBondContact CD-OG1 3.34Å; P199-T202 WeakPolarHBondContact O-CB 3.5Å; P199-T202 PolarHBondContact O-N 2.66Å; P199-T202 VanDerWaalsContact O-N 3.14Å; P199-T202 PolarHBondContact O-OG1 2.87Å; K200-T202 VanDerWaalsContact C-N 3.29Å; T202-V218 WeakPolarHBondContact O-CA 3.34Å; T202-R219 PolarHBondContact O-N 2.75Å; T202-S274 PolarHBondContact N-OG 2.9Å; T202-S274 VanDerWaalsContact N-OG 3.17Å; T202-I275 VanDerWaalsContact CA-O 3.28Å; T202-I275 WeakPolarHBondContact CA-O 3.37Å; T202-I275 HydrophobicContact CG2-CG1 4.36Å; T202-C277 HydrophobicContact CG2-CB 4.09Å
203	Y	97.7	Very high	89.3	Confident	16 Å²	16	49.8 Å²	49.8	6%	0.063	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	158	-170.3	70.4	-83.4	0	0	0	114.1	A180 G201 L216 S217 I259 L273 I275 P276 C277	A180-Y203 HydrophobicContact CB-CD2 4.05Å; A180-Y203 HydrophobicContact CB-CE2 3.53Å; G201-Y203 PolarHBondContact O-N 2.96Å; Y203-L216 HydrophobicContact CD2-CD1 3.88Å; Y203-L216 HydrophobicContact CG-CD1 4.26Å; Y203-S217 CarbonylContact C-O 3.4Å; Y203-S217 WeakPolarHBondContact CA-O 3.26Å; Y203-I259 HydrophobicContact CE2-CD1 4.1Å; Y203-I259 HydrophobicContact CE2-CG1 4.18Å; Y203-I259 HydrophobicContact CE2-CG2 3.82Å; Y203-I259 WeakPolarHBondContact OH-CG2 3.34Å; Y203-L273 HydrophobicContact CD1-CB 3.73Å; Y203-L273 HydrophobicContact CD1-CD1 4.41Å; Y203-L273 HydrophobicContact CD1-CD2 4.22Å; Y203-L273 HydrophobicContact CD1-CG 4.33Å; Y203-L273 HydrophobicContact CD2-CD1 4.24Å; Y203-L273 HydrophobicContact CE1-CB 3.89Å; Y203-L273 HydrophobicContact CE2-CD1 4.4Å; Y203-L273 HydrophobicContact CG-CB 4.3Å; Y203-L273 HydrophobicContact CG-CD1 4.26Å; Y203-L273 HydrophobicContact CG-CD2 4.02Å; Y203-L273 HydrophobicContact CG-CG 4.42Å; Y203-I275 WeakPolarHBondContact CD1-O 3.2Å; Y203-I275 WeakPolarHBondContact CE1-O 3.44Å; Y203-I275 PolarHBondContact N-O 2.68Å; Y203-P276 HydrophobicContact CE1-CG 4.36Å; Y203-P276 CarbonylContact O-C 3.58Å; Y203-P276 WeakPolarHBondContact O-CA 3.17Å; Y203-C277 WeakPolarHBondContact O-CB 3.48Å; Y203-C277 PolarHBondContact O-N 2.87Å
204	L	96.6	Very high	89.2	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	157.1	168.7	61.9	82.9	0	0	0	111.3	A180 Y182 I184 A189 L193 R206 L216 S217 C277	A180-L204 CarbonylContact O-C 3.56Å; A180-L204 VanDerWaalsContact O-CA 3.31Å; A180-L204 WeakPolarHBondContact O-CA 3.49Å; A180-L204 WeakPolarHBondContact O-CB 3.44Å; Y182-L204 HydrophobicContact CD2-CB 3.61Å; Y182-L204 HydrophobicContact CD2-CD2 4.09Å; Y182-L204 HydrophobicContact CD2-CG 4.34Å; Y182-L204 HydrophobicContact CE2-CB 4.01Å; Y182-L204 HydrophobicContact CE2-CD2 4.45Å; Y182-L204 HydrophobicContact CG-CB 4.5Å; Y182-L204 HydrophobicContact CG-CD2 4.33Å; I184-L204 HydrophobicContact CD1-CD1 4.47Å; I184-L204 HydrophobicContact CD1-CD2 4.1Å; A189-L204 HydrophobicContact CB-CD1 3.83Å; A189-L204 HydrophobicContact CB-CD2 4.03Å; A189-L204 HydrophobicContact CB-CG 4.42Å; L193-L204 HydrophobicContact CD1-CD2 4.08Å; L193-L204 HydrophobicContact CD1-CG 4.09Å; L193-L204 HydrophobicContact CD2-CD2 4.21Å; L193-L204 HydrophobicContact CD2-CG 4.45Å; L193-L204 HydrophobicContact CG-CD2 3.85Å; L193-L204 HydrophobicContact CG-CG 4.3Å; L204-R206 HydrophobicContact CD1-CB 4.03Å; L204-R206 HydrophobicContact CD1-CG 3.98Å; L204-L216 WeakPolarHBondContact O-CA 3.19Å; L204-S217 PolarHBondContact N-O 3.06Å; L204-S217 PolarHBondContact O-N 2.99Å; L204-C277 HydrophobicContact CB-CB 4.03Å; L204-C277 HydrophobicContact CD2-CB 4.11Å
205	I	95.3	Very high	89.3	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	138	170.3	-52.3	-59	0	0	0	108	A180 W181 Y182 A215 L216 I235 I255 I259	A180-I205 HydrophobicContact CB-CG1 4.19Å; A180-I205 PolarHBondContact O-N 2.95Å; W181-I205 CarbonylContact C-O 3.56Å; W181-I205 WeakPolarHBondContact CA-O 3.44Å; W181-I205 HydrophobicContact CE3-CB 4.11Å; W181-I205 HydrophobicContact CE3-CG2 3.72Å; W181-I205 HydrophobicContact CZ3-CG2 3.79Å; Y182-I205 PolarHBondContact N-O 2.98Å; I205-A215 WeakPolarHBondContact CA-O 3.28Å; I205-L216 HydrophobicContact CD1-CB 3.95Å; I205-L216 HydrophobicContact CD1-CD1 3.58Å; I205-L216 HydrophobicContact CD1-CG 4.35Å; I205-I235 HydrophobicContact CD1-CD1 3.77Å; I205-I255 HydrophobicContact CD1-CG2 4.42Å; I205-I255 HydrophobicContact CG1-CG2 4.25Å; I205-I259 HydrophobicContact CD1-CD1 4.37Å; I205-I259 HydrophobicContact CG1-CD1 4.05Å
206	R	93.4	Very high	89.7	Confident	9 Å²	9	46.7 Å²	46.7	3%	0.034	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	166.3	178.8	60.2	175.3	177.4	77.7	-2	111.6	Y182 I184 L204 Y214 A215 S217 H232	Y182-R206 VanDerWaalsContact O-CA 3.24Å; Y182-R206 WeakPolarHBondContact O-CA 2.86Å; Y182-R206 WeakPolarHBondContact O-CB 3.38Å; I184-R206 HydrophobicContact CG1-CB 4.33Å; I184-R206 WeakPolarHBondContact O-CB 3.43Å; I184-R206 VanDerWaalsContact O-CD 3.31Å; I184-R206 WeakPolarHBondContact O-CD 3.29Å; L204-R206 HydrophobicContact CD1-CB 4.03Å; L204-R206 HydrophobicContact CD1-CG 3.98Å; R206-Y214 CarbonylContact O-C 3.55Å; R206-Y214 WeakPolarHBondContact O-CA 3.4Å; R206-A215 HydrophobicContact CG-CB 4.02Å; R206-A215 PolarHBondContact N-O 3.36Å; R206-A215 PolarHBondContact O-N 3.13Å; R206-S217 PolarHBondContact NE-OG 3.43Å; R206-S217 VanDerWaalsContact NE-OG 3.07Å; R206-H232 PolarHBondContact NH2-ND1 3.42Å; R206-H232 VanDerWaalsContact NH2-ND1 3.18Å
207	P	89.9	Confident	90.1	Very high	26 Å²	26	39.7 Å²	39.7	17%	0.169	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.9	144.7	166.1	-21.7	32.5	0	0	0	111.6	W181 Y182 D183	W181-P207 HydrophobicContact CH2-CG 3.75Å; W181-P207 HydrophobicContact CZ2-CG 3.77Å; Y182-P207 WeakPolarHBondContact O-CD 3.42Å; D183-P207 WeakPolarHBondContact OD1-CG 3.49Å
208	S	86.4	Confident	90.5	Very high	23 Å²	23	36.4 Å²	36.4	16%	0.161	20%	0.195	C	C	.	.			trans	-83.1	149.2	168.4	174.9	0	0	0	0	110.1	E210 N213	S208-E210 WeakPolarHBondContact CB-O 3.36Å; S208-E210 PolarHBondContact O-N 2.69Å; S208-E210 PolarHBondContact OG-N 3.46Å; S208-E210 PolarHBondContact OG-O 2.99Å; S208-N213 VanDerWaalsContact CB-C 3.48Å; S208-N213 WeakPolarHBondContact CB-O 3.45Å; S208-N213 PolarHBondContact N-O 2.87Å
209	S	76.2	Confident	90.7	Very high	96 Å²	96	36 Å²	36	67%	0.671	19%	0.192	S	C	*	.	S	Bend	trans	-65.2	-28.3	170.5	51.7	0	0	0	0	112.1
210	E	72	Confident	90.7	Very high	95 Å²	95	34.6 Å²	34.6	44%	0.444	18%	0.181	S	C	.	.	S	Bend	trans	-80.1	131.9	166.2	-67.6	173.9	-138.9	0	0	110.5	S208 R234	S208-E210 WeakPolarHBondContact CB-O 3.36Å; S208-E210 PolarHBondContact O-N 2.69Å; S208-E210 PolarHBondContact OG-N 3.46Å; S208-E210 PolarHBondContact OG-O 2.99Å; E210-R234 IonicContact OE1-CZ 3.69Å; E210-R234 IonicContact OE1-NH2 2.74Å; E210-R234 IonicContact OE2-CZ 3.9Å; E210-R234 IonicContact OE2-NE 3.8Å; E210-R234 IonicContact OE2-NH1 3.83Å; E210-R234 PolarHBondContact OE2-NH1 3.19Å; E210-R234 IonicContact OE2-NH2 2.7Å
211	T	69.9	Low	90.6	Very high	90 Å²	90	32.1 Å²	32.1	55%	0.552	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	145	-179.1	56.8	0	0	0	0	113	V80 N213	V80-T211 HydrophobicContact CB-CG2 4.19Å; V80-T211 HydrophobicContact CG1-CG2 3.61Å; T211-N213 VanDerWaalsContact C-N 3.28Å; T211-N213 PolarHBondContact O-N 2.65Å; T211-N213 PolarHBondContact O-ND2 3.07Å
212	Q	76.4	Confident	90.3	Very high	149 Å²	149	33.3 Å²	33.3	70%	0.696	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.1	21.4	172.7	-56.2	-64.8	-33.2	0	0	115.6	I237	Q212-I237 VanDerWaalsContact O-CD1 3.28Å; Q212-I237 WeakPolarHBondContact O-CD1 3.39Å
213	N	86.4	Confident	90	Very high	28 Å²	28	37.9 Å²	37.9	15%	0.15	21%	0.209	C	C	.	.			trans	-128	164.5	173.7	-66.1	-61.6	0	0	0	110.9	S208 T211 R234 R236	S208-N213 VanDerWaalsContact CB-C 3.48Å; S208-N213 WeakPolarHBondContact CB-O 3.45Å; S208-N213 PolarHBondContact N-O 2.87Å; T211-N213 VanDerWaalsContact C-N 3.28Å; T211-N213 PolarHBondContact O-N 2.65Å; T211-N213 PolarHBondContact O-ND2 3.07Å; N213-R234 HydrophobicContact CB-CG 4.17Å; N213-R236 WeakPolarHBondContact OD1-CA 3.41Å
214	Y	92.4	Very high	89.8	Confident	50 Å²	50	46.1 Å²	46.1	20%	0.196	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	167	170	-53.5	-78.7	0	0	0	110.4	P175 W181 R206 I235 I237 F244 I255	P175-Y214 HydrophobicContact CB-CE1 4.31Å; P175-Y214 HydrophobicContact CG-CE1 4.14Å; P175-Y214 HydrophobicContact CG-CE2 4.02Å; W181-Y214 AromaticContact CH2-CD1 3.66Å; W181-Y214 HydrophobicContact CH2-CD1 3.66Å; W181-Y214 AromaticContact CH2-CE1 3.66Å; W181-Y214 HydrophobicContact CH2-CE1 3.66Å; W181-Y214 AromaticContact CZ3-CD1 3.45Å; W181-Y214 HydrophobicContact CZ3-CD1 3.45Å; W181-Y214 VanDerWaalsContact CZ3-CD1 3.45Å; W181-Y214 AromaticContact CZ3-CE1 3.69Å; W181-Y214 HydrophobicContact CZ3-CE1 3.69Å; W181-Y214 HydrophobicContact CZ3-CG 4.48Å; R206-Y214 CarbonylContact O-C 3.55Å; R206-Y214 WeakPolarHBondContact O-CA 3.4Å; Y214-I235 PolarHBondContact N-O 3.22Å; Y214-I235 PolarHBondContact O-N 3.14Å; Y214-I237 HydrophobicContact CD2-CD1 4.39Å; Y214-I237 HydrophobicContact CE2-CD1 3.78Å; Y214-I237 HydrophobicContact CE2-CG1 4.32Å; Y214-F244 HydrophobicContact CD2-CD1 4.49Å; Y214-F244 HydrophobicContact CD2-CE1 4.35Å; Y214-F244 HydrophobicContact CE2-CD1 4.47Å; Y214-F244 AromaticContact CE2-CE1 3.89Å; Y214-F244 HydrophobicContact CE2-CE1 3.89Å; Y214-I255 HydrophobicContact CD2-CD1 3.61Å; Y214-I255 HydrophobicContact CE2-CD1 4.04Å; Y214-I255 HydrophobicContact CG-CD1 4.04Å
215	A	94.5	Very high	89.4	Confident	6 Å²	6	52.7 Å²	52.7	5%	0.05	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	130.4	172.5	0	0	0	0	0	110.5	I205 R206 Y233	I205-A215 WeakPolarHBondContact CA-O 3.28Å; R206-A215 HydrophobicContact CG-CB 4.02Å; R206-A215 PolarHBondContact N-O 3.36Å; R206-A215 PolarHBondContact O-N 3.13Å; A215-Y233 CarbonylContact C-O 3.55Å; A215-Y233 WeakPolarHBondContact CA-O 3.12Å
216	L	95.9	Very high	89.2	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.7	165.1	170.1	66.5	0	0	0	108.2	Y203 L204 I205 V218 H232 Y233 I235 I246 L269 L273	Y203-L216 HydrophobicContact CD2-CD1 3.88Å; Y203-L216 HydrophobicContact CG-CD1 4.26Å; L204-L216 WeakPolarHBondContact O-CA 3.19Å; I205-L216 HydrophobicContact CD1-CB 3.95Å; I205-L216 HydrophobicContact CD1-CD1 3.58Å; I205-L216 HydrophobicContact CD1-CG 4.35Å; L216-V218 HydrophobicContact CD1-CG2 4.03Å; L216-V218 HydrophobicContact CD2-CG2 4.15Å; L216-V218 HydrophobicContact CG-CG2 3.74Å; L216-H232 CarbonylContact O-C 3.54Å; L216-H232 WeakPolarHBondContact O-CA 3.33Å; L216-Y233 HydrophobicContact CD2-CD2 4.44Å; L216-Y233 PolarHBondContact N-O 2.91Å; L216-Y233 PolarHBondContact O-N 3.05Å; L216-I235 HydrophobicContact CB-CD1 4.03Å; L216-I235 HydrophobicContact CB-CG1 4.23Å; L216-I246 HydrophobicContact CB-CD1 4.46Å; L216-I246 HydrophobicContact CD2-CD1 3.65Å; L216-L269 HydrophobicContact CD2-CD1 3.99Å; L216-L273 HydrophobicContact CD1-CD1 4.29Å; L216-L273 HydrophobicContact CD1-CD2 4.22Å; L216-L273 HydrophobicContact CD2-CD1 4.32Å; L216-L273 HydrophobicContact CD2-CD2 4.23Å
217	S	97.2	Very high	89.2	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	129.7	176.8	-51.5	0	0	0	0	108.8	Y203 L204 R206 K231 H232	Y203-S217 CarbonylContact C-O 3.4Å; Y203-S217 WeakPolarHBondContact CA-O 3.26Å; L204-S217 PolarHBondContact N-O 3.06Å; L204-S217 PolarHBondContact O-N 2.99Å; R206-S217 PolarHBondContact NE-OG 3.43Å; R206-S217 VanDerWaalsContact NE-OG 3.07Å; S217-K231 CarbonylContact C-O 3.6Å; S217-K231 WeakPolarHBondContact CA-O 3.38Å; S217-H232 WeakPolarHBondContact CB-ND1 3.48Å; S217-H232 PolarHBondContact OG-ND1 2.7Å
218	V	97.7	Very high	89.4	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	125.7	-171.1	-169.9	0	0	0	0	110.7	T202 L216 V230 K231 Y233 L273	T202-V218 WeakPolarHBondContact O-CA 3.34Å; L216-V218 HydrophobicContact CD1-CG2 4.03Å; L216-V218 HydrophobicContact CD2-CG2 4.15Å; L216-V218 HydrophobicContact CG-CG2 3.74Å; V218-V230 WeakPolarHBondContact O-CA 3.46Å; V218-K231 PolarHBondContact N-O 2.71Å; V218-K231 PolarHBondContact O-N 3.37Å; V218-Y233 HydrophobicContact CB-CE2 4.47Å; V218-Y233 HydrophobicContact CG2-CD2 4.12Å; V218-Y233 HydrophobicContact CG2-CE2 4.07Å; V218-L273 HydrophobicContact CG1-CD2 4.09Å; V218-L273 HydrophobicContact CG2-CD2 3.7Å
219	R	97.4	Very high	89.7	Confident	11 Å²	11	67 Å²	67	4%	0.042	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	126.6	172.5	-172	-166.2	176.2	124.5	-10	110.4	L193 L194 L195 N198 G201 T202 W228	L193-R219 HydrophobicContact CB-CB 4.36Å; L193-R219 VanDerWaalsContact O-CD 3.29Å; L193-R219 WeakPolarHBondContact O-CD 3.46Å; L193-R219 PolarHBondContact O-NH1 3.37Å; L194-R219 PolarHBondContact O-NH1 3.3Å; L195-R219 PolarHBondContact O-NH1 3.26Å; N198-R219 WeakPolarHBondContact O-CD 3.44Å; N198-R219 PolarHBondContact O-NE 3.5Å; N198-R219 VanDerWaalsContact O-NE 3.09Å; N198-R219 PolarHBondContact O-NH1 3.15Å; G201-R219 PolarHBondContact N-O 2.79Å; T202-R219 PolarHBondContact O-N 2.75Å; R219-W228 HydrophobicContact CG-CE3 3.78Å; R219-W228 HydrophobicContact CG-CZ3 4.1Å
220	H	96	Very high	90.6	Very high	30 Å²	30	63.4 Å²	63.4	14%	0.139	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	152.2	-179.4	-173.8	79.7	0	0	0	111.3	V229 K231 C270	H220-V229 HydrophobicContact CB-CG2 4.26Å; H220-V229 PolarHBondContact N-O 3.04Å; H220-V229 PolarHBondContact O-N 2.93Å; H220-K231 HydrophobicContact CB-CG 4.33Å; H220-C270 HydrophobicContact CB-CB 4.36Å; H220-C270 PolarHBondContact CE1-O 3.35Å; H220-C270 PolarHBondContact ND1-O 2.94Å
221	H	94.8	Very high	91.8	Very high	46 Å²	46	62.9 Å²	62.9	21%	0.213	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	112.4	171.8	-177.5	-85.8	0	0	0	108.8	S223 W228	H221-S223 PolarHBondContact O-N 2.7Å; H221-W228 HydrophobicContact CB-CD2 4.32Å; H221-W228 HydrophobicContact CB-CE3 3.97Å; H221-W228 HydrophobicContact CB-CH2 4.11Å; H221-W228 HydrophobicContact CB-CZ2 4.42Å; H221-W228 HydrophobicContact CB-CZ3 3.87Å; H221-W228 AromaticContact CD2-CE2 3.86Å
222	D	92	Very high	92.9	Very high	24 Å²	24	60.9 Å²	60.9	13%	0.128	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	105.6	174.1	-170.8	-39.1	0	0	0	108.7	E224 K225 N226 M227 V229	D222-E224 VanDerWaalsContact C-N 3.29Å; D222-E224 PolarHBondContact O-N 3.44Å; D222-E224 PolarHBondContact OD1-N 3.39Å; D222-K225 HydrophobicContact CB-CB 4.38Å; D222-K225 PolarHBondContact OD1-N 3.42Å; D222-K225 VanDerWaalsContact OD1-N 3.09Å; D222-N226 VanDerWaalsContact O-CA 3.28Å; D222-N226 WeakPolarHBondContact O-CA 3.2Å; D222-N226 PolarHBondContact O-N 3.42Å; D222-M227 PolarHBondContact N-O 3.05Å; D222-M227 PolarHBondContact O-N 2.73Å; D222-V229 HydrophobicContact CB-CG1 4.2Å; D222-V229 HydrophobicContact CB-CG2 4.08Å
223	S	92.4	Very high	93.8	Very high	97 Å²	97	55.9 Å²	55.9	68%	0.678	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-24.8	-177.1	-59	0	0	0	0	113.4	H221	H221-S223 PolarHBondContact O-N 2.7Å
224	E	91.9	Very high	94.1	Very high	189 Å²	189	58.4 Å²	58.4	88%	0.883	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-43.1	-179.6	-65.2	179.1	-178.3	0	0	110.5	D222 N226	D222-E224 VanDerWaalsContact C-N 3.29Å; D222-E224 PolarHBondContact O-N 3.44Å; D222-E224 PolarHBondContact OD1-N 3.39Å; E224-N226 VanDerWaalsContact C-N 3.33Å
225	K	89.1	Confident	94.2	Very high	138 Å²	138	56 Å²	56	60%	0.6	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-7.2	177.2	-62.1	-177.5	-179.1	-176.1	0	113.5	D222 M227	D222-K225 HydrophobicContact CB-CB 4.38Å; D222-K225 PolarHBondContact OD1-N 3.42Å; D222-K225 VanDerWaalsContact OD1-N 3.09Å; K225-M227 VanDerWaalsContact C-N 3.28Å; K225-M227 HydrophobicContact CB-CE 4.35Å; K225-M227 HydrophobicContact CB-CG 3.57Å; K225-M227 HydrophobicContact CB-SD 3.94Å; K225-M227 HydrophobicContact CD-SD 4.13Å; K225-M227 PolarHBondContact O-N 2.7Å
226	N	92	Very high	94	Very high	129 Å²	129	60.9 Å²	60.9	69%	0.69	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	47.3	-174.3	-166.5	44.1	0	0	0	112.9	D222 E224	D222-N226 VanDerWaalsContact O-CA 3.28Å; D222-N226 WeakPolarHBondContact O-CA 3.2Å; D222-N226 PolarHBondContact O-N 3.42Å; E224-N226 VanDerWaalsContact C-N 3.33Å
227	M	92.3	Very high	93.6	Very high	95 Å²	95	63.8 Å²	63.8	47%	0.468	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	155.2	-177.9	60.1	175.4	49.2	0	0	112.5	D222 K225 V229	D222-M227 PolarHBondContact N-O 3.05Å; D222-M227 PolarHBondContact O-N 2.73Å; K225-M227 VanDerWaalsContact C-N 3.28Å; K225-M227 HydrophobicContact CB-CE 4.35Å; K225-M227 HydrophobicContact CB-CG 3.57Å; K225-M227 HydrophobicContact CB-SD 3.94Å; K225-M227 HydrophobicContact CD-SD 4.13Å; K225-M227 PolarHBondContact O-N 2.7Å; M227-V229 HydrophobicContact CG-CG1 4.04Å; M227-V229 HydrophobicContact SD-CG1 4.31Å
228	W	93.9	Very high	93.1	Very high	106 Å²	106	66.9 Å²	66.9	40%	0.402	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	133.3	170.8	-69.3	97.6	0	0	0	110.1	L194 K200 R219 H221	L194-W228 HydrophobicContact CD2-CB 3.83Å; K200-W228 HydrophobicContact CB-CH2 3.98Å; K200-W228 HydrophobicContact CB-CZ3 3.91Å; R219-W228 HydrophobicContact CG-CE3 3.78Å; R219-W228 HydrophobicContact CG-CZ3 4.1Å; H221-W228 HydrophobicContact CB-CD2 4.32Å; H221-W228 HydrophobicContact CB-CE3 3.97Å; H221-W228 HydrophobicContact CB-CH2 4.11Å; H221-W228 HydrophobicContact CB-CZ2 4.42Å; H221-W228 HydrophobicContact CB-CZ3 3.87Å; H221-W228 AromaticContact CD2-CE2 3.86Å
229	V	94.1	Very high	92.4	Very high	28 Å²	28	73.6 Å²	73.6	17%	0.17	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	162.6	179.2	-59.9	0	0	0	0	109.6	H220 D222 M227	H220-V229 HydrophobicContact CB-CG2 4.26Å; H220-V229 PolarHBondContact N-O 3.04Å; H220-V229 PolarHBondContact O-N 2.93Å; D222-V229 HydrophobicContact CB-CG1 4.2Å; D222-V229 HydrophobicContact CB-CG2 4.08Å; M227-V229 HydrophobicContact CG-CG1 4.04Å; M227-V229 HydrophobicContact SD-CG1 4.31Å
230	V	95.1	Very high	91.4	Very high	20 Å²	20	81 Å²	81	12%	0.121	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	136.1	169.7	-178.8	0	0	0	0	109.3	D190 L193 L194 V218	D190-V230 HydrophobicContact CB-CG2 4.37Å; D190-V230 WeakPolarHBondContact OD1-CB 3.28Å; D190-V230 VanDerWaalsContact OD1-CG1 3.27Å; D190-V230 WeakPolarHBondContact OD1-CG1 3.39Å; L193-V230 HydrophobicContact CB-CG2 3.75Å; L193-V230 HydrophobicContact CD1-CG1 3.58Å; L193-V230 HydrophobicContact CD1-CG2 4.11Å; L194-V230 HydrophobicContact CD1-CG2 4.44Å; L194-V230 HydrophobicContact CD2-CG2 4.01Å; L194-V230 HydrophobicContact CG-CG2 3.88Å; V218-V230 WeakPolarHBondContact O-CA 3.46Å
231	K	95.4	Very high	90.3	Very high	84 Å²	84	86 Å²	86	37%	0.365	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	133.1	172.9	-62.1	-64.3	-175	-178.6	0	108.6	S217 V218 H220 Y233 C270	S217-K231 CarbonylContact C-O 3.6Å; S217-K231 WeakPolarHBondContact CA-O 3.38Å; V218-K231 PolarHBondContact N-O 2.71Å; V218-K231 PolarHBondContact O-N 3.37Å; H220-K231 HydrophobicContact CB-CG 4.33Å; K231-Y233 HydrophobicContact CB-CE2 3.78Å; K231-C270 HydrophobicContact CB-CB 4.46Å; K231-C270 HydrophobicContact CG-CB 3.97Å
232	H	94.6	Very high	89.4	Confident	49 Å²	49	85.9 Å²	85.9	23%	0.227	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	132.7	178.9	-52.2	-79.1	0	0	0	110.9	R186 D190 R206 L216 S217	R186-H232 WeakPolarHBondContact CG-NE2 3.4Å; D190-H232 IonicContact OD1-CE1 3.67Å; D190-H232 PolarHBondContact OD1-CE1 3.25Å; D190-H232 IonicContact OD1-NE2 3.74Å; D190-H232 PolarHBondContact OD1-NE2 2.8Å; D190-H232 IonicContact OD2-NE2 3.38Å; R206-H232 PolarHBondContact NH2-ND1 3.42Å; R206-H232 VanDerWaalsContact NH2-ND1 3.18Å; L216-H232 CarbonylContact O-C 3.54Å; L216-H232 WeakPolarHBondContact O-CA 3.33Å; S217-H232 WeakPolarHBondContact CB-ND1 3.48Å; S217-H232 PolarHBondContact OG-ND1 2.7Å
233	Y	94.9	Very high	89.2	Confident	44 Å²	44	84.8 Å²	84.8	17%	0.173	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	129.2	177.5	-57.7	-86.2	0	0	0	108.5	A215 L216 V218 K231 I235 I246 L269 C270	A215-Y233 CarbonylContact C-O 3.55Å; A215-Y233 WeakPolarHBondContact CA-O 3.12Å; L216-Y233 HydrophobicContact CD2-CD2 4.44Å; L216-Y233 PolarHBondContact N-O 2.91Å; L216-Y233 PolarHBondContact O-N 3.05Å; V218-Y233 HydrophobicContact CB-CE2 4.47Å; V218-Y233 HydrophobicContact CG2-CD2 4.12Å; V218-Y233 HydrophobicContact CG2-CE2 4.07Å; K231-Y233 HydrophobicContact CB-CE2 3.78Å; Y233-I235 PolarHBondContact O-N 3.33Å; Y233-I246 HydrophobicContact CD1-CG2 4.32Å; Y233-L269 HydrophobicContact CD1-CD2 3.43Å; Y233-L269 VanDerWaalsContact CD1-CD2 3.43Å; Y233-L269 HydrophobicContact CD2-CD2 3.72Å; Y233-L269 HydrophobicContact CE1-CD2 3.53Å; Y233-L269 HydrophobicContact CE2-CB 4.49Å; Y233-L269 HydrophobicContact CE2-CD2 3.81Å; Y233-L269 HydrophobicContact CG-CD2 3.53Å; Y233-C270 VanDerWaalsContact OH-CB 3.29Å; Y233-C270 WeakPolarHBondContact OH-CB 3.45Å; Y233-C270 PolarHBondContact OH-N 3.17Å; Y233-C270 PolarHBondContact OH-SG 2.77Å
234	R	92.9	Very high	89.2	Confident	80 Å²	80	81.8 Å²	81.8	30%	0.302	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	124.9	176.7	-175.4	159.9	56.8	136.8	-23.5	109.6	E210 N213 R236	E210-R234 IonicContact OE1-CZ 3.69Å; E210-R234 IonicContact OE1-NH2 2.74Å; E210-R234 IonicContact OE2-CZ 3.9Å; E210-R234 IonicContact OE2-NE 3.8Å; E210-R234 IonicContact OE2-NH1 3.83Å; E210-R234 PolarHBondContact OE2-NH1 3.19Å; E210-R234 IonicContact OE2-NH2 2.7Å; N213-R234 HydrophobicContact CB-CG 4.17Å; R234-R236 HydrophobicContact CG-CG 4.17Å
235	I	93.1	Very high	89.3	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	115.9	168.6	-55.2	173.1	0	0	0	106.8	I205 Y214 L216 Y233 F244 F245 I246 I255 L258	I205-I235 HydrophobicContact CD1-CD1 3.77Å; Y214-I235 PolarHBondContact N-O 3.22Å; Y214-I235 PolarHBondContact O-N 3.14Å; L216-I235 HydrophobicContact CB-CD1 4.03Å; L216-I235 HydrophobicContact CB-CG1 4.23Å; Y233-I235 PolarHBondContact O-N 3.33Å; I235-F244 HydrophobicContact CG2-CB 3.96Å; I235-F244 HydrophobicContact CG2-CD1 4.26Å; I235-F245 WeakPolarHBondContact CA-O 3.38Å; I235-I246 HydrophobicContact CG1-CD1 4.27Å; I235-I246 HydrophobicContact CG1-CG1 3.9Å; I235-I255 HydrophobicContact CD1-CD1 4.36Å; I235-I255 HydrophobicContact CG2-CD1 4.38Å; I235-L258 HydrophobicContact CD1-CD1 4.48Å; I235-L258 HydrophobicContact CD1-CD2 4.26Å; I235-L258 HydrophobicContact CG1-CD1 4.41Å; I235-L258 HydrophobicContact CG2-CD1 3.89Å
236	R	91.1	Very high	89.4	Confident	108 Å²	108	68.7 Å²	68.7	41%	0.408	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	151.9	176.7	-62.7	-174.7	-175.1	-171.1	2.2	110.6	N213 R234 F244 F245	N213-R236 WeakPolarHBondContact OD1-CA 3.41Å; R234-R236 HydrophobicContact CG-CG 4.17Å; R236-F244 WeakPolarHBondContact O-CA 3.42Å; R236-F245 HydrophobicContact CB-CD1 4.12Å; R236-F245 HydrophobicContact CB-CD2 4.42Å; R236-F245 HydrophobicContact CB-CE1 3.56Å; R236-F245 HydrophobicContact CB-CE2 3.93Å; R236-F245 HydrophobicContact CB-CZ 3.48Å; R236-F245 VanDerWaalsContact CB-CZ 3.48Å; R236-F245 HydrophobicContact CG-CE2 4.37Å; R236-F245 HydrophobicContact CG-CZ 4.22Å; R236-F245 PolarHBondContact N-O 2.93Å; R236-F245 PolarHBondContact O-N 3.47Å
237	I	88.2	Confident	89.4	Confident	62 Å²	62	64.4 Å²	64.4	32%	0.318	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	131.8	175.6	-48.2	-179.8	0	0	0	107.7	Q212 Y214 F244	Q212-I237 VanDerWaalsContact O-CD1 3.28Å; Q212-I237 WeakPolarHBondContact O-CD1 3.39Å; Y214-I237 HydrophobicContact CD2-CD1 4.39Å; Y214-I237 HydrophobicContact CE2-CD1 3.78Å; Y214-I237 HydrophobicContact CE2-CG1 4.32Å; I237-F244 HydrophobicContact CD1-CE1 4.21Å; I237-F244 HydrophobicContact CG1-CD1 4.06Å; I237-F244 HydrophobicContact CG1-CE1 3.92Å; I237-F244 HydrophobicContact CG2-CE1 4.4Å
238	L	85.7	Confident	89.1	Confident	64 Å²	64	66.7 Å²	66.7	34%	0.335	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-77.4	145.3	170.5	-83.5	153.2	0	0	0	110.4	G242 G243 F245 T251	L238-G242 VanDerWaalsContact CD1-O 3.26Å; L238-G242 WeakPolarHBondContact CD1-O 3.35Å; L238-G243 PolarHBondContact N-O 2.64Å; L238-F245 HydrophobicContact CD1-CD1 4.03Å; L238-F245 HydrophobicContact CD1-CE1 4.41Å; L238-F245 HydrophobicContact CD2-CE1 4.18Å; L238-F245 HydrophobicContact CG-CD1 3.82Å; L238-F245 HydrophobicContact CG-CE1 3.73Å; L238-T251 HydrophobicContact CD1-CG2 3.69Å
239	D	83.2	Confident	88.8	Confident	142 Å²	142	72.2 Å²	72.2	76%	0.759	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-56.4	157	173	-62.9	-33.3	0	0	0	111.5	N241 G242	D239-N241 VanDerWaalsContact C-N 3.31Å; D239-N241 PolarHBondContact O-N 3.09Å; D239-G242 PolarHBondContact O-N 2.81Å
240	N	77.1	Confident	88.7	Confident	166 Å²	166	72.2 Å²	72.2	89%	0.888	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	57.4	35.9	176.1	-55.6	-34.5	0	0	0	114.7	G242	N240-G242 PolarHBondContact O-N 3.26Å
241	N	72.6	Confident	88.6	Confident	136 Å²	136	75 Å²	75	73%	0.727	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	57.4	32.9	-174.3	-70.8	22.9	0	0	0	113.1	D239 G243	D239-N241 VanDerWaalsContact C-N 3.31Å; D239-N241 PolarHBondContact O-N 3.09Å; N241-G243 PolarHBondContact O-N 3.17Å
242	G	75.3	Confident	88.6	Confident	42 Å²	42	71.9 Å²	71.9	43%	0.433	36%	0.361	S	S	.	.			trans	-69.2	-0.4	-179.4	0	0	0	0	0	115.1	L238 D239 N240	L238-G242 VanDerWaalsContact CD1-O 3.26Å; L238-G242 WeakPolarHBondContact CD1-O 3.35Å; D239-G242 PolarHBondContact O-N 2.81Å; N240-G242 PolarHBondContact O-N 3.26Å
243	G	88.8	Confident	88.4	Confident	2 Å²	2	74 Å²	74	2%	0.021	38%	0.379	C	S	.	.			trans	103.2	-161.4	177.9	0	0	0	0	0	113.9	L238 N241 F252	L238-G243 PolarHBondContact N-O 2.64Å; N241-G243 PolarHBondContact O-N 3.17Å; G243-F252 CarbonylContact C-O 3.59Å; G243-F252 WeakPolarHBondContact CA-O 3.4Å
244	F	92.3	Very high	88.2	Confident	33 Å²	33	74.6 Å²	74.6	15%	0.145	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	144.9	-170.4	-57.3	-90.5	0	0	0	110.3	Y214 I235 R236 I237 F252 I255 L258	Y214-F244 HydrophobicContact CD2-CD1 4.49Å; Y214-F244 HydrophobicContact CD2-CE1 4.35Å; Y214-F244 HydrophobicContact CE2-CD1 4.47Å; Y214-F244 AromaticContact CE2-CE1 3.89Å; Y214-F244 HydrophobicContact CE2-CE1 3.89Å; I235-F244 HydrophobicContact CG2-CB 3.96Å; I235-F244 HydrophobicContact CG2-CD1 4.26Å; R236-F244 WeakPolarHBondContact O-CA 3.42Å; I237-F244 HydrophobicContact CD1-CE1 4.21Å; I237-F244 HydrophobicContact CG1-CD1 4.06Å; I237-F244 HydrophobicContact CG1-CE1 3.92Å; I237-F244 HydrophobicContact CG2-CE1 4.4Å; F244-F252 PolarHBondContact N-O 2.84Å; F244-F252 PolarHBondContact O-N 3.14Å; F244-I255 HydrophobicContact CB-CG1 4.34Å; F244-I255 HydrophobicContact CD1-CD1 3.97Å; F244-I255 HydrophobicContact CD1-CG1 3.68Å; F244-I255 HydrophobicContact CD2-CG1 4.16Å; F244-I255 HydrophobicContact CE1-CD1 4.17Å; F244-I255 HydrophobicContact CE1-CG1 3.99Å; F244-I255 HydrophobicContact CE2-CG1 4.43Å; F244-I255 HydrophobicContact CG-CG1 3.77Å; F244-I255 HydrophobicContact CZ-CG1 4.34Å; F244-L258 HydrophobicContact CB-CD1 4.19Å
245	F	92.9	Very high	88.1	Confident	18 Å²	18	71 Å²	71	8%	0.079	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	151	178.3	68.8	-82.3	0	0	0	112.8	I235 R236 L238 I248 T250 T251	I235-F245 WeakPolarHBondContact CA-O 3.38Å; R236-F245 HydrophobicContact CB-CD1 4.12Å; R236-F245 HydrophobicContact CB-CD2 4.42Å; R236-F245 HydrophobicContact CB-CE1 3.56Å; R236-F245 HydrophobicContact CB-CE2 3.93Å; R236-F245 HydrophobicContact CB-CZ 3.48Å; R236-F245 VanDerWaalsContact CB-CZ 3.48Å; R236-F245 HydrophobicContact CG-CE2 4.37Å; R236-F245 HydrophobicContact CG-CZ 4.22Å; R236-F245 PolarHBondContact N-O 2.93Å; R236-F245 PolarHBondContact O-N 3.47Å; L238-F245 HydrophobicContact CD1-CD1 4.03Å; L238-F245 HydrophobicContact CD1-CE1 4.41Å; L238-F245 HydrophobicContact CD2-CE1 4.18Å; L238-F245 HydrophobicContact CG-CD1 3.82Å; L238-F245 HydrophobicContact CG-CE1 3.73Å; F245-I248 HydrophobicContact CD2-CG2 4.05Å; F245-I248 HydrophobicContact CE2-CG2 3.51Å; F245-I248 HydrophobicContact CZ-CG2 4.19Å; F245-T250 WeakPolarHBondContact CB-O 3.49Å; F245-T251 HydrophobicContact CB-CG2 4.08Å
246	I	93	Very high	88.1	Confident	35 Å²	35	74.7 Å²	74.7	18%	0.179	39%	0.389	C	S	.	.	S	Bend	trans	-97.8	-43.9	165.9	-67.2	173.1	0	0	0	109.6	L216 Y233 I235 L258 Y262 L269	L216-I246 HydrophobicContact CB-CD1 4.46Å; L216-I246 HydrophobicContact CD2-CD1 3.65Å; Y233-I246 HydrophobicContact CD1-CG2 4.32Å; I235-I246 HydrophobicContact CG1-CD1 4.27Å; I235-I246 HydrophobicContact CG1-CG1 3.9Å; I246-L258 HydrophobicContact CD1-CD2 4.2Å; I246-L258 HydrophobicContact CG1-CD1 4.39Å; I246-Y262 HydrophobicContact CD1-CD2 4.3Å; I246-Y262 HydrophobicContact CD1-CE2 3.78Å; I246-Y262 HydrophobicContact CG1-CE2 4.4Å; I246-L269 HydrophobicContact CD1-CD2 4.12Å
247	S	90.6	Very high	88.2	Confident	39 Å²	39	72.5 Å²	72.5	27%	0.273	39%	0.385	S	S	.	.	S	Bend	trans	-116.2	137	174	174.5	0	0	0	0	109.2	R249 T250	S247-R249 PolarHBondContact O-N 2.84Å; S247-R249 PolarHBondContact OG-N 3.13Å; S247-T250 PolarHBondContact O-N 3.4Å; S247-T250 VanDerWaalsContact O-N 3.12Å; S247-T250 VanDerWaalsContact O-O 3.08Å
248	I	86.1	Confident	88.5	Confident	143 Å²	143	69.6 Å²	69.6	73%	0.733	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-12.7	179.1	58.2	166.8	0	0	0	113.9	F245 T250	F245-I248 HydrophobicContact CD2-CG2 4.05Å; F245-I248 HydrophobicContact CE2-CG2 3.51Å; F245-I248 HydrophobicContact CZ-CG2 4.19Å; I248-T250 VanDerWaalsContact C-N 3.29Å
249	R	89	Confident	89	Confident	221 Å²	221	66.7 Å²	66.7	83%	0.834	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-22.6	178.2	-62.4	-177.9	-177.9	179.2	-0.3	112.9	S247	S247-R249 PolarHBondContact O-N 2.84Å; S247-R249 PolarHBondContact OG-N 3.13Å
250	T	91.2	Very high	89.6	Confident	29 Å²	29	63.7 Å²	63.7	18%	0.178	34%	0.339	C	S	.	.			trans	-144.2	111.3	-169.2	-8.4	0	0	0	0	109.1	F245 S247 I248 F252 Y261 D267	F245-T250 WeakPolarHBondContact CB-O 3.49Å; S247-T250 PolarHBondContact O-N 3.4Å; S247-T250 VanDerWaalsContact O-N 3.12Å; S247-T250 VanDerWaalsContact O-O 3.08Å; I248-T250 VanDerWaalsContact C-N 3.29Å; T250-F252 HydrophobicContact CG2-CZ 4.13Å; T250-Y261 HydrophobicContact CG2-CE1 4.46Å; T250-D267 PolarHBondContact OG1-OD2 3.34Å
251	T	93.6	Very high	90.5	Very high	78 Å²	78	58.8 Å²	58.8	48%	0.479	31%	0.308	S	S	.	.			trans	-116.3	150.5	-176.5	62.3	0	0	0	0	110.6	L238 F245	L238-T251 HydrophobicContact CD1-CG2 3.69Å; F245-T251 HydrophobicContact CB-CG2 4.08Å
252	F	93.9	Very high	91.7	Very high	19 Å²	19	52.3 Å²	52.3	8%	0.083	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-133.4	141.7	-174.3	-54.8	-82.4	0	0	0	110.8	G243 F244 T250 N254 D257 L258 Y261 Y262	G243-F252 CarbonylContact C-O 3.59Å; G243-F252 WeakPolarHBondContact CA-O 3.4Å; F244-F252 PolarHBondContact N-O 2.84Å; F244-F252 PolarHBondContact O-N 3.14Å; T250-F252 HydrophobicContact CG2-CZ 4.13Å; F252-N254 VanDerWaalsContact C-N 3.29Å; F252-N254 PolarHBondContact O-N 3.32Å; F252-D257 HydrophobicContact CB-CB 4.3Å; F252-D257 HydrophobicContact CD1-CB 4.37Å; F252-L258 HydrophobicContact CB-CB 3.98Å; F252-L258 HydrophobicContact CD1-CB 4.49Å; F252-L258 HydrophobicContact CD2-CB 3.55Å; F252-L258 HydrophobicContact CD2-CD1 3.83Å; F252-L258 HydrophobicContact CD2-CG 3.65Å; F252-L258 HydrophobicContact CE2-CB 4.17Å; F252-L258 HydrophobicContact CE2-CD1 4.32Å; F252-L258 HydrophobicContact CE2-CG 3.93Å; F252-L258 HydrophobicContact CG-CB 3.74Å; F252-L258 HydrophobicContact CG-CG 4.36Å; F252-Y261 VanDerWaalsContact CE1-CB 3.41Å; F252-Y261 HydrophobicContact CE1-CD1 4.14Å; F252-Y261 HydrophobicContact CE1-CD2 4.03Å; F252-Y261 AromaticContact CE1-CG 3.6Å; F252-Y261 HydrophobicContact CE1-CG 3.6Å; F252-Y261 AromaticContact CZ-CD1 3.56Å; F252-Y261 HydrophobicContact CZ-CD1 3.56Å; F252-Y261 HydrophobicContact CZ-CD2 4.19Å; F252-Y261 HydrophobicContact CZ-CE1 4.24Å; F252-Y261 AromaticContact CZ-CG 3.52Å; F252-Y261 HydrophobicContact CZ-CG 3.52Å; F252-Y262 HydrophobicContact CE2-CE2 4.15Å
253	P	91.1	Very high	92.8	Very high	94 Å²	94	52.6 Å²	52.6	61%	0.61	27%	0.267	S	S	*	.	S	Bend	trans	-68.2	-27.8	-178.8	27.9	-34.7	0	0	0	113.1	D257	P253-D257 VanDerWaalsContact CG-OD2 3.29Å; P253-D257 WeakPolarHBondContact CG-OD2 3.42Å
254	N	89.9	Confident	93.2	Very high	56 Å²	56	56.2 Å²	56.2	30%	0.299	29%	0.289	S	S	.	.	S	Bend	trans	-144.5	166	176.9	62.9	68	0	0	0	111.1	F252 Q256 D257 L258	F252-N254 VanDerWaalsContact C-N 3.29Å; F252-N254 PolarHBondContact O-N 3.32Å; N254-Q256 VanDerWaalsContact C-N 3.31Å; N254-Q256 PolarHBondContact O-N 3.32Å; N254-Q256 WeakPolarHBondContact OD1-CA 2.84Å; N254-Q256 WeakPolarHBondContact OD1-CB 3.14Å; N254-Q256 PolarHBondContact OD1-N 2.91Å; N254-D257 PolarHBondContact ND2-OD2 2.83Å; N254-D257 PolarHBondContact O-N 3.43Å; N254-D257 PolarHBondContact OD1-N 3.2Å; N254-D257 PolarHBondContact OD1-OD2 3.41Å; N254-L258 PolarHBondContact O-N 3.47Å
255	I	91.8	Very high	93.3	Very high	5 Å²	5	58.8 Å²	58.8	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-68.5	-28.7	-179	-63.6	-160	0	0	0	112.3	P175 L178 I205 Y214 I235 F244 D257 L258 I259	P175-I255 HydrophobicContact CB-CD1 3.86Å; P175-I255 HydrophobicContact CG-CB 4.33Å; P175-I255 HydrophobicContact CG-CD1 3.32Å; P175-I255 HydrophobicContact CG-CG1 3.85Å; L178-I255 HydrophobicContact CD1-CB 4.04Å; L178-I255 HydrophobicContact CD1-CG2 3.67Å; I205-I255 HydrophobicContact CD1-CG2 4.42Å; I205-I255 HydrophobicContact CG1-CG2 4.25Å; Y214-I255 HydrophobicContact CD2-CD1 3.61Å; Y214-I255 HydrophobicContact CE2-CD1 4.04Å; Y214-I255 HydrophobicContact CG-CD1 4.04Å; I235-I255 HydrophobicContact CD1-CD1 4.36Å; I235-I255 HydrophobicContact CG2-CD1 4.38Å; F244-I255 HydrophobicContact CB-CG1 4.34Å; F244-I255 HydrophobicContact CD1-CD1 3.97Å; F244-I255 HydrophobicContact CD1-CG1 3.68Å; F244-I255 HydrophobicContact CD2-CG1 4.16Å; F244-I255 HydrophobicContact CE1-CD1 4.17Å; F244-I255 HydrophobicContact CE1-CG1 3.99Å; F244-I255 HydrophobicContact CE2-CG1 4.43Å; F244-I255 HydrophobicContact CG-CG1 3.77Å; F244-I255 HydrophobicContact CZ-CG1 4.34Å; I255-D257 VanDerWaalsContact C-N 3.35Å; I255-D257 PolarHBondContact O-N 3.23Å; I255-L258 WeakPolarHBondContact O-CB 3.42Å; I255-L258 PolarHBondContact O-N 3.05Å; I255-I259 HydrophobicContact CG2-CD1 3.89Å; I255-I259 HydrophobicContact CG2-CG1 4.24Å; I255-I259 WeakPolarHBondContact O-CG1 3.46Å; I255-I259 PolarHBondContact O-N 3.38Å
256	Q	91.9	Very high	93.2	Very high	76 Å²	76	60.4 Å²	60.4	36%	0.355	31%	0.313	S	S	.	.	H	α-helix	trans	-63.9	-41.9	177.5	-174.2	60.4	58	0	0	111.3	L178 N254 L258 I259 N260	L178-Q256 HydrophobicContact CD2-CB 4.28Å; L178-Q256 VanDerWaalsContact CD2-OE1 3.24Å; N254-Q256 VanDerWaalsContact C-N 3.31Å; N254-Q256 PolarHBondContact O-N 3.32Å; N254-Q256 WeakPolarHBondContact OD1-CA 2.84Å; N254-Q256 WeakPolarHBondContact OD1-CB 3.14Å; N254-Q256 PolarHBondContact OD1-N 2.91Å; Q256-L258 VanDerWaalsContact C-N 3.35Å; Q256-I259 PolarHBondContact O-N 3.33Å; Q256-N260 PolarHBondContact NE2-OD1 3.01Å; Q256-N260 WeakPolarHBondContact O-CB 3.46Å; Q256-N260 PolarHBondContact O-N 3.11Å; Q256-N260 PolarHBondContact O-ND2 3.1Å; Q256-N260 PolarHBondContact O-OD1 3.28Å
257	D	93.9	Very high	93.1	Very high	63 Å²	63	62.1 Å²	62.1	34%	0.337	32%	0.323	S	S	.	.	H	α-helix	trans	-66.9	-36.9	176.1	-69	-27.2	0	0	0	112	F252 P253 N254 I255 N260 Y261	F252-D257 HydrophobicContact CB-CB 4.3Å; F252-D257 HydrophobicContact CD1-CB 4.37Å; P253-D257 VanDerWaalsContact CG-OD2 3.29Å; P253-D257 WeakPolarHBondContact CG-OD2 3.42Å; N254-D257 PolarHBondContact ND2-OD2 2.83Å; N254-D257 PolarHBondContact O-N 3.43Å; N254-D257 PolarHBondContact OD1-N 3.2Å; N254-D257 PolarHBondContact OD1-OD2 3.41Å; I255-D257 VanDerWaalsContact C-N 3.35Å; I255-D257 PolarHBondContact O-N 3.23Å; D257-N260 PolarHBondContact O-N 3.39Å; D257-Y261 WeakPolarHBondContact O-CB 3.38Å; D257-Y261 PolarHBondContact O-N 3.38Å
258	L	95	Very high	93.1	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-58.7	-48.7	171.1	-176.8	155.4	0	0	0	110.8	I235 F244 I246 F252 N254 I255 Q256 Y261 Y262	I235-L258 HydrophobicContact CD1-CD1 4.48Å; I235-L258 HydrophobicContact CD1-CD2 4.26Å; I235-L258 HydrophobicContact CG1-CD1 4.41Å; I235-L258 HydrophobicContact CG2-CD1 3.89Å; F244-L258 HydrophobicContact CB-CD1 4.19Å; I246-L258 HydrophobicContact CD1-CD2 4.2Å; I246-L258 HydrophobicContact CG1-CD1 4.39Å; F252-L258 HydrophobicContact CB-CB 3.98Å; F252-L258 HydrophobicContact CD1-CB 4.49Å; F252-L258 HydrophobicContact CD2-CB 3.55Å; F252-L258 HydrophobicContact CD2-CD1 3.83Å; F252-L258 HydrophobicContact CD2-CG 3.65Å; F252-L258 HydrophobicContact CE2-CB 4.17Å; F252-L258 HydrophobicContact CE2-CD1 4.32Å; F252-L258 HydrophobicContact CE2-CG 3.93Å; F252-L258 HydrophobicContact CG-CB 3.74Å; F252-L258 HydrophobicContact CG-CG 4.36Å; N254-L258 PolarHBondContact O-N 3.47Å; I255-L258 WeakPolarHBondContact O-CB 3.42Å; I255-L258 PolarHBondContact O-N 3.05Å; Q256-L258 VanDerWaalsContact C-N 3.35Å; L258-Y261 PolarHBondContact O-N 3.22Å; L258-Y262 HydrophobicContact CD2-CD2 3.7Å; L258-Y262 HydrophobicContact CD2-CE2 3.97Å; L258-Y262 HydrophobicContact CG-CD2 4Å; L258-Y262 HydrophobicContact CG-CE2 3.94Å; L258-Y262 WeakPolarHBondContact O-CD2 3.49Å; L258-Y262 PolarHBondContact O-N 3.21Å
259	I	95.3	Very high	93.5	Very high	3 Å²	3	57.8 Å²	57.8	2%	0.015	32%	0.316	C	S	.	.	H	α-helix	trans	-60.6	-49.7	177.6	-71.2	166.3	0	0	0	110.3	L178 A180 Y203 I205 I255 Q256 Y261 Y262 T263 L273	L178-I259 HydrophobicContact CD1-CD1 4Å; A180-I259 HydrophobicContact CB-CD1 4.4Å; Y203-I259 HydrophobicContact CE2-CD1 4.1Å; Y203-I259 HydrophobicContact CE2-CG1 4.18Å; Y203-I259 HydrophobicContact CE2-CG2 3.82Å; Y203-I259 WeakPolarHBondContact OH-CG2 3.34Å; I205-I259 HydrophobicContact CD1-CD1 4.37Å; I205-I259 HydrophobicContact CG1-CD1 4.05Å; I255-I259 HydrophobicContact CG2-CD1 3.89Å; I255-I259 HydrophobicContact CG2-CG1 4.24Å; I255-I259 WeakPolarHBondContact O-CG1 3.46Å; I255-I259 PolarHBondContact O-N 3.38Å; Q256-I259 PolarHBondContact O-N 3.33Å; I259-Y261 PolarHBondContact O-N 3.38Å; I259-Y262 PolarHBondContact O-N 2.87Å; I259-Y262 VanDerWaalsContact O-N 3.08Å; I259-T263 HydrophobicContact CG2-CG2 4.4Å; I259-T263 WeakPolarHBondContact O-CG2 3.44Å; I259-T263 PolarHBondContact O-N 3.42Å; I259-L273 HydrophobicContact CG2-CD1 4.38Å
260	N	95.9	Very high	93.8	Very high	79 Å²	79	48.9 Å²	48.9	42%	0.422	29%	0.287	S	S	.	.	H	α-helix	trans	-58.6	-33.6	-179.3	-68.8	-15.7	0	0	0	112.5	Q256 D257 T263	Q256-N260 PolarHBondContact NE2-OD1 3.01Å; Q256-N260 WeakPolarHBondContact O-CB 3.46Å; Q256-N260 PolarHBondContact O-N 3.11Å; Q256-N260 PolarHBondContact O-ND2 3.1Å; Q256-N260 PolarHBondContact O-OD1 3.28Å; D257-N260 PolarHBondContact O-N 3.39Å; N260-T263 PolarHBondContact O-OG1 3.22Å
261	Y	97.3	Very high	94	Very high	63 Å²	63	48.3 Å²	48.3	25%	0.247	28%	0.284	C	S	.	.	H	α-helix	trans	-68.3	-48.1	174.2	177.3	-93.9	0	0	0	111.9	T250 F252 D257 L258 I259 T263 V264 H265 D267	T250-Y261 HydrophobicContact CG2-CE1 4.46Å; F252-Y261 VanDerWaalsContact CE1-CB 3.41Å; F252-Y261 HydrophobicContact CE1-CD1 4.14Å; F252-Y261 HydrophobicContact CE1-CD2 4.03Å; F252-Y261 AromaticContact CE1-CG 3.6Å; F252-Y261 HydrophobicContact CE1-CG 3.6Å; F252-Y261 AromaticContact CZ-CD1 3.56Å; F252-Y261 HydrophobicContact CZ-CD1 3.56Å; F252-Y261 HydrophobicContact CZ-CD2 4.19Å; F252-Y261 HydrophobicContact CZ-CE1 4.24Å; F252-Y261 AromaticContact CZ-CG 3.52Å; F252-Y261 HydrophobicContact CZ-CG 3.52Å; D257-Y261 WeakPolarHBondContact O-CB 3.38Å; D257-Y261 PolarHBondContact O-N 3.38Å; L258-Y261 PolarHBondContact O-N 3.22Å; I259-Y261 PolarHBondContact O-N 3.38Å; Y261-T263 VanDerWaalsContact C-N 3.31Å; Y261-T263 PolarHBondContact O-N 2.84Å; Y261-V264 PolarHBondContact O-N 3.34Å; Y261-V264 VanDerWaalsContact O-N 3.13Å; Y261-H265 HydrophobicContact CD1-CB 4.41Å; Y261-H265 AromaticContact CD2-ND1 3.69Å; Y261-H265 HydrophobicContact CE1-CB 3.86Å; Y261-H265 HydrophobicContact CE2-CB 4.22Å; Y261-H265 AromaticContact CE2-CG 3.99Å; Y261-H265 AromaticContact CE2-ND1 3.54Å; Y261-H265 AromaticContact CZ-ND1 3.99Å; Y261-H265 PolarHBondContact O-N 2.76Å; Y261-H265 PolarHBondContact O-ND1 2.69Å; Y261-D267 HydrophobicContact CE1-CB 3.97Å; Y261-D267 PolarHBondContact OH-OD2 3.47Å
262	Y	97.4	Very high	94.2	Very high	1 Å²	1	51.9 Å²	51.9	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-76.6	-12	-174.7	-75.9	-65.2	0	0	0	114.7	I246 F252 L258 I259 V264 H265 D267 L269 L273	I246-Y262 HydrophobicContact CD1-CD2 4.3Å; I246-Y262 HydrophobicContact CD1-CE2 3.78Å; I246-Y262 HydrophobicContact CG1-CE2 4.4Å; F252-Y262 HydrophobicContact CE2-CE2 4.15Å; L258-Y262 HydrophobicContact CD2-CD2 3.7Å; L258-Y262 HydrophobicContact CD2-CE2 3.97Å; L258-Y262 HydrophobicContact CG-CD2 4Å; L258-Y262 HydrophobicContact CG-CE2 3.94Å; L258-Y262 WeakPolarHBondContact O-CD2 3.49Å; L258-Y262 PolarHBondContact O-N 3.21Å; I259-Y262 PolarHBondContact O-N 2.87Å; I259-Y262 VanDerWaalsContact O-N 3.08Å; Y262-V264 VanDerWaalsContact C-N 3.27Å; Y262-H265 WeakPolarHBondContact CA-O 3.14Å; Y262-H265 VanDerWaalsContact CD1-O 3.24Å; Y262-H265 WeakPolarHBondContact CD1-O 3.49Å; Y262-D267 HydrophobicContact CE1-CB 4.11Å; Y262-L269 HydrophobicContact CD1-CD1 3.3Å; Y262-L269 HydrophobicContact CD1-CG 3.61Å; Y262-L269 HydrophobicContact CD2-CD1 4.25Å; Y262-L269 HydrophobicContact CE1-CD1 3.91Å; Y262-L269 HydrophobicContact CE1-CD2 4.33Å; Y262-L269 HydrophobicContact CE1-CG 3.74Å; Y262-L269 HydrophobicContact CG-CD1 3.52Å; Y262-L269 HydrophobicContact CG-CG 4.29Å; Y262-L273 PolarHBondContact O-N 2.74Å
263	T	97.1	Very high	94.4	Very high	48 Å²	48	51.3 Å²	51.3	29%	0.294	29%	0.286	S	S	.	.	H	α-helix	trans	-68.8	-28.4	166.3	56.5	0	0	0	0	112	I259 N260 Y261 L273	I259-T263 HydrophobicContact CG2-CG2 4.4Å; I259-T263 WeakPolarHBondContact O-CG2 3.44Å; I259-T263 PolarHBondContact O-N 3.42Å; N260-T263 PolarHBondContact O-OG1 3.22Å; Y261-T263 VanDerWaalsContact C-N 3.31Å; Y261-T263 PolarHBondContact O-N 2.84Å; T263-L273 WeakPolarHBondContact CA-O 3.5Å; T263-L273 HydrophobicContact CG2-CB 3.85Å
264	V	97.1	Very high	94.6	Very high	77 Å²	77	49.3 Å²	49.3	47%	0.467	28%	0.275	S	S	.	.	H	α-helix	trans	-99.3	-42.9	-179.7	-175	0	0	0	0	111.8	Y261 Y262 R272	Y261-V264 PolarHBondContact O-N 3.34Å; Y261-V264 VanDerWaalsContact O-N 3.13Å; Y262-V264 VanDerWaalsContact C-N 3.27Å; V264-R272 WeakPolarHBondContact O-CD 3.49Å; V264-R272 VanDerWaalsContact O-CZ 3.31Å; V264-R272 PolarHBondContact O-NE 3.35Å
265	H	94.8	Very high	94.9	Very high	88 Å²	88	50.2 Å²	50.2	41%	0.407	28%	0.279	S	S	.	.			trans	-117.7	114.6	-172.3	-49.9	96.8	0	0	0	110.1	Y261 Y262 D267	Y261-H265 HydrophobicContact CD1-CB 4.41Å; Y261-H265 AromaticContact CD2-ND1 3.69Å; Y261-H265 HydrophobicContact CE1-CB 3.86Å; Y261-H265 HydrophobicContact CE2-CB 4.22Å; Y261-H265 AromaticContact CE2-CG 3.99Å; Y261-H265 AromaticContact CE2-ND1 3.54Å; Y261-H265 AromaticContact CZ-ND1 3.99Å; Y261-H265 PolarHBondContact O-N 2.76Å; Y261-H265 PolarHBondContact O-ND1 2.69Å; Y262-H265 WeakPolarHBondContact CA-O 3.14Å; Y262-H265 VanDerWaalsContact CD1-O 3.24Å; Y262-H265 WeakPolarHBondContact CD1-O 3.49Å; H265-D267 VanDerWaalsContact C-N 3.33Å; H265-D267 PolarHBondContact O-N 3.4Å
266	P	91.7	Very high	95.1	Very high	51 Å²	51	52.1 Å²	52.1	33%	0.331	29%	0.291	S	S	.	.			trans	-66	-36	177.7	25	-30.9	0	0	0	112	G268 L269 R272	P266-G268 VanDerWaalsContact C-N 3.3Å; P266-G268 PolarHBondContact O-N 2.71Å; P266-L269 WeakPolarHBondContact O-CA 3.29Å; P266-L269 WeakPolarHBondContact O-CB 3.46Å; P266-L269 VanDerWaalsContact O-CG 3.26Å; P266-L269 WeakPolarHBondContact O-CG 3.32Å; P266-L269 PolarHBondContact O-N 3.47Å; P266-R272 HydrophobicContact CB-CG 4.32Å; P266-R272 HydrophobicContact CG-CG 4.33Å
267	D	91	Very high	95.2	Very high	72 Å²	72	48.6 Å²	48.6	39%	0.385	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	36.4	52.7	173.3	-161.5	31.7	0	0	0	115.5	T250 Y261 Y262 H265	T250-D267 PolarHBondContact OG1-OD2 3.34Å; Y261-D267 HydrophobicContact CE1-CB 3.97Å; Y261-D267 PolarHBondContact OH-OD2 3.47Å; Y262-D267 HydrophobicContact CE1-CB 4.11Å; H265-D267 VanDerWaalsContact C-N 3.33Å; H265-D267 PolarHBondContact O-N 3.4Å
268	G	90.8	Very high	95	Very high	76 Å²	76	48.7 Å²	48.7	78%	0.784	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.3	-11.1	-179.2	0	0	0	0	0	115.6	P266	P266-G268 VanDerWaalsContact C-N 3.3Å; P266-G268 PolarHBondContact O-N 2.71Å
269	L	94.4	Very high	94.3	Very high	15 Å²	15	50.8 Å²	50.8	8%	0.079	29%	0.289	C	S	.	.	S	Bend	trans	-71.4	156.3	166.4	-55.6	-170.2	0	0	0	111.2	L216 Y233 I246 Y262 P266 C271 L273	L216-L269 HydrophobicContact CD2-CD1 3.99Å; Y233-L269 HydrophobicContact CD1-CD2 3.43Å; Y233-L269 VanDerWaalsContact CD1-CD2 3.43Å; Y233-L269 HydrophobicContact CD2-CD2 3.72Å; Y233-L269 HydrophobicContact CE1-CD2 3.53Å; Y233-L269 HydrophobicContact CE2-CB 4.49Å; Y233-L269 HydrophobicContact CE2-CD2 3.81Å; Y233-L269 HydrophobicContact CG-CD2 3.53Å; I246-L269 HydrophobicContact CD1-CD2 4.12Å; Y262-L269 HydrophobicContact CD1-CD1 3.3Å; Y262-L269 HydrophobicContact CD1-CG 3.61Å; Y262-L269 HydrophobicContact CD2-CD1 4.25Å; Y262-L269 HydrophobicContact CE1-CD1 3.91Å; Y262-L269 HydrophobicContact CE1-CD2 4.33Å; Y262-L269 HydrophobicContact CE1-CG 3.74Å; Y262-L269 HydrophobicContact CG-CD1 3.52Å; Y262-L269 HydrophobicContact CG-CG 4.29Å; P266-L269 WeakPolarHBondContact O-CA 3.29Å; P266-L269 WeakPolarHBondContact O-CB 3.46Å; P266-L269 VanDerWaalsContact O-CG 3.26Å; P266-L269 WeakPolarHBondContact O-CG 3.32Å; P266-L269 PolarHBondContact O-N 3.47Å; L269-C271 PolarHBondContact O-N 2.95Å; L269-L273 HydrophobicContact CD1-CD2 4.2Å; L269-L273 HydrophobicContact CD1-CG 4.46Å
270	C	94.2	Very high	93.2	Very high	33 Å²	33	54.5 Å²	54.5	22%	0.223	32%	0.32	C	S	.	.	S	Bend	trans	-64.8	-25.3	-179.4	61.3	0	0	0	0	112.8	H220 K231 Y233	H220-C270 HydrophobicContact CB-CB 4.36Å; H220-C270 PolarHBondContact CE1-O 3.35Å; H220-C270 PolarHBondContact ND1-O 2.94Å; K231-C270 HydrophobicContact CB-CB 4.46Å; K231-C270 HydrophobicContact CG-CB 3.97Å; Y233-C270 VanDerWaalsContact OH-CB 3.29Å; Y233-C270 WeakPolarHBondContact OH-CB 3.45Å; Y233-C270 PolarHBondContact OH-N 3.17Å; Y233-C270 PolarHBondContact OH-SG 2.77Å
271	C	95.9	Very high	91.9	Very high	17 Å²	17	53.5 Å²	53.5	12%	0.115	31%	0.311	C	S	.	.	S	Bend	trans	-163.4	170.6	171.1	52.6	0	0	0	0	110.1	K200 L269	K200-C271 HydrophobicContact CG-CB 4.41Å; L269-C271 PolarHBondContact O-N 2.95Å
272	R	97.5	Very high	91	Very high	154 Å²	154	57.3 Å²	57.3	58%	0.581	33%	0.325	S	S	*	.			trans	-61.5	147.1	167.5	-66.8	177.2	-177	172.5	-0.8	110.2	G201 V264 P266	G201-R272 WeakPolarHBondContact CA-O 3.37Å; V264-R272 WeakPolarHBondContact O-CD 3.49Å; V264-R272 VanDerWaalsContact O-CZ 3.31Å; V264-R272 PolarHBondContact O-NE 3.35Å; P266-R272 HydrophobicContact CB-CG 4.32Å; P266-R272 HydrophobicContact CG-CG 4.33Å
273	L	98	Very high	90.1	Very high	6 Å²	6	58.1 Å²	58.1	3%	0.031	33%	0.33	C	S	.	.			trans	-70.3	133.3	169.5	-55.3	-175.4	0	0	0	109.1	Y203 L216 V218 I259 Y262 T263 L269	Y203-L273 HydrophobicContact CD1-CB 3.73Å; Y203-L273 HydrophobicContact CD1-CD1 4.41Å; Y203-L273 HydrophobicContact CD1-CD2 4.22Å; Y203-L273 HydrophobicContact CD1-CG 4.33Å; Y203-L273 HydrophobicContact CD2-CD1 4.24Å; Y203-L273 HydrophobicContact CE1-CB 3.89Å; Y203-L273 HydrophobicContact CE2-CD1 4.4Å; Y203-L273 HydrophobicContact CG-CB 4.3Å; Y203-L273 HydrophobicContact CG-CD1 4.26Å; Y203-L273 HydrophobicContact CG-CD2 4.02Å; Y203-L273 HydrophobicContact CG-CG 4.42Å; L216-L273 HydrophobicContact CD1-CD1 4.29Å; L216-L273 HydrophobicContact CD1-CD2 4.22Å; L216-L273 HydrophobicContact CD2-CD1 4.32Å; L216-L273 HydrophobicContact CD2-CD2 4.23Å; V218-L273 HydrophobicContact CG1-CD2 4.09Å; V218-L273 HydrophobicContact CG2-CD2 3.7Å; I259-L273 HydrophobicContact CG2-CD1 4.38Å; Y262-L273 PolarHBondContact O-N 2.74Å; T263-L273 WeakPolarHBondContact CA-O 3.5Å; T263-L273 HydrophobicContact CG2-CB 3.85Å; L269-L273 HydrophobicContact CD1-CD2 4.2Å; L269-L273 HydrophobicContact CD1-CG 4.46Å
274	S	96.6	Very high	89.5	Confident	52 Å²	52	57 Å²	57	36%	0.364	32%	0.323	S	S	.	.			trans	-105.2	-75.2	-179.2	60.5	0	0	0	0	111.3	K200 G201 T202	K200-S274 WeakPolarHBondContact O-CB 3.4Å; K200-S274 PolarHBondContact O-OG 3.25Å; G201-S274 WeakPolarHBondContact CA-OG 3.24Å; G201-S274 PolarHBondContact O-N 3.2Å; G201-S274 PolarHBondContact O-OG 3.42Å; T202-S274 PolarHBondContact N-OG 2.9Å; T202-S274 VanDerWaalsContact N-OG 3.17Å
275	I	96.2	Very high	88.9	Confident	75 Å²	75	54.6 Å²	54.6	39%	0.385	31%	0.309	S	S	.	.	S	Bend	trans	-128.6	148.5	179.8	63	172.9	0	0	0	111.1	P199 T202 Y203	P199-I275 HydrophobicContact CG-CD1 3.72Å; P199-I275 HydrophobicContact CG-CG1 3.94Å; T202-I275 VanDerWaalsContact CA-O 3.28Å; T202-I275 WeakPolarHBondContact CA-O 3.37Å; T202-I275 HydrophobicContact CG2-CG1 4.36Å; Y203-I275 WeakPolarHBondContact CD1-O 3.2Å; Y203-I275 WeakPolarHBondContact CE1-O 3.44Å; Y203-I275 PolarHBondContact N-O 2.68Å
276	P	95.3	Very high	88.4	Confident	45 Å²	45	50.9 Å²	50.9	29%	0.292	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-55.5	145.1	165.9	-21.1	31	0	0	0	110.8	A180 Y203 P278	A180-P276 HydrophobicContact CB-CB 4.21Å; Y203-P276 HydrophobicContact CE1-CG 4.36Å; Y203-P276 CarbonylContact O-C 3.58Å; Y203-P276 WeakPolarHBondContact O-CA 3.17Å; P276-P278 WeakPolarHBondContact O-CD 3.37Å
277	C	94.6	Very high	88.2	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.014	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-57.5	123.6	173.4	-173.5	0	0	0	0	108.9	Y182 L193 T202 Y203 L204 H279	Y182-C277 HydrophobicContact CE2-CB 3.94Å; Y182-C277 PolarHBondContact OH-O 2.89Å; L193-C277 HydrophobicContact CD2-CB 3.86Å; T202-C277 HydrophobicContact CG2-CB 4.09Å; Y203-C277 WeakPolarHBondContact O-CB 3.48Å; Y203-C277 PolarHBondContact O-N 2.87Å; L204-C277 HydrophobicContact CB-CB 4.03Å; L204-C277 HydrophobicContact CD2-CB 4.11Å; C277-H279 PolarHBondContact O-N 3.28Å
278	P	88.6	Confident	87.8	Confident	65 Å²	65	47.6 Å²	47.6	42%	0.422	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-62.4	130.5	-178.4	-23.3	33.3	0	0	0	112.1	Y182 N198 P276 A280	Y182-P278 PolarHBondContact OH-O 3.26Å; N198-P278 WeakPolarHBondContact OD1-CD 3.48Å; P276-P278 WeakPolarHBondContact O-CD 3.37Å; P278-A280 PolarHBondContact O-N 3.5Å
279	H	80	Confident	87.6	Confident	44 Å²	44	48.7 Å²	48.7	20%	0.204	26%	0.256	C	S	.	.			trans	-74	76.3	169	-67.6	77.6	0	0	0	110	Y121 D179 W181 Y182 C277 Y281	Y121-H279 HydrophobicContact CE1-CB 3.84Å; D179-H279 PolarHBondContact O-CE1 3.06Å; W181-H279 PolarHBondContact O-NE2 2.76Å; Y182-H279 AromaticContact CE1-CD2 3.75Å; Y182-H279 AromaticContact CE1-NE2 3.77Å; Y182-H279 AromaticContact CE2-CE1 3.52Å; Y182-H279 AromaticContact CE2-NE2 3.62Å; Y182-H279 AromaticContact CZ-CD2 3.64Å; Y182-H279 AromaticContact CZ-CE1 3.56Å; Y182-H279 AromaticContact CZ-CG 3.84Å; Y182-H279 AromaticContact CZ-ND1 3.83Å; Y182-H279 AromaticContact CZ-NE2 3.45Å; Y182-H279 WeakPolarHBondContact OH-CA 3.24Å; Y182-H279 PolarHBondContact OH-N 2.83Å; Y182-H279 VanDerWaalsContact OH-N 3.15Å; Y182-H279 PolarHBondContact OH-ND1 3.17Å; C277-H279 PolarHBondContact O-N 3.28Å; H279-Y281 VanDerWaalsContact C-N 3.31Å
280	A	71.9	Confident	87.2	Confident	82 Å²	82	49.6 Å²	49.6	68%	0.678	26%	0.259	S	S	*	.			trans	-68.3	-33.1	179.4	0	0	0	0	0	112.1	P278	P278-A280 PolarHBondContact O-N 3.5Å
281	Y	70.2	Confident	87.2	Confident	58 Å²	58	51.7 Å²	51.7	23%	0.227	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-79.5	123.1	174.3	176.9	-100.7	0	0	0	109.8	Y121 H279 P283 P284 K433	Y121-Y281 WeakPolarHBondContact CE1-O 3.28Å; H279-Y281 VanDerWaalsContact C-N 3.31Å; Y281-P283 HydrophobicContact CE1-CB 4.02Å; Y281-P284 WeakPolarHBondContact OH-CD 3.49Å; Y281-K433 PolarHBondContact OH-NZ 2.76Å
282	R	77.7	Confident	87	Confident	143 Å²	143	51.9 Å²	51.9	54%	0.54	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-103.4	125	165.7	-66.6	-171	-175.5	-160.4	2.6	107.9	Y121 S122	Y121-R282 HydrophobicContact CD1-CG 4.07Å; S122-R282 PolarHBondContact O-NH1 3.27Å
283	P	79.2	Confident	86.7	Confident	18 Å²	18	49.5 Å²	49.5	12%	0.117	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-61	143.2	176.7	26.4	-31.8	0	0	0	109.4	Y121 Y167 Y281	Y121-P283 HydrophobicContact CD2-CG 4.21Å; Y121-P283 HydrophobicContact CE2-CG 3.7Å; Y121-P283 VanDerWaalsContact CZ-CD 3.48Å; Y167-P283 HydrophobicContact CD2-CG 4.19Å; Y167-P283 HydrophobicContact CE2-CG 3.83Å; Y167-P283 VanDerWaalsContact CE2-O 3.22Å; Y167-P283 WeakPolarHBondContact CE2-O 3.35Å; Y167-P283 PolarHBondContact OH-O 3.39Å; Y281-P283 HydrophobicContact CE1-CB 4.02Å
284	P	83.3	Confident	86.5	Confident	23 Å²	23	50 Å²	50	15%	0.149	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-61.8	142	175.7	23.2	-31.1	0	0	0	110.4	N166 Y281 Q353 L355 E371	N166-P284 PolarHBondContact ND2-O 2.76Å; Y281-P284 WeakPolarHBondContact OH-CD 3.49Å; P284-Q353 HydrophobicContact CB-CB 4.39Å; P284-Q353 HydrophobicContact CG-CB 3.56Å; P284-Q353 HydrophobicContact CG-CG 3.9Å; P284-L355 HydrophobicContact CB-CD2 3.7Å; P284-L355 HydrophobicContact CG-CD2 4.49Å; P284-E371 HydrophobicContact CB-CB 4.11Å; P284-E371 HydrophobicContact CG-CB 4.27Å
285	V	84.3	Confident	86.4	Confident	27 Å²	27	54.1 Å²	54.1	16%	0.164	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-92.1	118.4	171.4	178.2	0	0	0	0	107.2	Y123 W149 P164 Y167	Y123-V285 HydrophobicContact CD2-CG2 4.35Å; Y123-V285 HydrophobicContact CE2-CG1 4.34Å; Y123-V285 HydrophobicContact CE2-CG2 4.19Å; W149-V285 HydrophobicContact CH2-CG1 3.72Å; W149-V285 HydrophobicContact CZ2-CG1 3.45Å; W149-V285 VanDerWaalsContact CZ2-CG1 3.45Å; P164-V285 HydrophobicContact CB-CG1 4.07Å; P164-V285 HydrophobicContact CB-CG2 4.19Å; P164-V285 HydrophobicContact CG-CG1 4.34Å; P164-V285 HydrophobicContact CG-CG2 4.12Å; Y167-V285 HydrophobicContact CD2-CG2 4.03Å; Y167-V285 HydrophobicContact CE1-CG2 4.3Å; Y167-V285 HydrophobicContact CE2-CG2 3.32Å; Y167-V285 VanDerWaalsContact CZ-CG2 3.49Å
286	Q	84.3	Confident	86.3	Confident	10 Å²	10	51.5 Å²	51.5	5%	0.047	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-65.5	151.3	172.7	-66.1	-177.9	-66.3	0	0	109.8	W149 H344 H347 Q353 L354	W149-Q286 WeakPolarHBondContact CZ2-O 3.36Å; W149-Q286 PolarHBondContact NE1-O 3.16Å; W149-Q286 VanDerWaalsContact NE1-O 3.11Å; Q286-H344 PolarHBondContact NE2-CD2 3.36Å; Q286-H344 VanDerWaalsContact NE2-CD2 3.34Å; Q286-H344 PolarHBondContact NE2-CE1 3.06Å; Q286-H344 PolarHBondContact NE2-NE2 2.85Å; Q286-H344 VanDerWaalsContact NE2-NE2 3.14Å; Q286-H344 PolarHBondContact NE2-O 2.77Å; Q286-H347 VanDerWaalsContact CD-NE2 3.31Å; Q286-H347 PolarHBondContact NE2-NE2 2.85Å; Q286-H347 PolarHBondContact OE1-NE2 3.18Å; Q286-Q353 HydrophobicContact CG-CG 4.18Å; Q286-Q353 VanDerWaalsContact NE2-NE2 3.12Å; Q286-L354 PolarHBondContact NE2-O 3.1Å
287	F	87.6	Confident	86.3	Confident	6 Å²	6	50 Å²	50	3%	0.026	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-65.5	153.9	174.4	-53.2	-39.5	0	0	0	110.4	W149 D289 I292 W316 V322 L355 I369	W149-F287 PolarHBondContact NE1-O 2.73Å; F287-D289 VanDerWaalsContact C-N 3.32Å; F287-D289 WeakPolarHBondContact CB-O 3.18Å; F287-I292 HydrophobicContact CB-CG2 4.01Å; F287-I292 HydrophobicContact CD2-CD1 3.93Å; F287-I292 HydrophobicContact CD2-CG2 3.7Å; F287-I292 HydrophobicContact CE2-CD1 3.68Å; F287-I292 HydrophobicContact CG-CG2 4.07Å; F287-I292 HydrophobicContact CZ-CD1 4.34Å; F287-W316 AromaticContact CD1-CD2 3.76Å; F287-W316 HydrophobicContact CD1-CD2 3.76Å; F287-W316 AromaticContact CD1-CE2 3.74Å; F287-W316 AromaticContact CD1-CE3 3.78Å; F287-W316 HydrophobicContact CD1-CE3 3.78Å; F287-W316 HydrophobicContact CD1-CG 4.48Å; F287-W316 AromaticContact CD1-CH2 3.79Å; F287-W316 HydrophobicContact CD1-CH2 3.79Å; F287-W316 AromaticContact CD1-CZ2 3.77Å; F287-W316 HydrophobicContact CD1-CZ2 3.77Å; F287-W316 AromaticContact CD1-CZ3 3.79Å; F287-W316 HydrophobicContact CD1-CZ3 3.79Å; F287-W316 HydrophobicContact CE1-CB 4.26Å; F287-W316 AromaticContact CE1-CD2 3.34Å; F287-W316 HydrophobicContact CE1-CD2 3.34Å; F287-W316 AromaticContact CE1-CE2 3.8Å; F287-W316 AromaticContact CE1-CE3 3.39Å; F287-W316 HydrophobicContact CE1-CE3 3.39Å; F287-W316 AromaticContact CE1-CG 3.75Å; F287-W316 HydrophobicContact CE1-CG 3.75Å; F287-W316 HydrophobicContact CE1-CH2 4.28Å; F287-W316 HydrophobicContact CE1-CZ2 4.25Å; F287-W316 AromaticContact CE1-CZ3 3.87Å; F287-W316 HydrophobicContact CE1-CZ3 3.87Å; F287-W316 HydrophobicContact CG-CZ2 4.37Å; F287-W316 HydrophobicContact CZ-CB 4.17Å; F287-W316 AromaticContact CZ-CD2 3.99Å; F287-W316 HydrophobicContact CZ-CD2 3.99Å; F287-W316 HydrophobicContact CZ-CE3 4.38Å; F287-W316 AromaticContact CZ-CG 3.89Å; F287-W316 HydrophobicContact CZ-CG 3.89Å; F287-V322 HydrophobicContact CZ-CG1 4.35Å; F287-L355 HydrophobicContact CD2-CB 4.09Å; F287-L355 WeakPolarHBondContact CD2-O 3.48Å; F287-L355 HydrophobicContact CE1-CB 4.23Å; F287-L355 HydrophobicContact CE1-CD1 4.45Å; F287-L355 HydrophobicContact CE2-CB 3.66Å; F287-L355 WeakPolarHBondContact CG-O 3.03Å; F287-L355 HydrophobicContact CZ-CB 3.75Å; F287-L355 HydrophobicContact CZ-CD1 4.14Å; F287-L355 PolarHBondContact N-O 2.73Å; F287-I369 HydrophobicContact CE2-CB 4.12Å; F287-I369 HydrophobicContact CE2-CD1 4Å; F287-I369 HydrophobicContact CE2-CG2 3.79Å; F287-I369 HydrophobicContact CZ-CG2 3.87Å
288	R	83.7	Confident	86.4	Confident	48 Å²	48	54 Å²	54	18%	0.181	29%	0.285	C	S	.	.	S	Bend	trans	-65.4	-41.7	174.3	-76.1	-155.4	-52.8	174.8	-3.2	111.4	N127 D129 D130 M145 W149	N127-R288 PolarHBondContact ND2-NE 3.4Å; N127-R288 VanDerWaalsContact ND2-NE 3.11Å; D129-R288 IonicContact OD1-CZ 3.42Å; D129-R288 IonicContact OD1-NH1 3.01Å; D129-R288 PolarHBondContact OD1-NH1 2.99Å; D129-R288 VanDerWaalsContact OD1-NH1 3.09Å; D129-R288 IonicContact OD1-NH2 2.65Å; D129-R288 PolarHBondContact OD1-NH2 3.12Å; D129-R288 IonicContact OD2-CZ 3.19Å; D129-R288 IonicContact OD2-NH1 3.49Å; D129-R288 PolarHBondContact OD2-NH1 3.11Å; D129-R288 IonicContact OD2-NH2 3.35Å; D129-R288 PolarHBondContact OD2-NH2 3.39Å; D130-R288 IonicContact OD1-NE 3.09Å; M145-R288 HydrophobicContact CE-CB 4.41Å; W149-R288 HydrophobicContact CD2-CG 3.68Å; W149-R288 VanDerWaalsContact CE2-CG 3.48Å; W149-R288 HydrophobicContact CE3-CG 4.06Å; W149-R288 HydrophobicContact CG-CG 4.14Å; W149-R288 HydrophobicContact CH2-CG 3.98Å; W149-R288 HydrophobicContact CZ2-CG 3.63Å; W149-R288 HydrophobicContact CZ3-CG 4.19Å
289	D	86.1	Confident	86.6	Confident	100 Å²	100	56.6 Å²	56.6	54%	0.535	29%	0.287	S	S	.	.	S	Bend	trans	-97.7	126.9	174.5	-58.7	-48.1	0	0	0	109.6	F287 E291 I292	F287-D289 VanDerWaalsContact C-N 3.32Å; F287-D289 WeakPolarHBondContact CB-O 3.18Å; D289-E291 VanDerWaalsContact C-N 3.34Å; D289-I292 VanDerWaalsContact O-CG2 3.3Å; D289-I292 WeakPolarHBondContact O-CG2 3.03Å
290	F	87	Confident	87.4	Confident	33 Å²	33	58.7 Å²	58.7	15%	0.145	30%	0.299	C	S	.	.	S	Bend	trans	-63.5	-41.4	178.5	170.4	-107	0	0	0	112	I337 A340 R341 H344 L354 G356 V357	F290-I337 HydrophobicContact CE1-CG2 4.21Å; F290-A340 HydrophobicContact CE2-CB 4.4Å; F290-A340 HydrophobicContact CZ-CB 3.67Å; F290-R341 HydrophobicContact CD1-CG 4.05Å; F290-R341 HydrophobicContact CE1-CG 3.7Å; F290-R341 HydrophobicContact CE2-CG 4.42Å; F290-R341 HydrophobicContact CZ-CG 3.9Å; F290-H344 HydrophobicContact CD2-CB 3.96Å; F290-H344 AromaticContact CD2-CD2 3.65Å; F290-H344 AromaticContact CD2-CG 3.67Å; F290-H344 HydrophobicContact CE2-CB 3.72Å; F290-H344 AromaticContact CE2-CG 3.94Å; F290-L354 HydrophobicContact CE2-CD2 4.19Å; F290-G356 CarbonylContact O-C 3.52Å; F290-G356 VanDerWaalsContact O-CA 3.24Å; F290-G356 WeakPolarHBondContact O-CA 3.18Å; F290-V357 HydrophobicContact CD1-CG2 4.2Å; F290-V357 HydrophobicContact CE1-CG2 3.62Å; F290-V357 HydrophobicContact CE2-CG1 4.36Å; F290-V357 HydrophobicContact CE2-CG2 4.39Å; F290-V357 HydrophobicContact CZ-CG1 4.03Å; F290-V357 HydrophobicContact CZ-CG2 3.74Å; F290-V357 PolarHBondContact O-N 3.37Å
291	E	92.2	Very high	88.5	Confident	77 Å²	77	62.7 Å²	62.7	36%	0.36	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-99.6	119.4	172.9	-56.9	-171.9	-132.7	0	0	108.3	D289 V357 T359	D289-E291 VanDerWaalsContact C-N 3.34Å; E291-V357 WeakPolarHBondContact CA-O 3.42Å; E291-V357 HydrophobicContact CG-CG2 3.88Å; E291-T359 PolarHBondContact OE2-OG1 2.65Å
292	I	92.3	Very high	89.6	Confident	21 Å²	21	63.4 Å²	63.4	11%	0.108	30%	0.301	C	S	.	.			trans	-111.2	155.3	-179.2	68.6	167.6	0	0	0	111.1	F287 D289 R294 I297 V357 C358 I369	F287-I292 HydrophobicContact CB-CG2 4.01Å; F287-I292 HydrophobicContact CD2-CD1 3.93Å; F287-I292 HydrophobicContact CD2-CG2 3.7Å; F287-I292 HydrophobicContact CE2-CD1 3.68Å; F287-I292 HydrophobicContact CG-CG2 4.07Å; F287-I292 HydrophobicContact CZ-CD1 4.34Å; D289-I292 VanDerWaalsContact O-CG2 3.3Å; D289-I292 WeakPolarHBondContact O-CG2 3.03Å; I292-R294 PolarHBondContact O-N 2.93Å; I292-I297 HydrophobicContact CD1-CD1 3.89Å; I292-I297 HydrophobicContact CD1-CG1 3.98Å; I292-V357 PolarHBondContact N-O 2.76Å; I292-C358 PolarHBondContact O-SG 3.02Å; I292-C358 VanDerWaalsContact O-SG 3.38Å; I292-I369 HydrophobicContact CD1-CD1 3.31Å; I292-I369 HydrophobicContact CG1-CD1 3.75Å
293	N	92.3	Very high	90.2	Very high	104 Å²	104	60.4 Å²	60.4	56%	0.556	30%	0.295	S	S	*	.			trans	-63.1	126.5	174.2	-173.7	-30.3	0	0	0	110.3	D295 S296	N293-D295 PolarHBondContact O-N 3.16Å; N293-D295 WeakPolarHBondContact OD1-CB 3.38Å; N293-D295 PolarHBondContact OD1-N 3.28Å; N293-S296 VanDerWaalsContact O-CB 3.28Å; N293-S296 WeakPolarHBondContact O-CB 3.46Å; N293-S296 PolarHBondContact O-N 3.45Å; N293-S296 PolarHBondContact O-OG 2.89Å
294	R	93.8	Very high	90.4	Very high	18 Å²	18	60.9 Å²	60.9	7%	0.068	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-51.8	-35.7	175.7	-178.6	-178.9	-60.8	-92.9	-7.6	113.7	I292 S296 I297 C358 E360 P365 Y367	I292-R294 PolarHBondContact O-N 2.93Å; R294-S296 PolarHBondContact O-N 2.91Å; R294-I297 WeakPolarHBondContact O-CB 3.48Å; R294-I297 PolarHBondContact O-N 2.89Å; R294-C358 HydrophobicContact CB-CB 4.24Å; R294-E360 PolarHBondContact NE-O 2.86Å; R294-E360 PolarHBondContact NH2-O 3.01Å; R294-E360 VanDerWaalsContact NH2-O 3.1Å; R294-P365 PolarHBondContact NH1-O 2.81Å; R294-P365 PolarHBondContact NH2-O 3.37Å; R294-Y367 HydrophobicContact CG-CD2 4.32Å; R294-Y367 HydrophobicContact CG-CE2 3.78Å; R294-Y367 PolarHBondContact NH1-OH 3.02Å
295	D	93.7	Very high	90.4	Very high	137 Å²	137	66.5 Å²	66.5	73%	0.733	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-68.3	-18.2	-178.9	-62	-28.6	0	0	0	112.6	N293 I297	N293-D295 PolarHBondContact O-N 3.16Å; N293-D295 WeakPolarHBondContact OD1-CB 3.38Å; N293-D295 PolarHBondContact OD1-N 3.28Å; D295-I297 PolarHBondContact O-N 3.08Å
296	S	93.4	Very high	89.6	Confident	20 Å²	20	67.3 Å²	67.3	14%	0.14	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-70.6	-11.7	171.1	73	0	0	0	0	113.1	N293 R294 W316 N317	N293-S296 VanDerWaalsContact O-CB 3.28Å; N293-S296 WeakPolarHBondContact O-CB 3.46Å; N293-S296 PolarHBondContact O-N 3.45Å; N293-S296 PolarHBondContact O-OG 2.89Å; R294-S296 PolarHBondContact O-N 2.91Å; S296-W316 WeakPolarHBondContact O-CA 3.2Å; S296-N317 WeakPolarHBondContact CB-OD1 3.15Å; S296-N317 PolarHBondContact O-N 3.3Å
297	I	95.7	Very high	88.6	Confident	15 Å²	15	70.4 Å²	70.4	8%	0.077	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	113	-177.4	-63	-63.3	0	0	0	110.7	I292 R294 D295 A314 W316 V322 V324 Y367 I369	I292-I297 HydrophobicContact CD1-CD1 3.89Å; I292-I297 HydrophobicContact CD1-CG1 3.98Å; R294-I297 WeakPolarHBondContact O-CB 3.48Å; R294-I297 PolarHBondContact O-N 2.89Å; D295-I297 PolarHBondContact O-N 3.08Å; I297-A314 HydrophobicContact CG2-CB 3.87Å; I297-W316 HydrophobicContact CD1-CB 3.81Å; I297-W316 HydrophobicContact CD1-CG 4.26Å; I297-V322 HydrophobicContact CD1-CG2 4.34Å; I297-V324 HydrophobicContact CG2-CG2 3.85Å; I297-Y367 HydrophobicContact CG2-CD2 4.39Å; I297-Y367 HydrophobicContact CG2-CE2 4.34Å; I297-I369 HydrophobicContact CD1-CD1 3.85Å; I297-I369 HydrophobicContact CG1-CD1 3.95Å
298	T	96.1	Very high	87.6	Confident	84 Å²	84	71.9 Å²	71.9	52%	0.515	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	109	172	-55.1	0	0	0	0	110.1	A314 K315	T298-A314 CarbonylContact O-C 3.51Å; T298-A314 VanDerWaalsContact O-CA 3.22Å; T298-A314 WeakPolarHBondContact O-CA 3.44Å; T298-A314 WeakPolarHBondContact O-CB 3.28Å; T298-K315 PolarHBondContact N-O 2.59Å; T298-K315 PolarHBondContact O-N 2.91Å
299	R	94.7	Very high	87.2	Confident	120 Å²	120	70 Å²	70	45%	0.453	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	131.7	174.8	-63.8	179.4	-64.7	172.9	0.8	110.3	Y312 M326	R299-Y312 HydrophobicContact CB-CD1 4.15Å; R299-Y312 HydrophobicContact CG-CD1 4.46Å; R299-Y312 HydrophobicContact CG-CG 4.39Å; R299-M326 PolarHBondContact NH1-SD 2.88Å
300	I	95.7	Very high	87.3	Confident	88 Å²	88	67.1 Å²	67.1	45%	0.451	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-57.6	-178.4	-61.7	172.7	0	0	0	110.8	L313 K315	I300-L313 HydrophobicContact CB-CD2 4.45Å; I300-L313 HydrophobicContact CB-CG 4.24Å; I300-L313 WeakPolarHBondContact CB-O 3.4Å; I300-L313 HydrophobicContact CD1-CG 4.25Å; I300-L313 HydrophobicContact CG2-CD2 4.36Å; I300-L313 PolarHBondContact N-O 2.67Å; I300-K315 HydrophobicContact CD1-CB 4.39Å; I300-K315 HydrophobicContact CD1-CD 3.78Å; I300-K315 HydrophobicContact CD1-CG 3.68Å
301	R	95.2	Very high	87.5	Confident	166 Å²	166	67.5 Å²	67.5	63%	0.626	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.2	142.8	-175.7	-172.4	176.6	68.4	128	-0.7	110.9	L303 Y312 L313	R301-L303 PolarHBondContact O-N 3.05Å; R301-Y312 CarbonylContact O-C 3.54Å; R301-Y312 WeakPolarHBondContact O-CA 3.38Å; R301-L313 PolarHBondContact N-O 3.46Å; R301-L313 PolarHBondContact O-N 3.27Å
302	K	93.6	Very high	87.6	Confident	74 Å²	74	65.7 Å²	65.7	32%	0.322	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	124.9	171.2	-170.7	170.5	174.3	176.5	0	109.7	G304 E310 V311 Y312	K302-G304 WeakPolarHBondContact CE-O 3.16Å; K302-E310 WeakPolarHBondContact CE-OE1 3.41Å; K302-E310 IonicContact NZ-OE1 2.66Å; K302-E310 PolarHBondContact NZ-OE1 3.2Å; K302-V311 CarbonylContact C-O 3.54Å; K302-Y312 HydrophobicContact CB-CD1 4.1Å; K302-Y312 HydrophobicContact CB-CE1 3.74Å; K302-Y312 HydrophobicContact CG-CE1 4.34Å; K302-Y312 HydrophobicContact CG-CE2 4.37Å
303	L	90.3	Very high	87.8	Confident	79 Å²	79	65.9 Å²	65.9	41%	0.414	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-36.4	176.3	-67.7	174	0	0	0	111.4	R301 V311 L313 L372	R301-L303 PolarHBondContact O-N 3.05Å; L303-V311 HydrophobicContact CB-CG1 4.31Å; L303-V311 HydrophobicContact CD1-CG1 4.28Å; L303-V311 PolarHBondContact N-O 3.01Å; L303-L313 HydrophobicContact CD1-CB 4.07Å; L303-L313 HydrophobicContact CD2-CB 4.03Å; L303-L313 HydrophobicContact CG-CB 4.01Å; L303-L372 HydrophobicContact CD1-CD1 3.81Å
304	G	84.2	Confident	88	Confident	29 Å²	29	61 Å²	61	30%	0.299	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.7	174.4	-178.1	0	0	0	0	0	112.9	K302 V311	K302-G304 WeakPolarHBondContact CE-O 3.16Å; G304-V311 PolarHBondContact N-O 2.95Å; G304-V311 PolarHBondContact O-N 2.83Å
305	Q	81.5	Confident	88.1	Confident	140 Å²	140	63.6 Å²	63.6	65%	0.654	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.5	117	172.8	-176.6	168.7	-6.4	0	0	107.8	E310	Q305-E310 HydrophobicContact CG-CG 4.33Å
306	G	68.3	Low	88	Confident	45 Å²	45	58 Å²	58	46%	0.464	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-179.9	176	0	0	0	0	0	111.4	F308 G309	G306-F308 PolarHBondContact O-N 3.27Å; G306-F308 VanDerWaalsContact O-N 3.1Å; G306-G309 PolarHBondContact N-O 3Å; G306-G309 PolarHBondContact O-N 3.17Å
307	T	63.7	Low	87.8	Confident	75 Å²	75	61 Å²	61	46%	0.46	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-27.3	176.1	-41.6	0	0	0	0	112.7	K454	T307-K454 HydrophobicContact CG2-CB 4.27Å; T307-K454 HydrophobicContact CG2-CD 4.38Å; T307-K454 HydrophobicContact CG2-CG 3.98Å
308	F	65.5	Low	87.4	Confident	36 Å²	36	62.6 Å²	62.6	16%	0.158	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	7.2	-172.4	-48.2	-56.2	0	0	0	113.8	G306 I443	G306-F308 PolarHBondContact O-N 3.27Å; G306-F308 VanDerWaalsContact O-N 3.1Å; F308-I443 HydrophobicContact CD1-CD1 3.27Å; F308-I443 HydrophobicContact CD1-CG1 4.34Å; F308-I443 HydrophobicContact CE1-CD1 3.22Å; F308-I443 HydrophobicContact CE1-CG1 4.39Å; F308-I443 HydrophobicContact CG-CD1 4.05Å; F308-I443 HydrophobicContact CZ-CD1 3.91Å
309	G	76.5	Confident	86.9	Confident	10 Å²	10	61.9 Å²	61.9	10%	0.103	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	126.1	-156.9	177.6	0	0	0	0	0	113.2	G306 M326	G306-G309 PolarHBondContact N-O 3Å; G306-G309 PolarHBondContact O-N 3.17Å; G309-M326 WeakPolarHBondContact CA-O 3.48Å
310	E	87.6	Confident	86.7	Confident	38 Å²	38	58 Å²	58	18%	0.178	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	143.1	-172.1	-57.4	-179.3	131.5	0	0	110.8	K302 Q305 Y312 K325 M326	K302-E310 WeakPolarHBondContact CE-OE1 3.41Å; K302-E310 IonicContact NZ-OE1 2.66Å; K302-E310 PolarHBondContact NZ-OE1 3.2Å; Q305-E310 HydrophobicContact CG-CG 4.33Å; E310-Y312 HydrophobicContact CB-CD2 4.22Å; E310-Y312 HydrophobicContact CB-CE2 3.56Å; E310-Y312 PolarHBondContact OE2-OH 2.77Å; E310-K325 WeakPolarHBondContact O-CA 3.22Å; E310-M326 HydrophobicContact CB-CE 4.06Å; E310-M326 PolarHBondContact N-O 3Å; E310-M326 PolarHBondContact O-N 2.96Å; E310-M326 VanDerWaalsContact OE2-CE 3.26Å; E310-M326 WeakPolarHBondContact OE2-CE 3.23Å
311	V	91.4	Very high	86.6	Confident	42 Å²	42	57.3 Å²	57.3	26%	0.255	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	132.4	177.9	-173.4	0	0	0	0	108.8	K302 L303 G304 V324 K325	K302-V311 CarbonylContact C-O 3.54Å; L303-V311 HydrophobicContact CB-CG1 4.31Å; L303-V311 HydrophobicContact CD1-CG1 4.28Å; L303-V311 PolarHBondContact N-O 3.01Å; G304-V311 PolarHBondContact N-O 2.95Å; G304-V311 PolarHBondContact O-N 2.83Å; V311-V324 CarbonylContact C-O 3.6Å; V311-V324 WeakPolarHBondContact CA-O 3.32Å; V311-K325 HydrophobicContact CG2-CB 4.26Å; V311-K325 HydrophobicContact CG2-CD 4.46Å; V311-K325 HydrophobicContact CG2-CG 4.08Å
312	Y	94.6	Very high	86.6	Confident	39 Å²	39	49.4 Å²	49.4	15%	0.153	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	143.2	-178.8	-74.1	-100.4	0	0	0	111.2	R299 R301 K302 E310 A323 V324 M326	R299-Y312 HydrophobicContact CB-CD1 4.15Å; R299-Y312 HydrophobicContact CG-CD1 4.46Å; R299-Y312 HydrophobicContact CG-CG 4.39Å; R301-Y312 CarbonylContact O-C 3.54Å; R301-Y312 WeakPolarHBondContact O-CA 3.38Å; K302-Y312 HydrophobicContact CB-CD1 4.1Å; K302-Y312 HydrophobicContact CB-CE1 3.74Å; K302-Y312 HydrophobicContact CG-CE1 4.34Å; K302-Y312 HydrophobicContact CG-CE2 4.37Å; E310-Y312 HydrophobicContact CB-CD2 4.22Å; E310-Y312 HydrophobicContact CB-CE2 3.56Å; E310-Y312 PolarHBondContact OE2-OH 2.77Å; Y312-A323 CarbonylContact O-C 3.55Å; Y312-A323 WeakPolarHBondContact O-CA 3.44Å; Y312-V324 PolarHBondContact N-O 3.23Å; Y312-V324 PolarHBondContact O-N 3.5Å; Y312-M326 HydrophobicContact CD2-CE 3.86Å; Y312-M326 HydrophobicContact CD2-CG 4.48Å; Y312-M326 HydrophobicContact CD2-SD 4.21Å; Y312-M326 HydrophobicContact CE2-CE 3.27Å; Y312-M326 HydrophobicContact CE2-SD 4.15Å
313	L	96	Very high	86.6	Confident	25 Å²	25	46.3 Å²	46.3	13%	0.131	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	128	154.5	171.1	62.4	0	0	0	106.9	I300 R301 L303 E321 L372	I300-L313 HydrophobicContact CB-CD2 4.45Å; I300-L313 HydrophobicContact CB-CG 4.24Å; I300-L313 WeakPolarHBondContact CB-O 3.4Å; I300-L313 HydrophobicContact CD1-CG 4.25Å; I300-L313 HydrophobicContact CG2-CD2 4.36Å; I300-L313 PolarHBondContact N-O 2.67Å; R301-L313 PolarHBondContact N-O 3.46Å; R301-L313 PolarHBondContact O-N 3.27Å; L303-L313 HydrophobicContact CD1-CB 4.07Å; L303-L313 HydrophobicContact CD2-CB 4.03Å; L303-L313 HydrophobicContact CG-CB 4.01Å; L313-E321 HydrophobicContact CD1-CB 4.3Å; L313-L372 HydrophobicContact CD1-CD1 3.93Å; L313-L372 HydrophobicContact CD1-CD2 3.5Å; L313-L372 HydrophobicContact CD1-CG 4.32Å
314	A	96.6	Very high	86.8	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	169.8	177.1	0	0	0	0	0	111.1	I297 T298 E321 V322 V324	I297-A314 HydrophobicContact CG2-CB 3.87Å; T298-A314 CarbonylContact O-C 3.51Å; T298-A314 VanDerWaalsContact O-CA 3.22Å; T298-A314 WeakPolarHBondContact O-CA 3.44Å; T298-A314 WeakPolarHBondContact O-CB 3.28Å; A314-E321 WeakPolarHBondContact O-CA 3.34Å; A314-V322 HydrophobicContact CB-CG2 4.08Å; A314-V322 PolarHBondContact N-O 3.19Å; A314-V322 PolarHBondContact O-N 2.7Å; A314-V324 HydrophobicContact CB-CB 4.32Å; A314-V324 HydrophobicContact CB-CG2 3.54Å
315	K	95.3	Very high	87.1	Confident	74 Å²	74	42.1 Å²	42.1	32%	0.322	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	130	169.1	-84.4	173.6	177.4	-164	0	110.5	T298 I300 V320	T298-K315 PolarHBondContact N-O 2.59Å; T298-K315 PolarHBondContact O-N 2.91Å; I300-K315 HydrophobicContact CD1-CB 4.39Å; I300-K315 HydrophobicContact CD1-CD 3.78Å; I300-K315 HydrophobicContact CD1-CG 3.68Å; K315-V320 CarbonylContact C-O 3.49Å; K315-V320 VanDerWaalsContact CA-O 3.25Å; K315-V320 WeakPolarHBondContact CA-O 3.4Å
316	W	92.8	Very high	87.4	Confident	20 Å²	20	35.7 Å²	35.7	8%	0.076	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	129.2	165.6	175.9	63.4	0	0	0	110	H126 F287 S296 I297 G318 S319 V320 V322	H126-W316 HydrophobicContact CB-CH2 3.88Å; H126-W316 HydrophobicContact CB-CZ3 3.93Å; H126-W316 AromaticContact CD2-CZ3 3.76Å; H126-W316 AromaticContact CG-CZ3 3.88Å; F287-W316 AromaticContact CD1-CD2 3.76Å; F287-W316 HydrophobicContact CD1-CD2 3.76Å; F287-W316 AromaticContact CD1-CE2 3.74Å; F287-W316 AromaticContact CD1-CE3 3.78Å; F287-W316 HydrophobicContact CD1-CE3 3.78Å; F287-W316 HydrophobicContact CD1-CG 4.48Å; F287-W316 AromaticContact CD1-CH2 3.79Å; F287-W316 HydrophobicContact CD1-CH2 3.79Å; F287-W316 AromaticContact CD1-CZ2 3.77Å; F287-W316 HydrophobicContact CD1-CZ2 3.77Å; F287-W316 AromaticContact CD1-CZ3 3.79Å; F287-W316 HydrophobicContact CD1-CZ3 3.79Å; F287-W316 HydrophobicContact CE1-CB 4.26Å; F287-W316 AromaticContact CE1-CD2 3.34Å; F287-W316 HydrophobicContact CE1-CD2 3.34Å; F287-W316 AromaticContact CE1-CE2 3.8Å; F287-W316 AromaticContact CE1-CE3 3.39Å; F287-W316 HydrophobicContact CE1-CE3 3.39Å; F287-W316 AromaticContact CE1-CG 3.75Å; F287-W316 HydrophobicContact CE1-CG 3.75Å; F287-W316 HydrophobicContact CE1-CH2 4.28Å; F287-W316 HydrophobicContact CE1-CZ2 4.25Å; F287-W316 AromaticContact CE1-CZ3 3.87Å; F287-W316 HydrophobicContact CE1-CZ3 3.87Å; F287-W316 HydrophobicContact CG-CZ2 4.37Å; F287-W316 HydrophobicContact CZ-CB 4.17Å; F287-W316 AromaticContact CZ-CD2 3.99Å; F287-W316 HydrophobicContact CZ-CD2 3.99Å; F287-W316 HydrophobicContact CZ-CE3 4.38Å; F287-W316 AromaticContact CZ-CG 3.89Å; F287-W316 HydrophobicContact CZ-CG 3.89Å; S296-W316 WeakPolarHBondContact O-CA 3.2Å; I297-W316 HydrophobicContact CD1-CB 3.81Å; I297-W316 HydrophobicContact CD1-CG 4.26Å; W316-G318 PolarHBondContact O-N 3.5Å; W316-S319 PolarHBondContact O-N 2.83Å; W316-S319 VanDerWaalsContact O-N 3.14Å; W316-V320 HydrophobicContact CB-CB 4.42Å; W316-V320 HydrophobicContact CE3-CB 4.01Å; W316-V320 HydrophobicContact CE3-CG2 3.79Å; W316-V320 HydrophobicContact CZ3-CG2 4.21Å; W316-V320 PolarHBondContact N-O 2.95Å; W316-V320 PolarHBondContact O-N 3.16Å; W316-V320 VanDerWaalsContact O-N 3.14Å; W316-V322 HydrophobicContact CB-CG1 4.45Å
317	N	89.3	Confident	87.7	Confident	81 Å²	81	34.8 Å²	34.8	43%	0.433	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.2	35.5	-177.6	-72.9	-18.8	0	0	0	113.3	S296 S319	S296-N317 WeakPolarHBondContact CB-OD1 3.15Å; S296-N317 PolarHBondContact O-N 3.3Å; N317-S319 PolarHBondContact O-N 2.84Å
318	G	87	Confident	87.7	Confident	49 Å²	49	35.9 Å²	35.9	51%	0.505	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	-3.1	177.3	0	0	0	0	0	116.5	W316	W316-G318 PolarHBondContact O-N 3.5Å
319	S	86.2	Confident	87.7	Confident	69 Å²	69	37.8 Å²	37.8	48%	0.483	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.9	-43.5	-171.1	56.3	0	0	0	0	113.9	W316 N317	W316-S319 PolarHBondContact O-N 2.83Å; W316-S319 VanDerWaalsContact O-N 3.14Å; N317-S319 PolarHBondContact O-N 2.84Å
320	V	88.7	Confident	87.1	Confident	39 Å²	39	43.6 Å²	43.6	24%	0.236	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	118.1	-173	-176.1	0	0	0	0	110.4	H126 K315 W316 V322	H126-V320 WeakPolarHBondContact NE2-CG2 3.49Å; K315-V320 CarbonylContact C-O 3.49Å; K315-V320 VanDerWaalsContact CA-O 3.25Å; K315-V320 WeakPolarHBondContact CA-O 3.4Å; W316-V320 HydrophobicContact CB-CB 4.42Å; W316-V320 HydrophobicContact CE3-CB 4.01Å; W316-V320 HydrophobicContact CE3-CG2 3.79Å; W316-V320 HydrophobicContact CZ3-CG2 4.21Å; W316-V320 PolarHBondContact N-O 2.95Å; W316-V320 PolarHBondContact O-N 3.16Å; W316-V320 VanDerWaalsContact O-N 3.14Å; V320-V322 HydrophobicContact CG1-CG1 4.11Å
321	E	93.8	Very high	86.1	Confident	74 Å²	74	43 Å²	43	35%	0.346	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	129.7	173.6	-62.9	-169.9	137.4	0	0	110.9	L313 A314 L372 R374	L313-E321 HydrophobicContact CD1-CB 4.3Å; A314-E321 WeakPolarHBondContact O-CA 3.34Å; E321-L372 HydrophobicContact CB-CD2 4.12Å; E321-R374 IonicContact OE2-CZ 3.5Å; E321-R374 IonicContact OE2-NH1 3.51Å; E321-R374 PolarHBondContact OE2-NH1 3.06Å; E321-R374 IonicContact OE2-NH2 2.83Å; E321-R374 PolarHBondContact OE2-NH2 3.39Å
322	V	95.2	Very high	85.4	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	160	-178.5	-62.6	0	0	0	0	111	F287 I297 A314 W316 V320 V324 L355 I369	F287-V322 HydrophobicContact CZ-CG1 4.35Å; I297-V322 HydrophobicContact CD1-CG2 4.34Å; A314-V322 HydrophobicContact CB-CG2 4.08Å; A314-V322 PolarHBondContact N-O 3.19Å; A314-V322 PolarHBondContact O-N 2.7Å; W316-V322 HydrophobicContact CB-CG1 4.45Å; V320-V322 HydrophobicContact CG1-CG1 4.11Å; V322-V324 HydrophobicContact CG2-CG2 4.05Å; V322-L355 HydrophobicContact CB-CD1 4.48Å; V322-L355 HydrophobicContact CG1-CD1 3.67Å; V322-I369 HydrophobicContact CB-CG2 3.77Å; V322-I369 HydrophobicContact CG1-CG2 4.11Å; V322-I369 HydrophobicContact CG2-CG2 3.78Å
323	A	95.2	Very high	84.7	Confident	9 Å²	9	44.5 Å²	44.5	7%	0.074	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	131.9	166.9	0	0	0	0	0	109.7	Y312 I369 T370 L372	Y312-A323 CarbonylContact O-C 3.55Å; Y312-A323 WeakPolarHBondContact O-CA 3.44Å; A323-I369 WeakPolarHBondContact O-CA 3.42Å; A323-T370 PolarHBondContact N-O 3.07Å; A323-T370 PolarHBondContact O-N 3.2Å; A323-L372 HydrophobicContact CB-CD1 4.26Å
324	V	94.5	Very high	84.1	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	113.1	-179.9	176.6	0	0	0	0	109	I297 V311 Y312 A314 V322 M326 Y367 I368 I369	I297-V324 HydrophobicContact CG2-CG2 3.85Å; V311-V324 CarbonylContact C-O 3.6Å; V311-V324 WeakPolarHBondContact CA-O 3.32Å; Y312-V324 PolarHBondContact N-O 3.23Å; Y312-V324 PolarHBondContact O-N 3.5Å; A314-V324 HydrophobicContact CB-CB 4.32Å; A314-V324 HydrophobicContact CB-CG2 3.54Å; V322-V324 HydrophobicContact CG2-CG2 4.05Å; V324-M326 HydrophobicContact CG1-CG 4.22Å; V324-Y367 HydrophobicContact CG1-CD1 4.11Å; V324-Y367 HydrophobicContact CG1-CD2 3.85Å; V324-Y367 HydrophobicContact CG1-CE2 4.39Å; V324-Y367 HydrophobicContact CG1-CG 3.7Å; V324-I368 WeakPolarHBondContact CA-O 3.43Å; V324-I369 HydrophobicContact CG2-CG1 4.34Å; V324-I369 HydrophobicContact CG2-CG2 4.46Å
325	K	90.3	Very high	83.2	Confident	19 Å²	19	53.5 Å²	53.5	8%	0.083	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	121.7	172.2	-175.7	175.1	-175.2	179.5	0	109.1	E310 V311 I368 D436	E310-K325 WeakPolarHBondContact O-CA 3.22Å; V311-K325 HydrophobicContact CG2-CB 4.26Å; V311-K325 HydrophobicContact CG2-CD 4.46Å; V311-K325 HydrophobicContact CG2-CG 4.08Å; K325-I368 HydrophobicContact CB-CB 4.29Å; K325-I368 HydrophobicContact CD-CD1 4.49Å; K325-I368 PolarHBondContact N-O 2.84Å; K325-I368 PolarHBondContact O-N 3.31Å; K325-D436 IonicContact NZ-OD1 2.91Å; K325-D436 PolarHBondContact NZ-OD1 3.42Å; K325-D436 IonicContact NZ-OD2 2.77Å; K325-D436 PolarHBondContact NZ-OD2 3.21Å
326	M	86.2	Confident	82.5	Confident	6 Å²	6	50 Å²	50	3%	0.03	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	124.3	-179.4	-51.1	-171.9	-52.6	0	0	109.6	R299 G309 E310 Y312 V324 V366 Y367	R299-M326 PolarHBondContact NH1-SD 2.88Å; G309-M326 WeakPolarHBondContact CA-O 3.48Å; E310-M326 HydrophobicContact CB-CE 4.06Å; E310-M326 PolarHBondContact N-O 3Å; E310-M326 PolarHBondContact O-N 2.96Å; E310-M326 VanDerWaalsContact OE2-CE 3.26Å; E310-M326 WeakPolarHBondContact OE2-CE 3.23Å; Y312-M326 HydrophobicContact CD2-CE 3.86Å; Y312-M326 HydrophobicContact CD2-CG 4.48Å; Y312-M326 HydrophobicContact CD2-SD 4.21Å; Y312-M326 HydrophobicContact CE2-CE 3.27Å; Y312-M326 HydrophobicContact CE2-SD 4.15Å; V324-M326 HydrophobicContact CG1-CG 4.22Å; M326-V366 WeakPolarHBondContact CA-O 3.31Å; M326-Y367 HydrophobicContact CB-CD1 4.15Å; M326-Y367 HydrophobicContact CB-CE1 4.14Å; M326-Y367 HydrophobicContact CG-CD1 3.61Å; M326-Y367 HydrophobicContact CG-CE1 3.43Å; M326-Y367 VanDerWaalsContact CG-CE1 3.43Å; M326-Y367 HydrophobicContact SD-CD1 4.23Å; M326-Y367 HydrophobicContact SD-CE1 3.41Å; M326-Y367 WeakPolarHBondContact SD-CE1 3.32Å
327	R	76.1	Confident	82.2	Confident	26 Å²	26	50.5 Å²	50.5	10%	0.098	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	114.3	170	-74.4	-160.6	67.9	-170.2	-4.9	110.2	P365 V366	R327-P365 WeakPolarHBondContact O-CA 3.44Å; R327-P365 VanDerWaalsContact O-CB 3.25Å; R327-P365 WeakPolarHBondContact O-CB 3.34Å; R327-V366 HydrophobicContact CB-CG2 3.77Å; R327-V366 HydrophobicContact CG-CG2 4.31Å; R327-V366 PolarHBondContact N-O 2.68Å
328	L	62.1	Low	81.8	Confident	97 Å²	97	53 Å²	53	51%	0.508	30%	0.295	S	S	.	.			trans	-81.2	-23.7	-177	-62.7	172.1	0	0	0	113.4	P365	L328-P365 HydrophobicContact CD2-CB 4.44Å; L328-P365 HydrophobicContact CD2-CG 4.05Å
329	D	67.2	Low	81.4	Confident	76 Å²	76	52.2 Å²	52.2	41%	0.406	28%	0.278	S	S	.	.	S	Bend	trans	-79.6	148	-178	-68.1	-24.9	0	0	0	111.8	T331	D329-T331 PolarHBondContact O-N 3.35Å; D329-T331 PolarHBondContact O-OG1 3.06Å
330	P	62.8	Low	81.3	Confident	133 Å²	133	49.1 Å²	49.1	86%	0.864	26%	0.257	S	S	*	.			trans	-52.5	112.6	172.2	-20.8	30.8	0	0	0	109.3
331	T	66.8	Low	81.2	Confident	24 Å²	24	54.2 Å²	54.2	15%	0.147	27%	0.272	C	S	.	.			trans	-108.7	130.5	-177.1	-54.9	0	0	0	0	107.4	D329 R333 F336 I442	D329-T331 PolarHBondContact O-N 3.35Å; D329-T331 PolarHBondContact O-OG1 3.06Å; T331-R333 VanDerWaalsContact C-N 3.33Å; T331-R333 PolarHBondContact O-N 3.44Å; T331-F336 HydrophobicContact CG2-CB 3.7Å; T331-F336 HydrophobicContact CG2-CD2 4.33Å; T331-F336 HydrophobicContact CG2-CG 4.21Å; T331-I442 HydrophobicContact CG2-CG2 4.39Å
332	D	76.1	Confident	80.6	Confident	80 Å²	80	55.8 Å²	55.8	43%	0.428	28%	0.282	S	S	.	.			trans	-60.5	101.4	164.3	-180	-19	0	0	0	107.7	S334 R335 F336	D332-S334 VanDerWaalsContact C-N 3.3Å; D332-S334 PolarHBondContact O-N 2.85Å; D332-S334 WeakPolarHBondContact OD1-CB 3.43Å; D332-S334 PolarHBondContact OD1-N 2.83Å; D332-S334 PolarHBondContact OD1-OG 3.26Å; D332-R335 HydrophobicContact CB-CB 4.2Å; D332-R335 PolarHBondContact O-N 2.91Å; D332-R335 PolarHBondContact OD1-N 3.29Å; D332-R335 WeakPolarHBondContact OD2-CD 3.48Å; D332-R335 WeakPolarHBondContact OD2-CG 3.29Å; D332-F336 WeakPolarHBondContact O-CB 3.26Å; D332-F336 PolarHBondContact O-N 3.34Å
333	R	81.3	Confident	80	Confident	34 Å²	34	56.6 Å²	56.6	13%	0.128	29%	0.286	C	S	.	.	H	α-helix	trans	-63.8	-38.1	-172.5	-70.5	-175.5	170.6	-160.8	-4.6	112	T331 F336 I337 T359 E360 P361 E362 Q364 V366	T331-R333 VanDerWaalsContact C-N 3.33Å; T331-R333 PolarHBondContact O-N 3.44Å; R333-F336 PolarHBondContact O-N 3.48Å; R333-I337 WeakPolarHBondContact O-CB 3.18Å; R333-I337 VanDerWaalsContact O-CG1 3.24Å; R333-I337 WeakPolarHBondContact O-CG1 3.35Å; R333-I337 PolarHBondContact O-N 2.78Å; R333-T359 PolarHBondContact NH1-O 3.29Å; R333-T359 PolarHBondContact NH2-O 2.78Å; R333-E360 IonicContact NH1-OE1 3.5Å; R333-E360 PolarHBondContact NH1-OE1 2.9Å; R333-E360 IonicContact NH1-OE2 3.56Å; R333-E360 PolarHBondContact NH1-OE2 3.35Å; R333-P361 PolarHBondContact NH1-O 3.14Å; R333-P361 PolarHBondContact NH2-O 3.36Å; R333-E362 VanDerWaalsContact NH1-N 3.17Å; R333-E362 VanDerWaalsContact NH2-C 3.3Å; R333-E362 PolarHBondContact NH2-O 3.47Å; R333-E362 VanDerWaalsContact NH2-O 3.13Å; R333-Q364 PolarHBondContact NH2-O 3.43Å; R333-V366 HydrophobicContact CG-CG1 4.32Å
334	S	82.1	Confident	79.6	Confident	87 Å²	87	57.8 Å²	57.8	61%	0.608	29%	0.29	S	S	*	.	H	α-helix	trans	-57.7	-51.2	177.1	0.1	0	0	0	0	110.6	D332 I337 E338	D332-S334 VanDerWaalsContact C-N 3.3Å; D332-S334 PolarHBondContact O-N 2.85Å; D332-S334 WeakPolarHBondContact OD1-CB 3.43Å; D332-S334 PolarHBondContact OD1-N 2.83Å; D332-S334 PolarHBondContact OD1-OG 3.26Å; S334-I337 PolarHBondContact O-N 2.96Å; S334-E338 PolarHBondContact O-N 3.42Å; S334-E338 VanDerWaalsContact O-N 3.11Å
335	R	77.8	Confident	79.1	Confident	126 Å²	126	60.6 Å²	60.6	48%	0.475	31%	0.314	S	S	.	.	H	α-helix	trans	-65.5	-38.9	176.1	-77.1	-177.8	155.1	-167.8	-8.5	112.6	D332 E338 E339 D445	D332-R335 HydrophobicContact CB-CB 4.2Å; D332-R335 PolarHBondContact O-N 2.91Å; D332-R335 PolarHBondContact OD1-N 3.29Å; D332-R335 WeakPolarHBondContact OD2-CD 3.48Å; D332-R335 WeakPolarHBondContact OD2-CG 3.29Å; R335-E338 PolarHBondContact O-N 3.31Å; R335-E339 PolarHBondContact O-N 2.87Å; R335-D445 IonicContact CZ-OD2 2.95Å; R335-D445 IonicContact NH1-OD2 2.96Å; R335-D445 PolarHBondContact NH1-OD2 3.04Å; R335-D445 IonicContact NH2-OD2 2.68Å; R335-D445 PolarHBondContact NH2-OD2 3.45Å
336	F	82.1	Confident	78.9	Confident	1 Å²	1	60.7 Å²	60.7	0%	0.004	31%	0.314	C	S	.	.	H	α-helix	trans	-61.9	-45.8	176.3	169.3	-95.5	0	0	0	112.3	T331 D332 R333 E338 E339 A340 V357 T359 V366 I368 I442	T331-F336 HydrophobicContact CG2-CB 3.7Å; T331-F336 HydrophobicContact CG2-CD2 4.33Å; T331-F336 HydrophobicContact CG2-CG 4.21Å; D332-F336 WeakPolarHBondContact O-CB 3.26Å; D332-F336 PolarHBondContact O-N 3.34Å; R333-F336 PolarHBondContact O-N 3.48Å; F336-E338 VanDerWaalsContact C-N 3.33Å; F336-E338 PolarHBondContact O-N 3.48Å; F336-E339 PolarHBondContact O-N 3.49Å; F336-A340 HydrophobicContact CE1-CB 4.48Å; F336-A340 HydrophobicContact CZ-CB 4.43Å; F336-A340 WeakPolarHBondContact O-CB 3.44Å; F336-A340 PolarHBondContact O-N 2.8Å; F336-V357 HydrophobicContact CE1-CB 4.12Å; F336-V357 HydrophobicContact CE1-CG1 3.98Å; F336-V357 HydrophobicContact CZ-CB 4.44Å; F336-V357 HydrophobicContact CZ-CG1 3.95Å; F336-T359 HydrophobicContact CD1-CG2 4.29Å; F336-T359 HydrophobicContact CE1-CG2 4.2Å; F336-V366 HydrophobicContact CD1-CB 4.48Å; F336-V366 HydrophobicContact CD1-CG1 4.47Å; F336-V366 HydrophobicContact CD1-CG2 4.4Å; F336-V366 HydrophobicContact CD2-CG2 4.37Å; F336-V366 HydrophobicContact CE1-CB 4.09Å; F336-V366 HydrophobicContact CE1-CG1 4.49Å; F336-V366 HydrophobicContact CE1-CG2 4.13Å; F336-V366 HydrophobicContact CE2-CG2 4.1Å; F336-V366 HydrophobicContact CZ-CB 4.3Å; F336-V366 HydrophobicContact CZ-CG2 3.97Å; F336-I368 HydrophobicContact CE2-CD1 3.88Å; F336-I368 HydrophobicContact CE2-CG1 3.64Å; F336-I368 HydrophobicContact CZ-CD1 4.33Å; F336-I368 HydrophobicContact CZ-CG1 3.57Å; F336-I442 HydrophobicContact CD2-CD1 3.9Å
337	I	84.9	Confident	78.8	Confident	30 Å²	30	63.7 Å²	63.7	15%	0.154	33%	0.328	C	S	.	.	H	α-helix	trans	-60.9	-44	177.2	-72	164.6	0	0	0	110.1	F290 R333 S334 A340 R341 T359	F290-I337 HydrophobicContact CE1-CG2 4.21Å; R333-I337 WeakPolarHBondContact O-CB 3.18Å; R333-I337 VanDerWaalsContact O-CG1 3.24Å; R333-I337 WeakPolarHBondContact O-CG1 3.35Å; R333-I337 PolarHBondContact O-N 2.78Å; S334-I337 PolarHBondContact O-N 2.96Å; I337-A340 PolarHBondContact O-N 2.85Å; I337-R341 HydrophobicContact CG2-CG 4.44Å; I337-R341 WeakPolarHBondContact O-CB 3.4Å; I337-R341 VanDerWaalsContact O-CG 3.29Å; I337-R341 WeakPolarHBondContact O-CG 3.48Å; I337-R341 PolarHBondContact O-N 3.43Å; I337-T359 HydrophobicContact CD1-CG2 3.92Å; I337-T359 HydrophobicContact CG1-CG2 3.71Å
338	E	81.9	Confident	79.3	Confident	134 Å²	134	63.3 Å²	63.3	63%	0.626	33%	0.327	S	S	*	.	H	α-helix	trans	-60.8	-48.3	179.2	-169.4	179.2	-176.9	0	0	111.8	S334 R335 F336 R341 L342	S334-E338 PolarHBondContact O-N 3.42Å; S334-E338 VanDerWaalsContact O-N 3.11Å; R335-E338 PolarHBondContact O-N 3.31Å; F336-E338 VanDerWaalsContact C-N 3.33Å; F336-E338 PolarHBondContact O-N 3.48Å; E338-R341 PolarHBondContact O-N 3.36Å; E338-L342 PolarHBondContact O-N 2.82Å
339	E	77.5	Confident	80.6	Confident	32 Å²	32	60.6 Å²	60.6	15%	0.15	32%	0.316	C	S	.	.	H	α-helix	trans	-68.4	-38.6	177.5	-68.8	-157.4	-175.5	0	0	112.5	R335 F336 R341 L342 M343 G438 K441 I442	R335-E339 PolarHBondContact O-N 2.87Å; F336-E339 PolarHBondContact O-N 3.49Å; E339-R341 VanDerWaalsContact C-N 3.31Å; E339-R341 PolarHBondContact O-N 2.98Å; E339-L342 WeakPolarHBondContact O-CB 3.29Å; E339-L342 PolarHBondContact O-N 3.08Å; E339-M343 WeakPolarHBondContact O-CG 3.24Å; E339-M343 PolarHBondContact O-N 3.35Å; E339-G438 VanDerWaalsContact OE2-O 3.14Å; E339-K441 WeakPolarHBondContact OE1-CD 3.39Å; E339-K441 WeakPolarHBondContact OE1-CG 3.44Å; E339-I442 HydrophobicContact CB-CD1 3.95Å; E339-I442 HydrophobicContact CB-CG1 4.14Å; E339-I442 HydrophobicContact CG-CD1 4.45Å; E339-I442 HydrophobicContact CG-CG1 4.12Å; E339-I442 WeakPolarHBondContact OE2-CG1 3.29Å
340	A	85.5	Confident	81.9	Confident	4 Å²	4	58 Å²	58	3%	0.033	30%	0.3	C	S	.	.	H	α-helix	trans	-66.1	-32.5	177.1	0	0	0	0	0	111.9	F290 F336 I337 M343 H344 L354 V357	F290-A340 HydrophobicContact CE2-CB 4.4Å; F290-A340 HydrophobicContact CZ-CB 3.67Å; F336-A340 HydrophobicContact CE1-CB 4.48Å; F336-A340 HydrophobicContact CZ-CB 4.43Å; F336-A340 WeakPolarHBondContact O-CB 3.44Å; F336-A340 PolarHBondContact O-N 2.8Å; I337-A340 PolarHBondContact O-N 2.85Å; A340-M343 PolarHBondContact O-N 2.98Å; A340-H344 WeakPolarHBondContact O-CB 3.49Å; A340-H344 PolarHBondContact O-N 2.9Å; A340-L354 HydrophobicContact CB-CD2 4.11Å; A340-L354 WeakPolarHBondContact O-CD2 3.27Å; A340-V357 HydrophobicContact CB-CG1 4Å
341	R	85.5	Confident	83.4	Confident	147 Å²	147	51.7 Å²	51.7	56%	0.555	26%	0.259	S	S	*	.	H	α-helix	trans	-64.2	-39.9	172.3	-77.9	177.6	-176	-179.1	3.9	112.4	F290 I337 E338 E339 H344 A345	F290-R341 HydrophobicContact CD1-CG 4.05Å; F290-R341 HydrophobicContact CE1-CG 3.7Å; F290-R341 HydrophobicContact CE2-CG 4.42Å; F290-R341 HydrophobicContact CZ-CG 3.9Å; I337-R341 HydrophobicContact CG2-CG 4.44Å; I337-R341 WeakPolarHBondContact O-CB 3.4Å; I337-R341 VanDerWaalsContact O-CG 3.29Å; I337-R341 WeakPolarHBondContact O-CG 3.48Å; I337-R341 PolarHBondContact O-N 3.43Å; E338-R341 PolarHBondContact O-N 3.36Å; E339-R341 VanDerWaalsContact C-N 3.31Å; E339-R341 PolarHBondContact O-N 2.98Å; R341-H344 PolarHBondContact O-N 3.02Å; R341-A345 PolarHBondContact O-N 3.4Å
342	L	81.8	Confident	84.6	Confident	107 Å²	107	50.9 Å²	50.9	56%	0.56	25%	0.254	S	S	*	.	H	α-helix	trans	-62.9	-44.8	173	-67.3	172.3	0	0	0	110.8	E338 E339 H344 A345 F346	E338-L342 PolarHBondContact O-N 2.82Å; E339-L342 WeakPolarHBondContact O-CB 3.29Å; E339-L342 PolarHBondContact O-N 3.08Å; L342-H344 VanDerWaalsContact C-N 3.28Å; L342-H344 PolarHBondContact O-N 3.24Å; L342-A345 PolarHBondContact O-N 3.18Å; L342-F346 WeakPolarHBondContact O-CD2 3.21Å
343	M	83.2	Confident	85.4	Confident	16 Å²	16	47.7 Å²	47.7	8%	0.079	24%	0.237	C	C	.	.	H	α-helix	trans	-62.5	-35.5	176.9	-66.6	179.3	65	0	0	112.8	E339 A340 A345 F346 L354 F437 L439	E339-M343 WeakPolarHBondContact O-CG 3.24Å; E339-M343 PolarHBondContact O-N 3.35Å; A340-M343 PolarHBondContact O-N 2.98Å; M343-A345 VanDerWaalsContact C-N 3.29Å; M343-A345 PolarHBondContact O-N 3.45Å; M343-F346 PolarHBondContact O-N 2.91Å; M343-L354 HydrophobicContact CB-CD2 3.92Å; M343-F437 HydrophobicContact CB-CE2 3.99Å; M343-F437 HydrophobicContact CE-CD2 4.17Å; M343-F437 HydrophobicContact CE-CE2 3.8Å; M343-F437 HydrophobicContact CE-CZ 4.06Å; M343-F437 WeakPolarHBondContact CE-O 3.5Å; M343-F437 HydrophobicContact CG-CD2 4.21Å; M343-F437 HydrophobicContact CG-CE2 3.77Å; M343-F437 VanDerWaalsContact SD-O 3.37Å; M343-L439 HydrophobicContact CE-CD2 4.29Å; M343-L439 HydrophobicContact CE-CG 4.13Å; M343-L439 HydrophobicContact SD-CD2 3.82Å; M343-L439 HydrophobicContact SD-CG 4.12Å
344	H	86	Confident	85.9	Confident	34 Å²	34	46.2 Å²	46.2	16%	0.157	23%	0.231	C	C	.	.	H	α-helix	trans	-67.7	-28.5	178	-173	-95.6	0	0	0	113	Q286 F290 A340 R341 L342 F346 L354	Q286-H344 PolarHBondContact NE2-CD2 3.36Å; Q286-H344 VanDerWaalsContact NE2-CD2 3.34Å; Q286-H344 PolarHBondContact NE2-CE1 3.06Å; Q286-H344 PolarHBondContact NE2-NE2 2.85Å; Q286-H344 VanDerWaalsContact NE2-NE2 3.14Å; Q286-H344 PolarHBondContact NE2-O 2.77Å; F290-H344 HydrophobicContact CD2-CB 3.96Å; F290-H344 AromaticContact CD2-CD2 3.65Å; F290-H344 AromaticContact CD2-CG 3.67Å; F290-H344 HydrophobicContact CE2-CB 3.72Å; F290-H344 AromaticContact CE2-CG 3.94Å; A340-H344 WeakPolarHBondContact O-CB 3.49Å; A340-H344 PolarHBondContact O-N 2.9Å; R341-H344 PolarHBondContact O-N 3.02Å; L342-H344 VanDerWaalsContact C-N 3.28Å; L342-H344 PolarHBondContact O-N 3.24Å; H344-F346 VanDerWaalsContact C-N 3.27Å; H344-F346 PolarHBondContact O-N 3.29Å; H344-L354 HydrophobicContact CB-CD2 4.08Å; H344-L354 PolarHBondContact CD2-O 2.94Å; H344-L354 VanDerWaalsContact CD2-O 3.3Å
345	A	83.8	Confident	86.3	Confident	60 Å²	60	42.3 Å²	42.3	50%	0.496	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-8.2	178.6	0	0	0	0	0	113.5	R341 L342 M343 H347	R341-A345 PolarHBondContact O-N 3.4Å; L342-A345 PolarHBondContact O-N 3.18Å; M343-A345 VanDerWaalsContact C-N 3.29Å; M343-A345 PolarHBondContact O-N 3.45Å; A345-H347 PolarHBondContact O-ND1 2.94Å; A345-H347 VanDerWaalsContact O-ND1 3.17Å
346	F	85.7	Confident	87	Confident	20 Å²	20	36.3 Å²	36.3	9%	0.088	18%	0.181	C	C	.	.			trans	-80.9	130.8	175.7	-66.3	-46.5	0	0	0	111.2	L342 M343 H344 Q353 Y408 M412 F437	L342-F346 WeakPolarHBondContact O-CD2 3.21Å; M343-F346 PolarHBondContact O-N 2.91Å; H344-F346 VanDerWaalsContact C-N 3.27Å; H344-F346 PolarHBondContact O-N 3.29Å; F346-Q353 PolarHBondContact O-NE2 2.84Å; F346-Q353 PolarHBondContact O-OE1 3.28Å; F346-Y408 WeakPolarHBondContact CA-OH 3.44Å; F346-Y408 HydrophobicContact CB-CE1 3.94Å; F346-Y408 AromaticContact CD1-CE1 3.8Å; F346-Y408 HydrophobicContact CD1-CE1 3.8Å; F346-Y408 HydrophobicContact CG-CE1 4.13Å; F346-M412 HydrophobicContact CD1-CB 4.31Å; F346-M412 HydrophobicContact CD1-CE 4.2Å; F346-M412 HydrophobicContact CD1-CG 4.04Å; F346-M412 HydrophobicContact CE1-CB 3.65Å; F346-M412 HydrophobicContact CE1-CE 3.95Å; F346-M412 HydrophobicContact CE1-CG 3.87Å; F346-M412 HydrophobicContact CZ-CB 4.49Å; F346-F437 HydrophobicContact CD2-CD2 4.13Å; F346-F437 AromaticContact CD2-CE2 3.46Å; F346-F437 HydrophobicContact CD2-CE2 3.46Å; F346-F437 VanDerWaalsContact CD2-CE2 3.46Å; F346-F437 HydrophobicContact CD2-CZ 4.22Å; F346-F437 HydrophobicContact CE2-CD2 4.19Å; F346-F437 AromaticContact CE2-CE2 3.93Å; F346-F437 HydrophobicContact CE2-CE2 3.93Å
347	H	84.4	Confident	87.5	Confident	70 Å²	70	36.3 Å²	36.3	32%	0.324	18%	0.181	S	C	.	.			trans	-134.4	103.2	178.8	-63.2	95.5	0	0	0	109.6	Q286 A345 Q353 Y408	Q286-H347 VanDerWaalsContact CD-NE2 3.31Å; Q286-H347 PolarHBondContact NE2-NE2 2.85Å; Q286-H347 PolarHBondContact OE1-NE2 3.18Å; A345-H347 PolarHBondContact O-ND1 2.94Å; A345-H347 VanDerWaalsContact O-ND1 3.17Å; H347-Q353 PolarHBondContact CD2-OE1 3.24Å; H347-Q353 VanDerWaalsContact CD2-OE1 3.28Å; H347-Y408 PolarHBondContact N-OH 3.09Å
348	H	87.8	Confident	87.9	Confident	18 Å²	18	34.9 Å²	34.9	8%	0.083	17%	0.173	C	C	.	.			trans	-154.3	138.9	177.1	-172.1	-92.6	0	0	0	110.7	R350 I351 S404 Y408	H348-R350 WeakPolarHBondContact ND1-CB 3.48Å; H348-R350 PolarHBondContact ND1-N 3.16Å; H348-R350 PolarHBondContact O-N 3.5Å; H348-I351 HydrophobicContact CB-CB 4.03Å; H348-I351 HydrophobicContact CB-CG1 3.73Å; H348-I351 PolarHBondContact O-N 2.66Å; H348-I351 VanDerWaalsContact O-O 3.07Å; H348-S404 PolarHBondContact CE1-OG 3.21Å; H348-Y408 HydrophobicContact CB-CD1 3.62Å; H348-Y408 HydrophobicContact CB-CD2 4.15Å; H348-Y408 HydrophobicContact CB-CE1 3.87Å; H348-Y408 HydrophobicContact CB-CE2 4.37Å; H348-Y408 HydrophobicContact CB-CG 3.75Å; H348-Y408 AromaticContact CD2-CD2 3.79Å; H348-Y408 AromaticContact CD2-CG 3.65Å; H348-Y408 AromaticContact CG-CG 3.72Å
349	P	88.8	Confident	88.3	Confident	40 Å²	40	28.7 Å²	28.7	26%	0.26	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-11.5	-177.7	26.5	-37.9	0	0	0	114.1	M85 K433	M85-P349 HydrophobicContact CE-CG 4.3Å; M85-P349 HydrophobicContact CG-CG 4.27Å; M85-P349 WeakPolarHBondContact SD-CD 3.31Å; M85-P349 HydrophobicContact SD-CG 3.74Å; P349-K433 WeakPolarHBondContact O-CE 3.21Å
350	R	94.3	Very high	88.8	Confident	20 Å²	20	32.1 Å²	32.1	8%	0.075	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	11.4	177.1	-52.6	-61.9	178.7	-136.9	6	113.9	E188 H348 Q401 V432 K433 V434	E188-R350 IonicContact OE1-NH2 2.65Å; E188-R350 PolarHBondContact OE1-NH2 3.32Å; E188-R350 IonicContact OE2-NH2 2.69Å; E188-R350 PolarHBondContact OE2-NH2 3.32Å; H348-R350 WeakPolarHBondContact ND1-CB 3.48Å; H348-R350 PolarHBondContact ND1-N 3.16Å; H348-R350 PolarHBondContact O-N 3.5Å; R350-Q401 WeakPolarHBondContact CB-O 3.08Å; R350-Q401 VanDerWaalsContact CG-O 3.3Å; R350-Q401 WeakPolarHBondContact CG-O 3.25Å; R350-V432 WeakPolarHBondContact CD-O 3.32Å; R350-K433 CarbonylContact O-C 3.51Å; R350-K433 WeakPolarHBondContact O-CA 3.05Å; R350-V434 PolarHBondContact O-N 3.28Å
351	I	93.3	Very high	89	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.01	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-118.5	132.8	173.3	-62.1	-56.2	0	0	0	107.4	H348 Q353 G405 Y408 L409 V434 F437	H348-I351 HydrophobicContact CB-CB 4.03Å; H348-I351 HydrophobicContact CB-CG1 3.73Å; H348-I351 PolarHBondContact O-N 2.66Å; H348-I351 VanDerWaalsContact O-O 3.07Å; I351-Q353 PolarHBondContact O-N 3.39Å; I351-G405 WeakPolarHBondContact CD1-O 3.26Å; I351-Y408 HydrophobicContact CG1-CD1 3.85Å; I351-Y408 HydrophobicContact CG1-CE1 4.39Å; I351-L409 HydrophobicContact CD1-CD1 4.02Å; I351-L409 HydrophobicContact CD1-CD2 4.16Å; I351-L409 HydrophobicContact CD1-CG 3.87Å; I351-V434 HydrophobicContact CD1-CB 3.78Å; I351-V434 HydrophobicContact CD1-CG1 4.47Å; I351-V434 HydrophobicContact CD1-CG2 4.21Å; I351-F437 HydrophobicContact CG2-CD1 4.08Å; I351-F437 HydrophobicContact CG2-CE1 3.22Å; I351-F437 HydrophobicContact CG2-CE2 4.37Å; I351-F437 HydrophobicContact CG2-CZ 3.38Å
352	V	93.4	Very high	88.9	Confident	7 Å²	7	34.9 Å²	34.9	4%	0.042	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-65.8	120.9	176.2	172.2	0	0	0	0	109.1	L354 T370 E371 M373 L425 K433 V434	V352-L354 PolarHBondContact O-N 2.94Å; V352-T370 HydrophobicContact CG1-CG2 4.03Å; V352-E371 HydrophobicContact CG1-CG 4.02Å; V352-M373 HydrophobicContact CG2-CG 4.37Å; V352-L425 HydrophobicContact CG2-CB 4.44Å; V352-L425 HydrophobicContact CG2-CD1 3.99Å; V352-L425 HydrophobicContact CG2-CG 4.41Å; V352-K433 HydrophobicContact CG2-CB 3.57Å; V352-K433 HydrophobicContact CG2-CD 4.42Å; V352-V434 WeakPolarHBondContact CG2-O 3.47Å; V352-V434 PolarHBondContact N-O 3.25Å
353	Q	91.6	Very high	89.1	Confident	13 Å²	13	36.3 Å²	36.3	6%	0.061	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-73.1	122.5	-178.3	-169.3	65.4	65.6	0	0	110.9	P284 Q286 F346 H347 I351 L355 T370 E371	P284-Q353 HydrophobicContact CB-CB 4.39Å; P284-Q353 HydrophobicContact CG-CB 3.56Å; P284-Q353 HydrophobicContact CG-CG 3.9Å; Q286-Q353 HydrophobicContact CG-CG 4.18Å; Q286-Q353 VanDerWaalsContact NE2-NE2 3.12Å; F346-Q353 PolarHBondContact O-NE2 2.84Å; F346-Q353 PolarHBondContact O-OE1 3.28Å; H347-Q353 PolarHBondContact CD2-OE1 3.24Å; H347-Q353 VanDerWaalsContact CD2-OE1 3.28Å; I351-Q353 PolarHBondContact O-N 3.39Å; Q353-L355 HydrophobicContact CB-CD2 4.33Å; Q353-L355 HydrophobicContact CG-CD2 3.97Å; Q353-L355 PolarHBondContact O-N 2.8Å; Q353-T370 VanDerWaalsContact O-CA 3.28Å; Q353-T370 WeakPolarHBondContact O-CA 3.35Å; Q353-T370 WeakPolarHBondContact O-CB 3.3Å; Q353-E371 HydrophobicContact CB-CG 4.38Å; Q353-E371 PolarHBondContact N-OE1 3.33Å; Q353-E371 PolarHBondContact O-N 3.27Å; Q353-E371 VanDerWaalsContact O-N 3.14Å
354	L	91.7	Very high	89.3	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	121.1	162.3	-176.5	68.1	0	0	0	108.9	Q286 F290 A340 M343 H344 V352 V357 I368 I369 T370	Q286-L354 PolarHBondContact NE2-O 3.1Å; F290-L354 HydrophobicContact CE2-CD2 4.19Å; A340-L354 HydrophobicContact CB-CD2 4.11Å; A340-L354 WeakPolarHBondContact O-CD2 3.27Å; M343-L354 HydrophobicContact CB-CD2 3.92Å; H344-L354 HydrophobicContact CB-CD2 4.08Å; H344-L354 PolarHBondContact CD2-O 2.94Å; H344-L354 VanDerWaalsContact CD2-O 3.3Å; V352-L354 PolarHBondContact O-N 2.94Å; L354-V357 HydrophobicContact CD1-CG1 4.46Å; L354-I368 HydrophobicContact CD1-CG2 3.43Å; L354-I368 VanDerWaalsContact CD1-CG2 3.43Å; L354-I369 WeakPolarHBondContact CD1-O 3.21Å; L354-T370 HydrophobicContact CD1-CG2 4.19Å
355	L	92.3	Very high	89.4	Confident	6 Å²	6	39.8 Å²	39.8	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-32.3	-179.5	-52.1	-178.2	0	0	0	112.1	P284 F287 V322 Q353 I369	P284-L355 HydrophobicContact CB-CD2 3.7Å; P284-L355 HydrophobicContact CG-CD2 4.49Å; F287-L355 HydrophobicContact CD2-CB 4.09Å; F287-L355 WeakPolarHBondContact CD2-O 3.48Å; F287-L355 HydrophobicContact CE1-CB 4.23Å; F287-L355 HydrophobicContact CE1-CD1 4.45Å; F287-L355 HydrophobicContact CE2-CB 3.66Å; F287-L355 WeakPolarHBondContact CG-O 3.03Å; F287-L355 HydrophobicContact CZ-CB 3.75Å; F287-L355 HydrophobicContact CZ-CD1 4.14Å; F287-L355 PolarHBondContact N-O 2.73Å; V322-L355 HydrophobicContact CB-CD1 4.48Å; V322-L355 HydrophobicContact CG1-CD1 3.67Å; Q353-L355 HydrophobicContact CB-CD2 4.33Å; Q353-L355 HydrophobicContact CG-CD2 3.97Å; Q353-L355 PolarHBondContact O-N 2.8Å; L355-I369 HydrophobicContact CB-CG2 4.48Å; L355-I369 WeakPolarHBondContact CB-O 3.12Å; L355-I369 PolarHBondContact N-O 3.34Å
356	G	92.4	Very high	89.6	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.8	-172.8	177.3	0	0	0	0	0	112	F290 I369	F290-G356 CarbonylContact O-C 3.52Å; F290-G356 VanDerWaalsContact O-CA 3.24Å; F290-G356 WeakPolarHBondContact O-CA 3.18Å; G356-I369 PolarHBondContact N-O 2.9Å; G356-I369 WeakPolarHBondContact O-CB 3.24Å; G356-I369 PolarHBondContact O-N 3.07Å
357	V	92.6	Very high	89.9	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	157.7	-179	-61.3	0	0	0	0	111.9	F290 E291 I292 F336 A340 L354 T359 Y367	F290-V357 HydrophobicContact CD1-CG2 4.2Å; F290-V357 HydrophobicContact CE1-CG2 3.62Å; F290-V357 HydrophobicContact CE2-CG1 4.36Å; F290-V357 HydrophobicContact CE2-CG2 4.39Å; F290-V357 HydrophobicContact CZ-CG1 4.03Å; F290-V357 HydrophobicContact CZ-CG2 3.74Å; F290-V357 PolarHBondContact O-N 3.37Å; E291-V357 WeakPolarHBondContact CA-O 3.42Å; E291-V357 HydrophobicContact CG-CG2 3.88Å; I292-V357 PolarHBondContact N-O 2.76Å; F336-V357 HydrophobicContact CE1-CB 4.12Å; F336-V357 HydrophobicContact CE1-CG1 3.98Å; F336-V357 HydrophobicContact CZ-CB 4.44Å; F336-V357 HydrophobicContact CZ-CG1 3.95Å; A340-V357 HydrophobicContact CB-CG1 4Å; L354-V357 HydrophobicContact CD1-CG1 4.46Å; V357-T359 HydrophobicContact CG2-CG2 4.07Å; V357-Y367 CarbonylContact C-O 3.56Å; V357-Y367 WeakPolarHBondContact CA-O 2.72Å; V357-Y367 WeakPolarHBondContact CB-O 3.37Å
358	C	92.8	Very high	90.2	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	114.8	161.7	-53.4	0	0	0	0	108.7	I292 R294 V366 Y367	I292-C358 PolarHBondContact O-SG 3.02Å; I292-C358 VanDerWaalsContact O-SG 3.38Å; R294-C358 HydrophobicContact CB-CB 4.24Å; C358-V366 CarbonylContact O-C 3.52Å; C358-V366 VanDerWaalsContact O-CA 3.28Å; C358-V366 WeakPolarHBondContact O-CA 3.36Å; C358-Y367 HydrophobicContact CB-CD2 4.08Å; C358-Y367 HydrophobicContact CB-CG 4.18Å; C358-Y367 PolarHBondContact N-O 3.13Å; C358-Y367 PolarHBondContact O-N 3.47Å
359	T	89.5	Confident	90.4	Very high	4 Å²	4	33.2 Å²	33.2	3%	0.025	17%	0.171	C	C	.	.			trans	-96	-49.7	178.7	49.9	0	0	0	0	109.2	E291 R333 F336 I337 V357	E291-T359 PolarHBondContact OE2-OG1 2.65Å; R333-T359 PolarHBondContact NH1-O 3.29Å; R333-T359 PolarHBondContact NH2-O 2.78Å; F336-T359 HydrophobicContact CD1-CG2 4.29Å; F336-T359 HydrophobicContact CE1-CG2 4.2Å; I337-T359 HydrophobicContact CD1-CG2 3.92Å; I337-T359 HydrophobicContact CG1-CG2 3.71Å; V357-T359 HydrophobicContact CG2-CG2 4.07Å
360	E	89.4	Confident	90.7	Very high	104 Å²	104	32.5 Å²	32.5	49%	0.486	17%	0.166	S	C	.	.			trans	-77.2	158.4	-177.2	-65.2	-52.4	127.3	0	0	115.7	R294 R333 E362	R294-E360 PolarHBondContact NE-O 2.86Å; R294-E360 PolarHBondContact NH2-O 3.01Å; R294-E360 VanDerWaalsContact NH2-O 3.1Å; R333-E360 IonicContact NH1-OE1 3.5Å; R333-E360 PolarHBondContact NH1-OE1 2.9Å; R333-E360 IonicContact NH1-OE2 3.56Å; R333-E360 PolarHBondContact NH1-OE2 3.35Å; E360-E362 PolarHBondContact OE2-N 2.97Å; E360-E362 VanDerWaalsContact OE2-N 3.16Å
361	P	89.5	Confident	90.6	Very high	50 Å²	50	32.3 Å²	32.3	33%	0.325	17%	0.166	S	C	.	.	S	Bend	cis	-75.1	158.5	-11	32.4	-36.1	0	0	0	113.2	R333 D363 Q364	R333-P361 PolarHBondContact NH1-O 3.14Å; R333-P361 PolarHBondContact NH2-O 3.36Å; P361-D363 VanDerWaalsContact CB-OD1 3.29Å; P361-D363 WeakPolarHBondContact CB-OD1 3.46Å; P361-D363 WeakPolarHBondContact CG-OD1 3.47Å; P361-D363 PolarHBondContact O-N 2.86Å; P361-D363 VanDerWaalsContact O-N 3.12Å; P361-Q364 HydrophobicContact CG-CB 4.16Å; P361-Q364 HydrophobicContact CG-CG 3.84Å; P361-Q364 PolarHBondContact O-N 3.1Å
362	E	83.7	Confident	90.7	Very high	160 Å²	160	33.5 Å²	33.5	75%	0.748	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-45.1	-34.3	179.2	-84.3	-168.5	178.7	0	0	117.2	R333 E360 Q364	R333-E362 VanDerWaalsContact NH1-N 3.17Å; R333-E362 VanDerWaalsContact NH2-C 3.3Å; R333-E362 PolarHBondContact NH2-O 3.47Å; R333-E362 VanDerWaalsContact NH2-O 3.13Å; E360-E362 PolarHBondContact OE2-N 2.97Å; E360-E362 VanDerWaalsContact OE2-N 3.16Å; E362-Q364 VanDerWaalsContact C-N 3.28Å; E362-Q364 PolarHBondContact O-N 3.28Å
363	D	85.7	Confident	90.7	Very high	136 Å²	136	33.7 Å²	33.7	73%	0.727	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	-0.5	-179.4	65.2	-35.3	0	0	0	114.1	P361	P361-D363 VanDerWaalsContact CB-OD1 3.29Å; P361-D363 WeakPolarHBondContact CB-OD1 3.46Å; P361-D363 WeakPolarHBondContact CG-OD1 3.47Å; P361-D363 PolarHBondContact O-N 2.86Å; P361-D363 VanDerWaalsContact O-N 3.12Å
364	Q	87.6	Confident	90.7	Very high	79 Å²	79	39.9 Å²	39.9	37%	0.369	20%	0.196	S	C	.	.	S	Bend	trans	-114.3	152.5	-177.7	-69.8	-169.3	31.9	0	0	115	R333 P361 E362	R333-Q364 PolarHBondContact NH2-O 3.43Å; P361-Q364 HydrophobicContact CG-CB 4.16Å; P361-Q364 HydrophobicContact CG-CG 3.84Å; P361-Q364 PolarHBondContact O-N 3.1Å; E362-Q364 VanDerWaalsContact C-N 3.28Å; E362-Q364 PolarHBondContact O-N 3.28Å
365	P	86.6	Confident	90.8	Very high	45 Å²	45	41.7 Å²	41.7	29%	0.292	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-56.4	135.2	174	-29	37.5	0	0	0	113.1	R294 R327 L328	R294-P365 PolarHBondContact NH1-O 2.81Å; R294-P365 PolarHBondContact NH2-O 3.37Å; R327-P365 WeakPolarHBondContact O-CA 3.44Å; R327-P365 VanDerWaalsContact O-CB 3.25Å; R327-P365 WeakPolarHBondContact O-CB 3.34Å; L328-P365 HydrophobicContact CD2-CB 4.44Å; L328-P365 HydrophobicContact CD2-CG 4.05Å
366	V	88	Confident	90.9	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.03	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	142.7	174.6	-59	0	0	0	0	111.2	M326 R327 R333 F336 C358	M326-V366 WeakPolarHBondContact CA-O 3.31Å; R327-V366 HydrophobicContact CB-CG2 3.77Å; R327-V366 HydrophobicContact CG-CG2 4.31Å; R327-V366 PolarHBondContact N-O 2.68Å; R333-V366 HydrophobicContact CG-CG1 4.32Å; F336-V366 HydrophobicContact CD1-CB 4.48Å; F336-V366 HydrophobicContact CD1-CG1 4.47Å; F336-V366 HydrophobicContact CD1-CG2 4.4Å; F336-V366 HydrophobicContact CD2-CG2 4.37Å; F336-V366 HydrophobicContact CE1-CB 4.09Å; F336-V366 HydrophobicContact CE1-CG1 4.49Å; F336-V366 HydrophobicContact CE1-CG2 4.13Å; F336-V366 HydrophobicContact CE2-CG2 4.1Å; F336-V366 HydrophobicContact CZ-CB 4.3Å; F336-V366 HydrophobicContact CZ-CG2 3.97Å; C358-V366 CarbonylContact O-C 3.52Å; C358-V366 VanDerWaalsContact O-CA 3.28Å; C358-V366 WeakPolarHBondContact O-CA 3.36Å
367	Y	91.7	Very high	91.1	Very high	17 Å²	17	43.5 Å²	43.5	7%	0.067	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	131.1	173.6	-66	-7.5	0	0	0	110.4	R294 I297 V324 M326 V357 C358	R294-Y367 HydrophobicContact CG-CD2 4.32Å; R294-Y367 HydrophobicContact CG-CE2 3.78Å; R294-Y367 PolarHBondContact NH1-OH 3.02Å; I297-Y367 HydrophobicContact CG2-CD2 4.39Å; I297-Y367 HydrophobicContact CG2-CE2 4.34Å; V324-Y367 HydrophobicContact CG1-CD1 4.11Å; V324-Y367 HydrophobicContact CG1-CD2 3.85Å; V324-Y367 HydrophobicContact CG1-CE2 4.39Å; V324-Y367 HydrophobicContact CG1-CG 3.7Å; M326-Y367 HydrophobicContact CB-CD1 4.15Å; M326-Y367 HydrophobicContact CB-CE1 4.14Å; M326-Y367 HydrophobicContact CG-CD1 3.61Å; M326-Y367 HydrophobicContact CG-CE1 3.43Å; M326-Y367 VanDerWaalsContact CG-CE1 3.43Å; M326-Y367 HydrophobicContact SD-CD1 4.23Å; M326-Y367 HydrophobicContact SD-CE1 3.41Å; M326-Y367 WeakPolarHBondContact SD-CE1 3.32Å; V357-Y367 CarbonylContact C-O 3.56Å; V357-Y367 WeakPolarHBondContact CA-O 2.72Å; V357-Y367 WeakPolarHBondContact CB-O 3.37Å; C358-Y367 HydrophobicContact CB-CD2 4.08Å; C358-Y367 HydrophobicContact CB-CG 4.18Å; C358-Y367 PolarHBondContact N-O 3.13Å; C358-Y367 PolarHBondContact O-N 3.47Å
368	I	90.6	Very high	91.3	Very high	7 Å²	7	43.5 Å²	43.5	4%	0.036	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	120.6	166.4	-57.8	163.5	0	0	0	106.5	V324 K325 F336 L354 T370 L439	V324-I368 WeakPolarHBondContact CA-O 3.43Å; K325-I368 HydrophobicContact CB-CB 4.29Å; K325-I368 HydrophobicContact CD-CD1 4.49Å; K325-I368 PolarHBondContact N-O 2.84Å; K325-I368 PolarHBondContact O-N 3.31Å; F336-I368 HydrophobicContact CE2-CD1 3.88Å; F336-I368 HydrophobicContact CE2-CG1 3.64Å; F336-I368 HydrophobicContact CZ-CD1 4.33Å; F336-I368 HydrophobicContact CZ-CG1 3.57Å; L354-I368 HydrophobicContact CD1-CG2 3.43Å; L354-I368 VanDerWaalsContact CD1-CG2 3.43Å; I368-T370 HydrophobicContact CG2-CG2 4.17Å; I368-L439 HydrophobicContact CD1-CD1 4.03Å; I368-L439 HydrophobicContact CD1-CD2 3.82Å
369	I	93.7	Very high	91.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	114.8	-173.8	-50	169.1	0	0	0	109	F287 I292 I297 V322 A323 V324 L354 L355 G356	F287-I369 HydrophobicContact CE2-CB 4.12Å; F287-I369 HydrophobicContact CE2-CD1 4Å; F287-I369 HydrophobicContact CE2-CG2 3.79Å; F287-I369 HydrophobicContact CZ-CG2 3.87Å; I292-I369 HydrophobicContact CD1-CD1 3.31Å; I292-I369 HydrophobicContact CG1-CD1 3.75Å; I297-I369 HydrophobicContact CD1-CD1 3.85Å; I297-I369 HydrophobicContact CG1-CD1 3.95Å; V322-I369 HydrophobicContact CB-CG2 3.77Å; V322-I369 HydrophobicContact CG1-CG2 4.11Å; V322-I369 HydrophobicContact CG2-CG2 3.78Å; A323-I369 WeakPolarHBondContact O-CA 3.42Å; V324-I369 HydrophobicContact CG2-CG1 4.34Å; V324-I369 HydrophobicContact CG2-CG2 4.46Å; L354-I369 WeakPolarHBondContact CD1-O 3.21Å; L355-I369 HydrophobicContact CB-CG2 4.48Å; L355-I369 WeakPolarHBondContact CB-O 3.12Å; L355-I369 PolarHBondContact N-O 3.34Å; G356-I369 PolarHBondContact N-O 2.9Å; G356-I369 WeakPolarHBondContact O-CB 3.24Å; G356-I369 PolarHBondContact O-N 3.07Å
370	T	94.1	Very high	91.8	Very high	26 Å²	26	51.2 Å²	51.2	16%	0.16	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	168.4	-179.8	67.2	0	0	0	0	111.2	A323 V352 Q353 L354 I368	A323-T370 PolarHBondContact N-O 3.07Å; A323-T370 PolarHBondContact O-N 3.2Å; V352-T370 HydrophobicContact CG1-CG2 4.03Å; Q353-T370 VanDerWaalsContact O-CA 3.28Å; Q353-T370 WeakPolarHBondContact O-CA 3.35Å; Q353-T370 WeakPolarHBondContact O-CB 3.3Å; L354-T370 HydrophobicContact CD1-CG2 4.19Å; I368-T370 HydrophobicContact CG2-CG2 4.17Å
371	E	93	Very high	92.1	Very high	16 Å²	16	46.5 Å²	46.5	8%	0.075	24%	0.237	C	C	.	.			trans	-54.2	149.8	162.3	64.6	179.3	133.3	0	0	111.5	P284 V352 Q353 K433	P284-E371 HydrophobicContact CB-CB 4.11Å; P284-E371 HydrophobicContact CG-CB 4.27Å; V352-E371 HydrophobicContact CG1-CG 4.02Å; Q353-E371 HydrophobicContact CB-CG 4.38Å; Q353-E371 PolarHBondContact N-OE1 3.33Å; Q353-E371 PolarHBondContact O-N 3.27Å; Q353-E371 VanDerWaalsContact O-N 3.14Å; E371-K433 WeakPolarHBondContact OE1-CD 3.17Å; E371-K433 IonicContact OE1-NZ 3.66Å; E371-K433 PolarHBondContact OE1-NZ 3.09Å; E371-K433 IonicContact OE2-NZ 2.9Å; E371-K433 PolarHBondContact OE2-NZ 2.71Å
372	L	93.9	Very high	92.5	Very high	26 Å²	26	44.1 Å²	44.1	14%	0.136	22%	0.222	C	C	.	.			trans	-89	121.5	178.8	177.3	71.3	0	0	0	110.4	L303 L313 E321 A323	L303-L372 HydrophobicContact CD1-CD1 3.81Å; L313-L372 HydrophobicContact CD1-CD1 3.93Å; L313-L372 HydrophobicContact CD1-CD2 3.5Å; L313-L372 HydrophobicContact CD1-CG 4.32Å; E321-L372 HydrophobicContact CB-CD2 4.12Å; A323-L372 HydrophobicContact CB-CD1 4.26Å
373	M	94.1	Very high	93.1	Very high	11 Å²	11	43.1 Å²	43.1	5%	0.054	21%	0.211	C	C	.	.			trans	-98.9	109.4	173.4	-60.4	-67.1	-70.2	0	0	109.6	V352 K375 G376 L425 V426 D427 K433	V352-M373 HydrophobicContact CG2-CG 4.37Å; M373-K375 VanDerWaalsContact C-N 3.34Å; M373-K375 PolarHBondContact O-N 2.77Å; M373-G376 PolarHBondContact O-N 2.79Å; M373-L425 HydrophobicContact CB-CB 3.6Å; M373-L425 HydrophobicContact CB-CD1 4.01Å; M373-L425 HydrophobicContact CB-CG 4.4Å; M373-L425 HydrophobicContact CE-CB 4.08Å; M373-L425 VanDerWaalsContact CE-O 3.28Å; M373-L425 WeakPolarHBondContact CE-O 3.47Å; M373-L425 HydrophobicContact CG-CB 3.55Å; M373-L425 HydrophobicContact CG-CD1 3.73Å; M373-L425 HydrophobicContact CG-CG 4.3Å; M373-V426 CarbonylContact C-O 3.53Å; M373-D427 HydrophobicContact CE-CB 3.71Å; M373-D427 HydrophobicContact SD-CB 4.12Å; M373-K433 HydrophobicContact CE-CB 3.87Å; M373-K433 HydrophobicContact CE-CD 3.93Å; M373-K433 HydrophobicContact CE-CG 3.64Å; M373-K433 HydrophobicContact SD-CD 3.83Å; M373-K433 HydrophobicContact SD-CG 4.24Å
374	R	92.8	Very high	93.6	Very high	143 Å²	143	39.4 Å²	39.4	54%	0.54	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-25.6	-160.7	-67	-170.1	-178.2	-81.4	-4.9	115.4	E321 D427 Q428	E321-R374 IonicContact OE2-CZ 3.5Å; E321-R374 IonicContact OE2-NH1 3.51Å; E321-R374 PolarHBondContact OE2-NH1 3.06Å; E321-R374 IonicContact OE2-NH2 2.83Å; E321-R374 PolarHBondContact OE2-NH2 3.39Å; R374-D427 PolarHBondContact N-OD1 2.91Å; R374-D427 VanDerWaalsContact N-OD1 3.13Å; R374-Q428 HydrophobicContact CB-CB 4.38Å
375	K	93.6	Very high	94	Very high	40 Å²	40	42.6 Å²	42.6	17%	0.174	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	0.5	-178.7	-65.9	-175.9	178.8	-67.8	0	113.4	M373 F381 E386 V426 D427	M373-K375 VanDerWaalsContact C-N 3.34Å; M373-K375 PolarHBondContact O-N 2.77Å; K375-F381 HydrophobicContact CB-CD2 4.25Å; K375-F381 HydrophobicContact CD-CD2 4.07Å; K375-F381 HydrophobicContact CD-CE2 3.7Å; K375-F381 HydrophobicContact CD-CZ 4.25Å; K375-E386 IonicContact NZ-OE1 2.68Å; K375-E386 PolarHBondContact NZ-OE1 3.45Å; K375-E386 IonicContact NZ-OE2 3.64Å; K375-E386 PolarHBondContact NZ-OE2 2.74Å; K375-V426 WeakPolarHBondContact CA-O 3.34Å; K375-V426 HydrophobicContact CB-CB 3.87Å; K375-V426 HydrophobicContact CB-CG1 4.02Å; K375-V426 WeakPolarHBondContact CB-O 3.44Å; K375-V426 HydrophobicContact CD-CG1 3.97Å; K375-V426 PolarHBondContact N-O 3.12Å; K375-D427 WeakPolarHBondContact CD-O 3.39Å
376	G	94.3	Very high	94.4	Very high	30 Å²	30	43.7 Å²	43.7	31%	0.309	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	75.2	-153.3	175	0	0	0	0	0	113.2	M373 L425 V426	M373-G376 PolarHBondContact O-N 2.79Å; G376-L425 CarbonylContact O-C 3.59Å; G376-L425 WeakPolarHBondContact O-CA 3.48Å; G376-V426 PolarHBondContact N-O 3.5Å; G376-V426 PolarHBondContact O-N 3.18Å
377	A	94.9	Very high	94.7	Very high	15 Å²	15	43.4 Å²	43.4	12%	0.124	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	141.3	-177.2	0	0	0	0	0	111.9	Y379 D380 F381 I424 L425	A377-Y379 PolarHBondContact O-N 3.22Å; A377-D380 PolarHBondContact O-N 2.77Å; A377-D380 VanDerWaalsContact O-N 3.12Å; A377-F381 WeakPolarHBondContact O-CB 3.23Å; A377-F381 PolarHBondContact O-N 2.74Å; A377-I424 CarbonylContact C-O 3.58Å; A377-I424 WeakPolarHBondContact CA-O 3.32Å; A377-L425 HydrophobicContact CB-CD2 4.31Å
378	L	97.7	Very high	94.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.6	-37.2	178.6	178.5	64	0	0	0	111.3	D380 F381 L382 I398 I402 A421 I424 V426 I486	L378-D380 VanDerWaalsContact C-N 3.34Å; L378-D380 PolarHBondContact O-N 2.83Å; L378-F381 HydrophobicContact CD1-CD1 4.12Å; L378-F381 PolarHBondContact O-N 2.99Å; L378-L382 HydrophobicContact CD1-CD1 4.1Å; L378-L382 HydrophobicContact CD1-CD2 4.17Å; L378-L382 HydrophobicContact CD1-CG 3.81Å; L378-L382 HydrophobicContact CG-CD1 3.87Å; L378-L382 HydrophobicContact CG-CG 4.09Å; L378-L382 WeakPolarHBondContact O-CB 3.34Å; L378-L382 VanDerWaalsContact O-CG 3.24Å; L378-L382 WeakPolarHBondContact O-CG 3.3Å; L378-L382 PolarHBondContact O-N 3.13Å; L378-I398 HydrophobicContact CD1-CD1 4.23Å; L378-I398 HydrophobicContact CD1-CG2 4.27Å; L378-I398 HydrophobicContact CD2-CG2 3.77Å; L378-I402 HydrophobicContact CD2-CD1 4.07Å; L378-A421 WeakPolarHBondContact CB-O 3.31Å; L378-A421 PolarHBondContact N-O 3.49Å; L378-I424 HydrophobicContact CB-CB 3.82Å; L378-I424 HydrophobicContact CB-CG2 4.01Å; L378-I424 WeakPolarHBondContact CB-O 3.41Å; L378-I424 HydrophobicContact CD2-CB 3.94Å; L378-I424 HydrophobicContact CD2-CG1 4.36Å; L378-I424 HydrophobicContact CD2-CG2 3.83Å; L378-I424 PolarHBondContact N-O 3.02Å; L378-V426 HydrophobicContact CB-CG2 3.84Å; L378-V426 HydrophobicContact CD1-CG2 3.74Å; L378-V426 HydrophobicContact CG-CG2 4.42Å; L378-I486 HydrophobicContact CD2-CD1 4.28Å; L378-I486 HydrophobicContact CD2-CG1 4.07Å
379	Y	96	Very high	94.9	Very high	65 Å²	65	53 Å²	53	26%	0.255	25%	0.251	S	S	.	.	H	α-helix	trans	-53.8	-48.5	174.8	179.9	-95.7	0	0	0	112.7	A377 R383 A421 G490	A377-Y379 PolarHBondContact O-N 3.22Å; Y379-R383 WeakPolarHBondContact O-CD 3.31Å; Y379-R383 WeakPolarHBondContact O-CG 3.39Å; Y379-A421 HydrophobicContact CD2-CB 4.4Å; Y379-A421 PolarHBondContact N-O 3.35Å; Y379-A421 VanDerWaalsContact N-O 3.13Å; Y379-G490 WeakPolarHBondContact CE2-O 3.36Å
380	D	95.8	Very high	94.9	Very high	100 Å²	100	53.7 Å²	53.7	54%	0.535	25%	0.254	S	S	.	.	H	α-helix	trans	-73.7	-41.7	179.5	-63.1	-46.6	0	0	0	110.7	A377 L378 L382 R383 T384	A377-D380 PolarHBondContact O-N 2.77Å; A377-D380 VanDerWaalsContact O-N 3.12Å; L378-D380 VanDerWaalsContact C-N 3.34Å; L378-D380 PolarHBondContact O-N 2.83Å; D380-L382 PolarHBondContact O-N 2.67Å; D380-R383 PolarHBondContact O-N 3.01Å; D380-R383 VanDerWaalsContact O-N 3.16Å; D380-T384 WeakPolarHBondContact O-CG2 3.4Å
381	F	97.4	Very high	94.7	Very high	6 Å²	6	55.9 Å²	55.9	3%	0.026	27%	0.268	C	S	.	.	H	α-helix	trans	-58.3	-47.1	-179.4	174.7	-111.6	0	0	0	112.6	K375 A377 L378 R383 T384 E386 G387 L390 V426 Y430	K375-F381 HydrophobicContact CB-CD2 4.25Å; K375-F381 HydrophobicContact CD-CD2 4.07Å; K375-F381 HydrophobicContact CD-CE2 3.7Å; K375-F381 HydrophobicContact CD-CZ 4.25Å; A377-F381 WeakPolarHBondContact O-CB 3.23Å; A377-F381 PolarHBondContact O-N 2.74Å; L378-F381 HydrophobicContact CD1-CD1 4.12Å; L378-F381 PolarHBondContact O-N 2.99Å; F381-R383 PolarHBondContact O-N 3.38Å; F381-R383 VanDerWaalsContact O-N 3.08Å; F381-T384 WeakPolarHBondContact O-CB 3.49Å; F381-T384 PolarHBondContact O-N 3.16Å; F381-T384 PolarHBondContact O-OG1 2.94Å; F381-E386 HydrophobicContact CE2-CB 4.16Å; F381-E386 HydrophobicContact CE2-CG 3.92Å; F381-E386 HydrophobicContact CZ-CG 4.19Å; F381-G387 WeakPolarHBondContact O-CA 3.44Å; F381-L390 HydrophobicContact CE1-CD1 3.87Å; F381-V426 HydrophobicContact CB-CG2 4.05Å; F381-V426 HydrophobicContact CD1-CB 4.42Å; F381-V426 HydrophobicContact CD1-CG1 4.06Å; F381-V426 HydrophobicContact CD1-CG2 3.91Å; F381-V426 HydrophobicContact CE1-CG1 4.13Å; F381-V426 HydrophobicContact CG-CB 4.43Å; F381-V426 HydrophobicContact CG-CG1 4.34Å; F381-V426 HydrophobicContact CG-CG2 4.12Å; F381-Y430 HydrophobicContact CE1-CD1 4.35Å; F381-Y430 AromaticContact CZ-CD1 3.76Å; F381-Y430 HydrophobicContact CZ-CD1 3.76Å; F381-Y430 AromaticContact CZ-CE1 3.81Å; F381-Y430 HydrophobicContact CZ-CE1 3.81Å
382	L	96.6	Very high	94.6	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-56.9	-26.6	179.5	-75.3	169.5	0	0	0	113	L378 D380 L390 L395 I486 Y489	L378-L382 HydrophobicContact CD1-CD1 4.1Å; L378-L382 HydrophobicContact CD1-CD2 4.17Å; L378-L382 HydrophobicContact CD1-CG 3.81Å; L378-L382 HydrophobicContact CG-CD1 3.87Å; L378-L382 HydrophobicContact CG-CG 4.09Å; L378-L382 WeakPolarHBondContact O-CB 3.34Å; L378-L382 VanDerWaalsContact O-CG 3.24Å; L378-L382 WeakPolarHBondContact O-CG 3.3Å; L378-L382 PolarHBondContact O-N 3.13Å; D380-L382 PolarHBondContact O-N 2.67Å; L382-L390 HydrophobicContact CD2-CD1 4.1Å; L382-L395 HydrophobicContact CD2-CD2 3.98Å; L382-I486 HydrophobicContact CD1-CG1 4.4Å; L382-Y489 HydrophobicContact CD2-CD1 4.33Å
383	R	96	Very high	94.5	Very high	139 Å²	139	60.8 Å²	60.8	53%	0.525	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-0.8	-177.8	-60	170	63.2	75.3	6.1	113.3	Y379 D380 F381 Y489	Y379-R383 WeakPolarHBondContact O-CD 3.31Å; Y379-R383 WeakPolarHBondContact O-CG 3.39Å; D380-R383 PolarHBondContact O-N 3.01Å; D380-R383 VanDerWaalsContact O-N 3.16Å; F381-R383 PolarHBondContact O-N 3.38Å; F381-R383 VanDerWaalsContact O-N 3.08Å; R383-Y489 WeakPolarHBondContact CG-O 3.49Å
384	T	96.5	Very high	94.4	Very high	58 Å²	58	63.3 Å²	63.3	36%	0.356	31%	0.308	S	S	.	.	S	Bend	trans	-82	165.1	173.8	68.3	0	0	0	0	111.1	D380 F381 E386 G387 H388	D380-T384 WeakPolarHBondContact O-CG2 3.4Å; F381-T384 WeakPolarHBondContact O-CB 3.49Å; F381-T384 PolarHBondContact O-N 3.16Å; F381-T384 PolarHBondContact O-OG1 2.94Å; T384-E386 PolarHBondContact O-N 3.16Å; T384-E386 PolarHBondContact OG1-N 2.84Å; T384-G387 PolarHBondContact O-N 2.98Å; T384-G387 PolarHBondContact OG1-N 2.86Å; T384-H388 PolarHBondContact O-CD2 3.05Å; T384-H388 VanDerWaalsContact O-CD2 3.27Å; T384-H388 PolarHBondContact O-N 2.84Å
385	E	95.8	Very high	94.5	Very high	145 Å²	145	56.7 Å²	56.7	68%	0.678	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-31.7	173	-162.8	-161.4	144.6	0	0	112.3	K389	E385-K389 WeakPolarHBondContact O-CG 3.42Å; E385-K389 WeakPolarHBondContact OE1-CE 3.18Å; E385-K389 IonicContact OE1-NZ 3.47Å; E385-K389 PolarHBondContact OE1-NZ 2.87Å
386	E	95.3	Very high	94.5	Very high	68 Å²	68	54.8 Å²	54.8	32%	0.318	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-44.2	175.4	-171.4	177.2	-158.8	0	0	111.1	K375 F381 T384 H388 K389 Y430	K375-E386 IonicContact NZ-OE1 2.68Å; K375-E386 PolarHBondContact NZ-OE1 3.45Å; K375-E386 IonicContact NZ-OE2 3.64Å; K375-E386 PolarHBondContact NZ-OE2 2.74Å; F381-E386 HydrophobicContact CE2-CB 4.16Å; F381-E386 HydrophobicContact CE2-CG 3.92Å; F381-E386 HydrophobicContact CZ-CG 4.19Å; T384-E386 PolarHBondContact O-N 3.16Å; T384-E386 PolarHBondContact OG1-N 2.84Å; E386-H388 PolarHBondContact O-N 2.88Å; E386-K389 PolarHBondContact O-N 2.79Å; E386-Y430 HydrophobicContact CG-CE1 4.01Å; E386-Y430 VanDerWaalsContact OE1-CZ 3.27Å; E386-Y430 PolarHBondContact OE1-OH 2.81Å
387	G	95.3	Very high	94.5	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-62.5	-40.4	176.4	0	0	0	0	0	113.3	F381 T384 K389 L390 Y489	F381-G387 WeakPolarHBondContact O-CA 3.44Å; T384-G387 PolarHBondContact O-N 2.98Å; T384-G387 PolarHBondContact OG1-N 2.86Å; G387-K389 PolarHBondContact O-N 2.87Å; G387-L390 WeakPolarHBondContact O-CB 3.24Å; G387-L390 VanDerWaalsContact O-CG 3.23Å; G387-L390 WeakPolarHBondContact O-CG 3.38Å; G387-L390 PolarHBondContact O-N 2.85Å; G387-Y489 WeakPolarHBondContact O-CE1 3.41Å
388	H	92.6	Very high	94.6	Very high	85 Å²	85	53.8 Å²	53.8	39%	0.394	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-68.6	-12.1	176.9	-81.8	-67.3	0	0	0	114.3	T384 E386 Y489	T384-H388 PolarHBondContact O-CD2 3.05Å; T384-H388 VanDerWaalsContact O-CD2 3.27Å; T384-H388 PolarHBondContact O-N 2.84Å; E386-H388 PolarHBondContact O-N 2.88Å; H388-Y489 AromaticContact ND1-CG 3.9Å
389	K	93.4	Very high	94.6	Very high	141 Å²	141	53.8 Å²	53.8	61%	0.613	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-88.5	-7.8	175	-72.7	170.2	-172.6	168.7	0	113.3	E385 E386 G387	E385-K389 WeakPolarHBondContact O-CG 3.42Å; E385-K389 WeakPolarHBondContact OE1-CE 3.18Å; E385-K389 IonicContact OE1-NZ 3.47Å; E385-K389 PolarHBondContact OE1-NZ 2.87Å; E386-K389 PolarHBondContact O-N 2.79Å; G387-K389 PolarHBondContact O-N 2.87Å
390	L	92.8	Very high	94.6	Very high	14 Å²	14	50.9 Å²	50.9	7%	0.073	25%	0.25	C	S	.	.			trans	-63.4	136.6	177.2	-62.5	174.2	0	0	0	109.8	F381 L382 G387 D394 L395 I398 Y430 Y489	F381-L390 HydrophobicContact CE1-CD1 3.87Å; L382-L390 HydrophobicContact CD2-CD1 4.1Å; G387-L390 WeakPolarHBondContact O-CB 3.24Å; G387-L390 VanDerWaalsContact O-CG 3.23Å; G387-L390 WeakPolarHBondContact O-CG 3.38Å; G387-L390 PolarHBondContact O-N 2.85Å; L390-D394 HydrophobicContact CB-CB 4.04Å; L390-D394 HydrophobicContact CD2-CB 3.94Å; L390-L395 HydrophobicContact CB-CD2 3.99Å; L390-L395 HydrophobicContact CD1-CD2 3.95Å; L390-I398 HydrophobicContact CD1-CD1 3.9Å; L390-Y430 HydrophobicContact CD2-CD1 4.36Å; L390-Y430 HydrophobicContact CD2-CE1 4.47Å; L390-Y489 HydrophobicContact CB-CE1 4.41Å; L390-Y489 PolarHBondContact O-OH 3.33Å
391	T	91.5	Very high	94.6	Very high	72 Å²	72	46.4 Å²	46.4	44%	0.442	23%	0.226	S	C	.	.			trans	-84.6	167.6	173.1	68.9	0	0	0	0	110.4	D393 D394 L395	T391-D393 PolarHBondContact O-N 3.2Å; T391-D393 PolarHBondContact OG1-N 2.9Å; T391-D394 WeakPolarHBondContact CB-OD2 3.32Å; T391-D394 PolarHBondContact N-OD2 2.88Å; T391-D394 WeakPolarHBondContact O-CB 3.46Å; T391-D394 PolarHBondContact O-N 3.34Å; T391-D394 VanDerWaalsContact O-N 3.07Å; T391-D394 PolarHBondContact OG1-N 3.49Å; T391-D394 PolarHBondContact OG1-OD2 3.26Å; T391-L395 WeakPolarHBondContact O-CG 3.5Å; T391-L395 PolarHBondContact O-N 2.81Å
392	L	91.1	Very high	94.6	Very high	53 Å²	53	46.1 Å²	46.1	28%	0.277	23%	0.225	S	C	.	.	H	α-helix	trans	-55	-36.5	172.8	176.5	67.9	0	0	0	112.4	D394 L395 I396 P523 L526	L392-D394 VanDerWaalsContact C-N 3.34Å; L392-L395 PolarHBondContact O-N 2.77Å; L392-I396 HydrophobicContact CD1-CG1 4.32Å; L392-I396 HydrophobicContact CG-CG1 4.39Å; L392-I396 VanDerWaalsContact O-CG1 3.3Å; L392-I396 WeakPolarHBondContact O-CG1 3.34Å; L392-I396 PolarHBondContact O-N 3.37Å; L392-P523 HydrophobicContact CD1-CG 4.37Å; L392-P523 HydrophobicContact CD2-CG 3.5Å; L392-L526 HydrophobicContact CD1-CD2 4.45Å
393	D	90.1	Very high	94.7	Very high	91 Å²	91	46.1 Å²	46.1	49%	0.487	23%	0.225	S	C	.	.	H	α-helix	trans	-67.2	-36.5	178.9	-168.7	57.2	0	0	0	111.8	R187 T391 I396 D397	R187-D393 IonicContact CZ-OD1 2.69Å; R187-D393 IonicContact NH1-OD1 3.63Å; R187-D393 PolarHBondContact NH1-OD1 3.44Å; R187-D393 IonicContact NH1-OD2 3.73Å; R187-D393 IonicContact NH2-OD1 3.47Å; T391-D393 PolarHBondContact O-N 3.2Å; T391-D393 PolarHBondContact OG1-N 2.9Å; D393-I396 PolarHBondContact O-N 3.28Å; D393-D397 PolarHBondContact O-N 3.04Å
394	D	92.2	Very high	94.7	Very high	65 Å²	65	40.8 Å²	40.8	35%	0.348	21%	0.209	S	C	.	.	H	α-helix	trans	-64.9	-40.6	172.7	-56.7	-59.9	0	0	0	111.3	L390 T391 L392 D397 I398	L390-D394 HydrophobicContact CB-CB 4.04Å; L390-D394 HydrophobicContact CD2-CB 3.94Å; T391-D394 WeakPolarHBondContact CB-OD2 3.32Å; T391-D394 PolarHBondContact N-OD2 2.88Å; T391-D394 WeakPolarHBondContact O-CB 3.46Å; T391-D394 PolarHBondContact O-N 3.34Å; T391-D394 VanDerWaalsContact O-N 3.07Å; T391-D394 PolarHBondContact OG1-N 3.49Å; T391-D394 PolarHBondContact OG1-OD2 3.26Å; L392-D394 VanDerWaalsContact C-N 3.34Å; D394-D397 WeakPolarHBondContact O-CB 3.31Å; D394-D397 PolarHBondContact O-N 3.08Å; D394-I398 WeakPolarHBondContact O-CG1 3.27Å; D394-I398 PolarHBondContact O-N 3.33Å
395	L	95	Very high	94.7	Very high	3 Å²	3	38 Å²	38	2%	0.016	19%	0.192	C	C	.	.	H	α-helix	trans	-65.1	-40.5	176.3	-62.1	-174.4	0	0	0	112	L382 L390 T391 L392 D397 I398 M399 I486 Y489	L382-L395 HydrophobicContact CD2-CD2 3.98Å; L390-L395 HydrophobicContact CB-CD2 3.99Å; L390-L395 HydrophobicContact CD1-CD2 3.95Å; T391-L395 WeakPolarHBondContact O-CG 3.5Å; T391-L395 PolarHBondContact O-N 2.81Å; L392-L395 PolarHBondContact O-N 2.77Å; L395-D397 VanDerWaalsContact C-N 3.33Å; L395-I398 PolarHBondContact O-N 3.06Å; L395-M399 WeakPolarHBondContact O-CG 3.46Å; L395-M399 PolarHBondContact O-N 3Å; L395-I486 HydrophobicContact CB-CG2 3.82Å; L395-I486 HydrophobicContact CD1-CG2 4.42Å; L395-I486 HydrophobicContact CD2-CG2 3.81Å; L395-I486 HydrophobicContact CG-CG2 4.21Å; L395-Y489 HydrophobicContact CD1-CE1 4.32Å; L395-Y489 HydrophobicContact CD1-CE2 4.39Å; L395-Y489 HydrophobicContact CD2-CE1 4.27Å
396	I	94.5	Very high	94.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.4	-39	174.1	-70.9	-66.2	0	0	0	110.8	L392 D393 M399 A400 L526 F551 W554	L392-I396 HydrophobicContact CD1-CG1 4.32Å; L392-I396 HydrophobicContact CG-CG1 4.39Å; L392-I396 VanDerWaalsContact O-CG1 3.3Å; L392-I396 WeakPolarHBondContact O-CG1 3.34Å; L392-I396 PolarHBondContact O-N 3.37Å; D393-I396 PolarHBondContact O-N 3.28Å; I396-M399 HydrophobicContact CD1-SD 4.19Å; I396-M399 WeakPolarHBondContact O-CB 3.19Å; I396-M399 PolarHBondContact O-N 2.98Å; I396-A400 PolarHBondContact O-N 2.78Å; I396-L526 HydrophobicContact CD1-CD1 4.05Å; I396-L526 HydrophobicContact CD1-CD2 4.07Å; I396-F551 HydrophobicContact CD1-CD1 4.1Å; I396-F551 HydrophobicContact CD1-CE1 3.96Å; I396-F551 HydrophobicContact CG2-CD1 4.15Å; I396-W554 HydrophobicContact CD1-CD2 3.99Å; I396-W554 HydrophobicContact CD1-CE3 4.28Å; I396-W554 HydrophobicContact CD1-CH2 4.41Å; I396-W554 HydrophobicContact CD1-CZ2 4.11Å; I396-W554 HydrophobicContact CD1-CZ3 4.47Å; I396-W554 HydrophobicContact CG1-CD2 4.44Å; I396-W554 HydrophobicContact CG1-CG 4.49Å; I396-W554 HydrophobicContact CG2-CB 3.82Å; I396-W554 HydrophobicContact CG2-CD2 4.21Å; I396-W554 HydrophobicContact CG2-CG 3.77Å
397	D	93.7	Very high	94.8	Very high	18 Å²	18	29 Å²	29	10%	0.096	15%	0.152	C	C	.	.	H	α-helix	trans	-62.6	-44.1	173.9	-177.3	71.2	0	0	0	112.1	R187 R191 D393 D394 L395 M399 A400 Q401	R187-D397 WeakPolarHBondContact CD-OD1 3.41Å; R187-D397 VanDerWaalsContact CG-OD1 3.3Å; R187-D397 WeakPolarHBondContact CG-OD1 3.37Å; R191-D397 WeakPolarHBondContact CD-OD2 3.21Å; D393-D397 PolarHBondContact O-N 3.04Å; D394-D397 WeakPolarHBondContact O-CB 3.31Å; D394-D397 PolarHBondContact O-N 3.08Å; L395-D397 VanDerWaalsContact C-N 3.33Å; D397-M399 VanDerWaalsContact C-N 3.29Å; D397-M399 PolarHBondContact O-N 3.08Å; D397-A400 WeakPolarHBondContact O-CB 3.37Å; D397-A400 PolarHBondContact O-N 2.72Å; D397-A400 VanDerWaalsContact O-N 3.12Å; D397-Q401 WeakPolarHBondContact O-CG 3.08Å; D397-Q401 PolarHBondContact O-N 3.22Å; D397-Q401 PolarHBondContact OD2-NE2 2.84Å
398	I	96.7	Very high	94.8	Very high	6 Å²	6	30.4 Å²	30.4	3%	0.031	16%	0.158	C	C	.	.	H	α-helix	trans	-56.5	-44.5	172.8	-72.1	169.3	0	0	0	110.7	L378 L390 D394 L395 Q401 I402 V432 I486	L378-I398 HydrophobicContact CD1-CD1 4.23Å; L378-I398 HydrophobicContact CD1-CG2 4.27Å; L378-I398 HydrophobicContact CD2-CG2 3.77Å; L390-I398 HydrophobicContact CD1-CD1 3.9Å; D394-I398 WeakPolarHBondContact O-CG1 3.27Å; D394-I398 PolarHBondContact O-N 3.33Å; L395-I398 PolarHBondContact O-N 3.06Å; I398-Q401 PolarHBondContact O-N 3.04Å; I398-I402 HydrophobicContact CG2-CD1 3.74Å; I398-I402 WeakPolarHBondContact O-CD1 3.28Å; I398-I402 VanDerWaalsContact O-CG1 3.26Å; I398-I402 WeakPolarHBondContact O-CG1 3.41Å; I398-I402 PolarHBondContact O-N 3.18Å; I398-V432 HydrophobicContact CG1-CG1 4.18Å; I398-V432 HydrophobicContact CG2-CG1 4.2Å; I398-V432 HydrophobicContact CG2-CG2 4.23Å; I398-I486 HydrophobicContact CG2-CD1 4.06Å
399	M	97.8	Very high	94.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.3	-40.7	176.2	-66.6	174.2	-155.5	0	0	112.3	L395 I396 D397 I402 A403 F479 M483 I486 V487 L526 F551	L395-M399 WeakPolarHBondContact O-CG 3.46Å; L395-M399 PolarHBondContact O-N 3Å; I396-M399 HydrophobicContact CD1-SD 4.19Å; I396-M399 WeakPolarHBondContact O-CB 3.19Å; I396-M399 PolarHBondContact O-N 2.98Å; D397-M399 VanDerWaalsContact C-N 3.29Å; D397-M399 PolarHBondContact O-N 3.08Å; M399-I402 PolarHBondContact O-N 3.38Å; M399-A403 VanDerWaalsContact O-CB 3.29Å; M399-A403 WeakPolarHBondContact O-CB 3.4Å; M399-A403 PolarHBondContact O-N 3.31Å; M399-F479 HydrophobicContact CB-CZ 4.43Å; M399-M483 HydrophobicContact CE-CB 4.37Å; M399-M483 HydrophobicContact CG-CG 4.43Å; M399-M483 HydrophobicContact SD-CB 4.24Å; M399-M483 HydrophobicContact SD-CG 3.92Å; M399-I486 HydrophobicContact CE-CB 3.83Å; M399-I486 HydrophobicContact CE-CD1 4.46Å; M399-I486 HydrophobicContact CE-CG2 3.49Å; M399-I486 VanDerWaalsContact CE-CG2 3.49Å; M399-I486 HydrophobicContact CG-CD1 3.78Å; M399-I486 HydrophobicContact CG-CG2 4.46Å; M399-V487 HydrophobicContact CE-CG2 3.6Å; M399-L526 HydrophobicContact CE-CD2 4.19Å; M399-L526 HydrophobicContact SD-CD1 3.9Å; M399-L526 HydrophobicContact SD-CD2 4.49Å; M399-F551 HydrophobicContact CB-CD1 4.11Å; M399-F551 HydrophobicContact CB-CD2 4.21Å; M399-F551 HydrophobicContact CB-CE1 3.94Å; M399-F551 HydrophobicContact CB-CE2 4.09Å; M399-F551 HydrophobicContact CB-CG 4.23Å; M399-F551 HydrophobicContact CB-CZ 3.92Å; M399-F551 HydrophobicContact CG-CZ 4.45Å; M399-F551 HydrophobicContact SD-CE1 3.74Å; M399-F551 HydrophobicContact SD-CZ 3.89Å
400	A	96.2	Very high	94.9	Very high	5 Å²	5	21.4 Å²	21.4	4%	0.041	12%	0.118	C	C	.	.	H	α-helix	trans	-60	-46.8	175.6	0	0	0	0	0	111.3	I396 D397 I402 A403 S404 F551	I396-A400 PolarHBondContact O-N 2.78Å; D397-A400 WeakPolarHBondContact O-CB 3.37Å; D397-A400 PolarHBondContact O-N 2.72Å; D397-A400 VanDerWaalsContact O-N 3.12Å; A400-I402 PolarHBondContact O-N 2.73Å; A400-A403 PolarHBondContact O-N 3.22Å; A400-S404 WeakPolarHBondContact O-CB 3.19Å; A400-S404 PolarHBondContact O-N 3.03Å; A400-F551 HydrophobicContact CB-CB 3.62Å
401	Q	95.9	Very high	94.9	Very high	5 Å²	5	26.5 Å²	26.5	2%	0.023	14%	0.141	C	C	.	.	H	α-helix	trans	-61.5	-43.2	178.5	-71.8	-172.2	64.3	0	0	112.2	R350 D397 I398 S404 G405 S431 V432	R350-Q401 WeakPolarHBondContact CB-O 3.08Å; R350-Q401 VanDerWaalsContact CG-O 3.3Å; R350-Q401 WeakPolarHBondContact CG-O 3.25Å; D397-Q401 WeakPolarHBondContact O-CG 3.08Å; D397-Q401 PolarHBondContact O-N 3.22Å; D397-Q401 PolarHBondContact OD2-NE2 2.84Å; I398-Q401 PolarHBondContact O-N 3.04Å; Q401-S404 WeakPolarHBondContact O-CB 3.47Å; Q401-S404 PolarHBondContact O-N 3.41Å; Q401-G405 PolarHBondContact O-N 2.99Å; Q401-G405 VanDerWaalsContact O-N 3.17Å; Q401-S431 VanDerWaalsContact OE1-CA 3.23Å; Q401-V432 HydrophobicContact CB-CG2 3.39Å; Q401-V432 HydrophobicContact CG-CG2 4.3Å
402	I	98.4	Very high	94.8	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-66.5	-45.2	176.3	-63.6	159.1	0	0	0	110.6	L378 I398 M399 A400 S404 G405 M406 I424 V432 V434 F479 L482 I486	L378-I402 HydrophobicContact CD2-CD1 4.07Å; I398-I402 HydrophobicContact CG2-CD1 3.74Å; I398-I402 WeakPolarHBondContact O-CD1 3.28Å; I398-I402 VanDerWaalsContact O-CG1 3.26Å; I398-I402 WeakPolarHBondContact O-CG1 3.41Å; I398-I402 PolarHBondContact O-N 3.18Å; M399-I402 PolarHBondContact O-N 3.38Å; A400-I402 PolarHBondContact O-N 2.73Å; I402-S404 VanDerWaalsContact C-N 3.27Å; I402-S404 PolarHBondContact O-N 2.84Å; I402-G405 PolarHBondContact O-N 3.22Å; I402-G405 VanDerWaalsContact O-N 3.16Å; I402-M406 HydrophobicContact CG2-CG 4.36Å; I402-M406 WeakPolarHBondContact O-CG 3.45Å; I402-M406 PolarHBondContact O-N 3.18Å; I402-I424 HydrophobicContact CD1-CD1 4.39Å; I402-I424 HydrophobicContact CD1-CG1 3.99Å; I402-I424 HydrophobicContact CD1-CG2 4.08Å; I402-I424 HydrophobicContact CG1-CD1 4.08Å; I402-I424 HydrophobicContact CG1-CG1 4.18Å; I402-I424 HydrophobicContact CG1-CG2 4Å; I402-I424 HydrophobicContact CG2-CD1 3.99Å; I402-V432 HydrophobicContact CD1-CG2 4.49Å; I402-V432 HydrophobicContact CG1-CG2 3.84Å; I402-V434 HydrophobicContact CG2-CG2 4.26Å; I402-F479 HydrophobicContact CB-CE2 3.91Å; I402-F479 HydrophobicContact CG2-CD2 3.87Å; I402-F479 HydrophobicContact CG2-CE2 3.53Å; I402-L482 HydrophobicContact CD1-CD2 4.19Å; I402-L482 HydrophobicContact CG2-CD2 4.07Å; I402-I486 HydrophobicContact CD1-CD1 3.82Å
403	A	98	Very high	94.7	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.8	-39	178	0	0	0	0	0	111.7	M399 A400 M406 S407 F479 L547 C548 F551	M399-A403 VanDerWaalsContact O-CB 3.29Å; M399-A403 WeakPolarHBondContact O-CB 3.4Å; M399-A403 PolarHBondContact O-N 3.31Å; A400-A403 PolarHBondContact O-N 3.22Å; A403-M406 PolarHBondContact O-N 3.36Å; A403-S407 VanDerWaalsContact O-CB 3.32Å; A403-S407 WeakPolarHBondContact O-CB 3.29Å; A403-S407 PolarHBondContact O-N 3.4Å; A403-F479 HydrophobicContact CB-CE1 4.09Å; A403-F479 HydrophobicContact CB-CZ 3.86Å; A403-L547 HydrophobicContact CB-CB 4.41Å; A403-C548 HydrophobicContact CB-CB 4.08Å; A403-F551 HydrophobicContact CB-CD2 4.28Å
404	S	95.8	Very high	94.7	Very high	26 Å²	26	28.7 Å²	28.7	18%	0.182	15%	0.151	C	C	.	.	H	α-helix	trans	-60.2	-47.9	173.6	174.1	0	0	0	0	111.8	H348 A400 Q401 I402 M406 S407 Y408	H348-S404 PolarHBondContact CE1-OG 3.21Å; A400-S404 WeakPolarHBondContact O-CB 3.19Å; A400-S404 PolarHBondContact O-N 3.03Å; Q401-S404 WeakPolarHBondContact O-CB 3.47Å; Q401-S404 PolarHBondContact O-N 3.41Å; I402-S404 VanDerWaalsContact C-N 3.27Å; I402-S404 PolarHBondContact O-N 2.84Å; S404-M406 PolarHBondContact O-N 2.88Å; S404-S407 PolarHBondContact O-N 3.41Å; S404-Y408 PolarHBondContact O-N 3.27Å; S404-Y408 VanDerWaalsContact O-N 3.14Å
405	G	96.1	Very high	94.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.6	-44.2	174.7	0	0	0	0	0	113	I351 Q401 I402 S407 Y408 L409	I351-G405 WeakPolarHBondContact CD1-O 3.26Å; Q401-G405 PolarHBondContact O-N 2.99Å; Q401-G405 VanDerWaalsContact O-N 3.17Å; I402-G405 PolarHBondContact O-N 3.22Å; I402-G405 VanDerWaalsContact O-N 3.16Å; G405-S407 PolarHBondContact O-N 2.73Å; G405-Y408 WeakPolarHBondContact O-CB 3.49Å; G405-Y408 PolarHBondContact O-N 3.12Å; G405-L409 PolarHBondContact O-N 3.14Å; G405-L409 VanDerWaalsContact O-N 3.12Å
406	M	97.6	Very high	94.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-70.5	-30.2	178.7	-70	-58.1	-52.7	0	0	113.3	I402 A403 S404 Y408 L409 E410 H416 L419 V434 I472 D475 F544	I402-M406 HydrophobicContact CG2-CG 4.36Å; I402-M406 WeakPolarHBondContact O-CG 3.45Å; I402-M406 PolarHBondContact O-N 3.18Å; A403-M406 PolarHBondContact O-N 3.36Å; S404-M406 PolarHBondContact O-N 2.88Å; M406-Y408 VanDerWaalsContact C-N 3.29Å; M406-L409 HydrophobicContact CE-CD1 4.28Å; M406-L409 PolarHBondContact O-N 3.5Å; M406-L409 HydrophobicContact SD-CD1 3.85Å; M406-E410 WeakPolarHBondContact O-CB 3.26Å; M406-E410 PolarHBondContact O-N 2.88Å; M406-H416 HydrophobicContact CE-CB 3.91Å; M406-H416 HydrophobicContact SD-CB 4.29Å; M406-L419 HydrophobicContact CE-CD2 4.05Å; M406-L419 HydrophobicContact CG-CD1 4.3Å; M406-L419 HydrophobicContact CG-CD2 3.88Å; M406-L419 HydrophobicContact SD-CD1 3.82Å; M406-L419 HydrophobicContact SD-CD2 3.85Å; M406-L419 HydrophobicContact SD-CG 4.4Å; M406-V434 HydrophobicContact CG-CG2 4.33Å; M406-V434 HydrophobicContact SD-CG1 4.06Å; M406-V434 HydrophobicContact SD-CG2 4.31Å; M406-I472 HydrophobicContact CE-CD1 4.22Å; M406-D475 HydrophobicContact CE-CB 3.82Å; M406-F544 HydrophobicContact CB-CB 4.19Å; M406-F544 HydrophobicContact CB-CD1 3.3Å; M406-F544 HydrophobicContact CB-CD2 3.76Å; M406-F544 HydrophobicContact CB-CE1 3.4Å; M406-F544 HydrophobicContact CB-CE2 3.86Å; M406-F544 HydrophobicContact CB-CG 3.48Å; M406-F544 VanDerWaalsContact CB-CG 3.48Å; M406-F544 HydrophobicContact CB-CZ 3.68Å; M406-F544 HydrophobicContact CE-CD2 4.28Å; M406-F544 HydrophobicContact CE-CE1 4.47Å; M406-F544 HydrophobicContact CE-CE2 3.55Å; M406-F544 HydrophobicContact CE-CZ 3.66Å; M406-F544 HydrophobicContact CG-CD1 4.16Å; M406-F544 HydrophobicContact CG-CE1 3.75Å; M406-F544 HydrophobicContact CG-CE2 4.41Å; M406-F544 HydrophobicContact CG-CZ 3.89Å
407	S	96.6	Very high	94.4	Very high	24 Å²	24	29.7 Å²	29.7	17%	0.168	15%	0.154	C	C	.	.	H	α-helix	trans	-64.2	-37.8	172.2	-174	0	0	0	0	111	A403 S404 G405 E410 E411 R545	A403-S407 VanDerWaalsContact O-CB 3.32Å; A403-S407 WeakPolarHBondContact O-CB 3.29Å; A403-S407 PolarHBondContact O-N 3.4Å; S404-S407 PolarHBondContact O-N 3.41Å; G405-S407 PolarHBondContact O-N 2.73Å; S407-E410 WeakPolarHBondContact O-CB 3.23Å; S407-E410 PolarHBondContact O-N 3.32Å; S407-E411 PolarHBondContact O-N 3.31Å; S407-R545 WeakPolarHBondContact OG-CA 3.31Å
408	Y	94.4	Very high	94.2	Very high	29 Å²	29	29.2 Å²	29.2	11%	0.114	15%	0.151	C	C	.	.	H	α-helix	trans	-65	-43.6	172.6	172.1	-98.4	0	0	0	111.7	F346 H347 H348 I351 S404 G405 M406 E410 E411 M412	F346-Y408 WeakPolarHBondContact CA-OH 3.44Å; F346-Y408 HydrophobicContact CB-CE1 3.94Å; F346-Y408 AromaticContact CD1-CE1 3.8Å; F346-Y408 HydrophobicContact CD1-CE1 3.8Å; F346-Y408 HydrophobicContact CG-CE1 4.13Å; H347-Y408 PolarHBondContact N-OH 3.09Å; H348-Y408 HydrophobicContact CB-CD1 3.62Å; H348-Y408 HydrophobicContact CB-CD2 4.15Å; H348-Y408 HydrophobicContact CB-CE1 3.87Å; H348-Y408 HydrophobicContact CB-CE2 4.37Å; H348-Y408 HydrophobicContact CB-CG 3.75Å; H348-Y408 AromaticContact CD2-CD2 3.79Å; H348-Y408 AromaticContact CD2-CG 3.65Å; H348-Y408 AromaticContact CG-CG 3.72Å; I351-Y408 HydrophobicContact CG1-CD1 3.85Å; I351-Y408 HydrophobicContact CG1-CE1 4.39Å; S404-Y408 PolarHBondContact O-N 3.27Å; S404-Y408 VanDerWaalsContact O-N 3.14Å; G405-Y408 WeakPolarHBondContact O-CB 3.49Å; G405-Y408 PolarHBondContact O-N 3.12Å; M406-Y408 VanDerWaalsContact C-N 3.29Å; Y408-E410 VanDerWaalsContact C-N 3.31Å; Y408-E410 PolarHBondContact O-N 2.91Å; Y408-E411 PolarHBondContact O-N 3.26Å; Y408-M412 HydrophobicContact CD1-CG 4.4Å; Y408-M412 HydrophobicContact CD2-CG 4.35Å; Y408-M412 HydrophobicContact CE1-CG 3.98Å; Y408-M412 HydrophobicContact CE2-CG 3.91Å; Y408-M412 HydrophobicContact CE2-SD 4.24Å; Y408-M412 VanDerWaalsContact O-CG 3.31Å; Y408-M412 WeakPolarHBondContact O-CG 3.29Å; Y408-M412 PolarHBondContact O-N 2.79Å
409	L	93.3	Very high	94.1	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63	-37.4	174.9	-65.6	-178.5	0	0	0	112.3	I351 G405 M406 M412 N413 S414 F437	I351-L409 HydrophobicContact CD1-CD1 4.02Å; I351-L409 HydrophobicContact CD1-CD2 4.16Å; I351-L409 HydrophobicContact CD1-CG 3.87Å; G405-L409 PolarHBondContact O-N 3.14Å; G405-L409 VanDerWaalsContact O-N 3.12Å; M406-L409 HydrophobicContact CE-CD1 4.28Å; M406-L409 PolarHBondContact O-N 3.5Å; M406-L409 HydrophobicContact SD-CD1 3.85Å; L409-M412 CarbonylContact O-C 3.59Å; L409-M412 PolarHBondContact O-N 3.26Å; L409-N413 PolarHBondContact O-N 3Å; L409-S414 PolarHBondContact O-N 3.46Å; L409-F437 HydrophobicContact CD1-CB 4.11Å; L409-F437 HydrophobicContact CD1-CG 4.36Å; L409-F437 HydrophobicContact CD2-CD2 4.5Å
410	E	94.6	Very high	94	Very high	37 Å²	37	31.2 Å²	31.2	17%	0.173	16%	0.158	C	C	.	.	H	α-helix	trans	-59	-47.6	173.3	179.5	170	-124.1	0	0	111.4	M406 S407 Y408 M412 N413 I472 F544 R545	M406-E410 WeakPolarHBondContact O-CB 3.26Å; M406-E410 PolarHBondContact O-N 2.88Å; S407-E410 WeakPolarHBondContact O-CB 3.23Å; S407-E410 PolarHBondContact O-N 3.32Å; Y408-E410 VanDerWaalsContact C-N 3.31Å; Y408-E410 PolarHBondContact O-N 2.91Å; E410-M412 VanDerWaalsContact C-N 3.3Å; E410-M412 PolarHBondContact O-N 3.46Å; E410-N413 PolarHBondContact O-N 3.36Å; E410-I472 HydrophobicContact CB-CD1 3.95Å; E410-I472 HydrophobicContact CB-CG1 3.82Å; E410-I472 HydrophobicContact CG-CG1 3.91Å; E410-F544 PolarHBondContact OE2-N 3.16Å; E410-R545 PolarHBondContact OE2-N 3.37Å
411	E	93.6	Very high	94.1	Very high	121 Å²	121	31 Å²	31	57%	0.565	16%	0.156	S	C	*	.	H	α-helix	trans	-60.7	-39.9	176.4	-174.5	179.5	175.2	0	0	112.1	S407 Y408 N413	S407-E411 PolarHBondContact O-N 3.31Å; Y408-E411 PolarHBondContact O-N 3.26Å; E411-N413 PolarHBondContact O-N 3.17Å; E411-N413 PolarHBondContact O-ND2 2.89Å
412	M	89.8	Confident	93.9	Very high	88 Å²	88	32.2 Å²	32.2	43%	0.433	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	5.2	176.6	-62.6	-56.3	-66.3	0	0	113.8	F346 Y408 L409 E410 S414	F346-M412 HydrophobicContact CD1-CB 4.31Å; F346-M412 HydrophobicContact CD1-CE 4.2Å; F346-M412 HydrophobicContact CD1-CG 4.04Å; F346-M412 HydrophobicContact CE1-CB 3.65Å; F346-M412 HydrophobicContact CE1-CE 3.95Å; F346-M412 HydrophobicContact CE1-CG 3.87Å; F346-M412 HydrophobicContact CZ-CB 4.49Å; Y408-M412 HydrophobicContact CD1-CG 4.4Å; Y408-M412 HydrophobicContact CD2-CG 4.35Å; Y408-M412 HydrophobicContact CE1-CG 3.98Å; Y408-M412 HydrophobicContact CE2-CG 3.91Å; Y408-M412 HydrophobicContact CE2-SD 4.24Å; Y408-M412 VanDerWaalsContact O-CG 3.31Å; Y408-M412 WeakPolarHBondContact O-CG 3.29Å; Y408-M412 PolarHBondContact O-N 2.79Å; L409-M412 CarbonylContact O-C 3.59Å; L409-M412 PolarHBondContact O-N 3.26Å; E410-M412 VanDerWaalsContact C-N 3.3Å; E410-M412 PolarHBondContact O-N 3.46Å; M412-S414 PolarHBondContact O-N 2.91Å
413	N	89.4	Confident	93.7	Very high	152 Å²	152	32.4 Å²	32.4	81%	0.813	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	33.3	-175.5	-63.3	-77.5	0	0	0	113.6	L409 E410 E411	L409-N413 PolarHBondContact O-N 3Å; E410-N413 PolarHBondContact O-N 3.36Å; E411-N413 PolarHBondContact O-N 3.17Å; E411-N413 PolarHBondContact O-ND2 2.89Å
414	S	89.7	Confident	93.7	Very high	23 Å²	23	32.4 Å²	32.4	16%	0.161	17%	0.168	C	C	.	.			trans	-102.8	133.1	-179.1	-168.7	0	0	0	0	110.8	L409 M412	L409-S414 PolarHBondContact O-N 3.46Å; M412-S414 PolarHBondContact O-N 2.91Å
415	V	91	Very high	93.8	Very high	37 Å²	37	32.9 Å²	32.9	22%	0.224	17%	0.169	C	C	.	.			trans	-106	126.4	178.8	-175.1	0	0	0	0	108.9	R417 F470 D475	V415-R417 HydrophobicContact CB-CG 4.38Å; V415-R417 HydrophobicContact CG1-CG 3.75Å; V415-F470 HydrophobicContact CG1-CB 4.39Å; V415-D475 WeakPolarHBondContact CA-OD2 3.21Å; V415-D475 VanDerWaalsContact CG1-OD2 3.31Å; V415-D475 WeakPolarHBondContact CG1-OD2 3.28Å
416	H	92.2	Very high	93.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.169	C	C	.	.			trans	-72.7	-48.1	-176.7	-170.4	-65	0	0	0	112.8	M406 D418 L419 V434 S435 F437 D475	M406-H416 HydrophobicContact CE-CB 3.91Å; M406-H416 HydrophobicContact SD-CB 4.29Å; H416-D418 PolarHBondContact CE1-O 3.43Å; H416-D418 PolarHBondContact ND1-N 3.17Å; H416-D418 PolarHBondContact ND1-O 3.32Å; H416-D418 PolarHBondContact O-N 2.66Å; H416-L419 HydrophobicContact CB-CB 4.45Å; H416-L419 PolarHBondContact ND1-N 2.8Å; H416-L419 VanDerWaalsContact ND1-N 3.18Å; H416-V434 WeakPolarHBondContact CD2-CG1 3.38Å; H416-V434 WeakPolarHBondContact NE2-CG1 3.21Å; H416-S435 PolarHBondContact CE1-O 2.91Å; H416-S435 PolarHBondContact NE2-O 3.43Å; H416-F437 VanDerWaalsContact CD2-CB 3.48Å; H416-F437 WeakPolarHBondContact CD2-CB 3.35Å; H416-D475 PolarHBondContact N-OD2 3.06Å
417	R	91	Very high	93.5	Very high	52 Å²	52	34 Å²	34	20%	0.196	18%	0.175	C	C	.	.	S	Bend	trans	69.5	-21.8	179.1	-49.1	-178.6	177.8	-168.4	-1.5	117.8	V415 A440 F470 D475	V415-R417 HydrophobicContact CB-CG 4.38Å; V415-R417 HydrophobicContact CG1-CG 3.75Å; R417-A440 HydrophobicContact CB-CB 4.09Å; R417-F470 HydrophobicContact CB-CD1 3.91Å; R417-F470 HydrophobicContact CB-CE1 4.21Å; R417-F470 HydrophobicContact CG-CB 4.18Å; R417-F470 HydrophobicContact CG-CD1 3.81Å; R417-F470 HydrophobicContact CG-CG 4.17Å; R417-D475 PolarHBondContact N-OD1 3.28Å
418	D	89.9	Confident	93.2	Very high	7 Å²	7	38.4 Å²	38.4	4%	0.037	19%	0.193	C	C	.	.			trans	-128.4	47.5	175.1	-170.2	15	0	0	0	112.3	H416 R420 N423 P456	H416-D418 PolarHBondContact CE1-O 3.43Å; H416-D418 PolarHBondContact ND1-N 3.17Å; H416-D418 PolarHBondContact ND1-O 3.32Å; H416-D418 PolarHBondContact O-N 2.66Å; D418-R420 PolarHBondContact O-N 3.48Å; D418-R420 WeakPolarHBondContact OD1-CD 3.46Å; D418-R420 IonicContact OD1-CZ 2.81Å; D418-R420 IonicContact OD1-NE 3.58Å; D418-R420 PolarHBondContact OD1-NE 3.4Å; D418-R420 IonicContact OD1-NH2 2.75Å; D418-R420 IonicContact OD2-CZ 3.63Å; D418-R420 IonicContact OD2-NE 2.72Å; D418-R420 PolarHBondContact OD2-NE 2.98Å; D418-R420 IonicContact OD2-NH2 2.66Å; D418-R420 PolarHBondContact OD2-NH2 3.42Å; D418-N423 PolarHBondContact O-ND2 3.02Å; D418-N423 PolarHBondContact OD2-ND2 3.47Å; D418-P456 HydrophobicContact CB-CG 4.47Å; D418-P456 WeakPolarHBondContact OD1-CB 3.45Å; D418-P456 WeakPolarHBondContact OD1-CG 3.34Å
419	L	95.3	Very high	92.8	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	20%	0.195	C	C	.	.			trans	-80.1	113.3	-177.3	-177	66.9	0	0	0	110.7	M406 H416 I424 V434 S478 F479 L482 F544	M406-L419 HydrophobicContact CE-CD2 4.05Å; M406-L419 HydrophobicContact CG-CD1 4.3Å; M406-L419 HydrophobicContact CG-CD2 3.88Å; M406-L419 HydrophobicContact SD-CD1 3.82Å; M406-L419 HydrophobicContact SD-CD2 3.85Å; M406-L419 HydrophobicContact SD-CG 4.4Å; H416-L419 HydrophobicContact CB-CB 4.45Å; H416-L419 PolarHBondContact ND1-N 2.8Å; H416-L419 VanDerWaalsContact ND1-N 3.18Å; L419-I424 HydrophobicContact CD1-CD1 3.9Å; L419-V434 HydrophobicContact CD1-CG1 4.15Å; L419-S478 WeakPolarHBondContact O-CB 3.41Å; L419-F479 HydrophobicContact CD2-CB 3.78Å; L419-F479 HydrophobicContact CD2-CD2 4.29Å; L419-F479 HydrophobicContact CD2-CG 4.43Å; L419-L482 HydrophobicContact CD1-CD2 4.12Å; L419-L482 HydrophobicContact CG-CD2 4.06Å; L419-F544 HydrophobicContact CD2-CE1 4.48Å; L419-F544 HydrophobicContact CD2-CZ 4.11Å
420	R	95.7	Very high	92.6	Very high	47 Å²	47	42.9 Å²	42.9	18%	0.177	21%	0.212	C	C	.	.	S	Bend	trans	-162.3	168.3	-179.1	56	-179.5	168	94.6	19	111.3	D418 A422 N423 I424 W459	D418-R420 PolarHBondContact O-N 3.48Å; D418-R420 WeakPolarHBondContact OD1-CD 3.46Å; D418-R420 IonicContact OD1-CZ 2.81Å; D418-R420 IonicContact OD1-NE 3.58Å; D418-R420 PolarHBondContact OD1-NE 3.4Å; D418-R420 IonicContact OD1-NH2 2.75Å; D418-R420 IonicContact OD2-CZ 3.63Å; D418-R420 IonicContact OD2-NE 2.72Å; D418-R420 PolarHBondContact OD2-NE 2.98Å; D418-R420 IonicContact OD2-NH2 2.66Å; D418-R420 PolarHBondContact OD2-NH2 3.42Å; R420-A422 HydrophobicContact CG-CB 4.42Å; R420-A422 PolarHBondContact O-N 2.93Å; R420-A422 VanDerWaalsContact O-N 3.14Å; R420-N423 HydrophobicContact CG-CB 4.44Å; R420-N423 PolarHBondContact NH2-OD1 3.13Å; R420-N423 PolarHBondContact O-N 3.36Å; R420-I424 PolarHBondContact O-N 3.29Å; R420-W459 VanDerWaalsContact CB-CD1 3.45Å; R420-W459 HydrophobicContact CB-CD2 4.11Å; R420-W459 HydrophobicContact CB-CG 3.9Å
421	A	96.9	Very high	92.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-61.8	-29.7	-173.1	0	0	0	0	0	113	L378 Y379 N423 I424 L482 E485	L378-A421 WeakPolarHBondContact CB-O 3.31Å; L378-A421 PolarHBondContact N-O 3.49Å; Y379-A421 HydrophobicContact CD2-CB 4.4Å; Y379-A421 PolarHBondContact N-O 3.35Å; Y379-A421 VanDerWaalsContact N-O 3.13Å; A421-N423 PolarHBondContact O-N 3.25Å; A421-I424 PolarHBondContact O-N 3.03Å; A421-L482 VanDerWaalsContact CA-CD1 3.45Å; A421-L482 HydrophobicContact CB-CD1 3.6Å; A421-L482 VanDerWaalsContact N-CD1 3.28Å; A421-E485 HydrophobicContact CB-CB 4.1Å; A421-E485 HydrophobicContact CB-CG 4.49Å; A421-E485 WeakPolarHBondContact CB-OE1 3.47Å; A421-E485 PolarHBondContact N-OE2 3.28Å
422	A	93.5	Very high	92.6	Very high	31 Å²	31	35.4 Å²	35.4	26%	0.256	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-69.3	-19.3	176	0	0	0	0	0	113.9	R420	R420-A422 HydrophobicContact CG-CB 4.42Å; R420-A422 PolarHBondContact O-N 2.93Å; R420-A422 VanDerWaalsContact O-N 3.14Å
423	N	94.3	Very high	92.9	Very high	6 Å²	6	31.3 Å²	31.3	3%	0.032	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-106.2	9.8	177.4	-69.5	-5.9	0	0	0	112.1	D418 R420 A421 S435 D436	D418-N423 PolarHBondContact O-ND2 3.02Å; D418-N423 PolarHBondContact OD2-ND2 3.47Å; R420-N423 HydrophobicContact CG-CB 4.44Å; R420-N423 PolarHBondContact NH2-OD1 3.13Å; R420-N423 PolarHBondContact O-N 3.36Å; A421-N423 PolarHBondContact O-N 3.25Å; N423-S435 VanDerWaalsContact C-OG 3.26Å; N423-S435 WeakPolarHBondContact O-CA 3.29Å; N423-S435 WeakPolarHBondContact O-CB 3.4Å; N423-S435 PolarHBondContact O-N 3.39Å; N423-S435 PolarHBondContact O-OG 3.07Å; N423-D436 HydrophobicContact CB-CB 4.45Å
424	I	97.6	Very high	93.3	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	130.5	163.6	-54.5	-53.2	0	0	0	107.2	A377 L378 I402 L419 R420 A421 V432 K433 V434 L482	A377-I424 CarbonylContact C-O 3.58Å; A377-I424 WeakPolarHBondContact CA-O 3.32Å; L378-I424 HydrophobicContact CB-CB 3.82Å; L378-I424 HydrophobicContact CB-CG2 4.01Å; L378-I424 WeakPolarHBondContact CB-O 3.41Å; L378-I424 HydrophobicContact CD2-CB 3.94Å; L378-I424 HydrophobicContact CD2-CG1 4.36Å; L378-I424 HydrophobicContact CD2-CG2 3.83Å; L378-I424 PolarHBondContact N-O 3.02Å; I402-I424 HydrophobicContact CD1-CD1 4.39Å; I402-I424 HydrophobicContact CD1-CG1 3.99Å; I402-I424 HydrophobicContact CD1-CG2 4.08Å; I402-I424 HydrophobicContact CG1-CD1 4.08Å; I402-I424 HydrophobicContact CG1-CG1 4.18Å; I402-I424 HydrophobicContact CG1-CG2 4Å; I402-I424 HydrophobicContact CG2-CD1 3.99Å; L419-I424 HydrophobicContact CD1-CD1 3.9Å; R420-I424 PolarHBondContact O-N 3.29Å; A421-I424 PolarHBondContact O-N 3.03Å; I424-V432 HydrophobicContact CG2-CB 3.73Å; I424-V432 HydrophobicContact CG2-CG1 4.32Å; I424-V432 HydrophobicContact CG2-CG2 4.33Å; I424-K433 WeakPolarHBondContact CA-O 3.33Å; I424-V434 HydrophobicContact CD1-CB 4.26Å; I424-V434 HydrophobicContact CD1-CG1 4.34Å; I424-V434 HydrophobicContact CD1-CG2 3.92Å; I424-L482 HydrophobicContact CD1-CD2 4.16Å; I424-L482 HydrophobicContact CG1-CD2 3.84Å
425	L	96.7	Very high	93.4	Very high	35 Å²	35	23.3 Å²	23.3	18%	0.183	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	144.5	177.4	-60.1	-174	0	0	0	110.7	V352 M373 G376 A377 V432 K433	V352-L425 HydrophobicContact CG2-CB 4.44Å; V352-L425 HydrophobicContact CG2-CD1 3.99Å; V352-L425 HydrophobicContact CG2-CG 4.41Å; M373-L425 HydrophobicContact CB-CB 3.6Å; M373-L425 HydrophobicContact CB-CD1 4.01Å; M373-L425 HydrophobicContact CB-CG 4.4Å; M373-L425 HydrophobicContact CE-CB 4.08Å; M373-L425 VanDerWaalsContact CE-O 3.28Å; M373-L425 WeakPolarHBondContact CE-O 3.47Å; M373-L425 HydrophobicContact CG-CB 3.55Å; M373-L425 HydrophobicContact CG-CD1 3.73Å; M373-L425 HydrophobicContact CG-CG 4.3Å; G376-L425 CarbonylContact O-C 3.59Å; G376-L425 WeakPolarHBondContact O-CA 3.48Å; A377-L425 HydrophobicContact CB-CD2 4.31Å; L425-V432 CarbonylContact O-C 3.55Å; L425-V432 VanDerWaalsContact O-CA 3.24Å; L425-V432 WeakPolarHBondContact O-CA 3.41Å; L425-K433 PolarHBondContact N-O 3.36Å; L425-K433 PolarHBondContact O-N 2.91Å
426	V	96.6	Very high	93.1	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.006	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	134.5	-177.7	-168.3	0	0	0	0	109.4	M373 K375 G376 L378 F381 S431 V432	M373-V426 CarbonylContact C-O 3.53Å; K375-V426 WeakPolarHBondContact CA-O 3.34Å; K375-V426 HydrophobicContact CB-CB 3.87Å; K375-V426 HydrophobicContact CB-CG1 4.02Å; K375-V426 WeakPolarHBondContact CB-O 3.44Å; K375-V426 HydrophobicContact CD-CG1 3.97Å; K375-V426 PolarHBondContact N-O 3.12Å; G376-V426 PolarHBondContact N-O 3.5Å; G376-V426 PolarHBondContact O-N 3.18Å; L378-V426 HydrophobicContact CB-CG2 3.84Å; L378-V426 HydrophobicContact CD1-CG2 3.74Å; L378-V426 HydrophobicContact CG-CG2 4.42Å; F381-V426 HydrophobicContact CB-CG2 4.05Å; F381-V426 HydrophobicContact CD1-CB 4.42Å; F381-V426 HydrophobicContact CD1-CG1 4.06Å; F381-V426 HydrophobicContact CD1-CG2 3.91Å; F381-V426 HydrophobicContact CE1-CG1 4.13Å; F381-V426 HydrophobicContact CG-CB 4.43Å; F381-V426 HydrophobicContact CG-CG1 4.34Å; F381-V426 HydrophobicContact CG-CG2 4.12Å; V426-S431 WeakPolarHBondContact CA-O 3.41Å; V426-V432 HydrophobicContact CG1-CG1 4.36Å; V426-V432 HydrophobicContact CG2-CG1 4.06Å
427	D	92.3	Very high	92.4	Very high	24 Å²	24	23.5 Å²	23.5	13%	0.128	11%	0.113	C	C	.	.			trans	-103.7	174.8	175.5	-156.2	9.7	0	0	0	112.7	M373 R374 K375 D429 Y430 S431	M373-D427 HydrophobicContact CE-CB 3.71Å; M373-D427 HydrophobicContact SD-CB 4.12Å; R374-D427 PolarHBondContact N-OD1 2.91Å; R374-D427 VanDerWaalsContact N-OD1 3.13Å; K375-D427 WeakPolarHBondContact CD-O 3.39Å; D427-D429 PolarHBondContact O-N 3.16Å; D427-Y430 PolarHBondContact O-N 3.28Å; D427-S431 PolarHBondContact N-O 2.89Å
428	Q	88.6	Confident	91.2	Very high	116 Å²	116	21.8 Å²	21.8	54%	0.542	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-32.6	-174.8	-170.7	62.7	37.6	0	0	113.8	R374 Y430	R374-Q428 HydrophobicContact CB-CB 4.38Å; Q428-Y430 VanDerWaalsContact C-N 3.25Å; Q428-Y430 PolarHBondContact O-N 3.38Å
429	D	85.8	Confident	90	Very high	29 Å²	29	22 Å²	22	16%	0.155	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	14.3	179.3	78.2	-34.6	0	0	0	113	R191 D427 S431	R191-D429 IonicContact CZ-OD2 3.05Å; R191-D429 PolarHBondContact NH1-O 2.9Å; R191-D429 IonicContact NH1-OD2 3.12Å; R191-D429 PolarHBondContact NH1-OD2 2.81Å; R191-D429 IonicContact NH2-OD2 2.94Å; R191-D429 PolarHBondContact NH2-OD2 3.26Å; D427-D429 PolarHBondContact O-N 3.16Å; D429-S431 PolarHBondContact O-N 3.01Å; D429-S431 WeakPolarHBondContact OD1-CB 3.26Å; D429-S431 PolarHBondContact OD1-N 3.36Å; D429-S431 VanDerWaalsContact OD1-N 3.07Å; D429-S431 PolarHBondContact OD1-OG 2.95Å
430	Y	89.8	Confident	88.2	Confident	94 Å²	94	23.2 Å²	23.2	37%	0.369	12%	0.122	S	C	.	.	S	Bend	trans	63.9	11.7	-174.6	-54.1	-100	0	0	0	114.1	F381 E386 L390 D427 Q428	F381-Y430 HydrophobicContact CE1-CD1 4.35Å; F381-Y430 AromaticContact CZ-CD1 3.76Å; F381-Y430 HydrophobicContact CZ-CD1 3.76Å; F381-Y430 AromaticContact CZ-CE1 3.81Å; F381-Y430 HydrophobicContact CZ-CE1 3.81Å; E386-Y430 HydrophobicContact CG-CE1 4.01Å; E386-Y430 VanDerWaalsContact OE1-CZ 3.27Å; E386-Y430 PolarHBondContact OE1-OH 2.81Å; L390-Y430 HydrophobicContact CD2-CD1 4.36Å; L390-Y430 HydrophobicContact CD2-CE1 4.47Å; D427-Y430 PolarHBondContact O-N 3.28Å; Q428-Y430 VanDerWaalsContact C-N 3.25Å; Q428-Y430 PolarHBondContact O-N 3.38Å
431	S	92	Very high	86.4	Confident	1 Å²	1	26 Å²	26	1%	0.007	14%	0.136	C	C	.	.			trans	-68.9	147.5	167.8	65.9	0	0	0	0	110.8	Q401 V426 D427 D429	Q401-S431 VanDerWaalsContact OE1-CA 3.23Å; V426-S431 WeakPolarHBondContact CA-O 3.41Å; D427-S431 PolarHBondContact N-O 2.89Å; D429-S431 PolarHBondContact O-N 3.01Å; D429-S431 WeakPolarHBondContact OD1-CB 3.26Å; D429-S431 PolarHBondContact OD1-N 3.36Å; D429-S431 VanDerWaalsContact OD1-N 3.07Å; D429-S431 PolarHBondContact OD1-OG 2.95Å
432	V	96.9	Very high	84.4	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	146	178.5	-59.1	0	0	0	0	111.5	R350 I398 Q401 I402 I424 L425 V426	R350-V432 WeakPolarHBondContact CD-O 3.32Å; I398-V432 HydrophobicContact CG1-CG1 4.18Å; I398-V432 HydrophobicContact CG2-CG1 4.2Å; I398-V432 HydrophobicContact CG2-CG2 4.23Å; Q401-V432 HydrophobicContact CB-CG2 3.39Å; Q401-V432 HydrophobicContact CG-CG2 4.3Å; I402-V432 HydrophobicContact CD1-CG2 4.49Å; I402-V432 HydrophobicContact CG1-CG2 3.84Å; I424-V432 HydrophobicContact CG2-CB 3.73Å; I424-V432 HydrophobicContact CG2-CG1 4.32Å; I424-V432 HydrophobicContact CG2-CG2 4.33Å; L425-V432 CarbonylContact O-C 3.55Å; L425-V432 VanDerWaalsContact O-CA 3.24Å; L425-V432 WeakPolarHBondContact O-CA 3.41Å; V426-V432 HydrophobicContact CG1-CG1 4.36Å; V426-V432 HydrophobicContact CG2-CG1 4.06Å
433	K	96.4	Very high	82.3	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.009	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	140	177.8	-59.3	-170.5	-179.2	-170.9	0	111.1	Y281 P349 R350 V352 E371 M373 I424 L425	Y281-K433 PolarHBondContact OH-NZ 2.76Å; P349-K433 WeakPolarHBondContact O-CE 3.21Å; R350-K433 CarbonylContact O-C 3.51Å; R350-K433 WeakPolarHBondContact O-CA 3.05Å; V352-K433 HydrophobicContact CG2-CB 3.57Å; V352-K433 HydrophobicContact CG2-CD 4.42Å; E371-K433 WeakPolarHBondContact OE1-CD 3.17Å; E371-K433 IonicContact OE1-NZ 3.66Å; E371-K433 PolarHBondContact OE1-NZ 3.09Å; E371-K433 IonicContact OE2-NZ 2.9Å; E371-K433 PolarHBondContact OE2-NZ 2.71Å; M373-K433 HydrophobicContact CE-CB 3.87Å; M373-K433 HydrophobicContact CE-CD 3.93Å; M373-K433 HydrophobicContact CE-CG 3.64Å; M373-K433 HydrophobicContact SD-CD 3.83Å; M373-K433 HydrophobicContact SD-CG 4.24Å; I424-K433 WeakPolarHBondContact CA-O 3.33Å; L425-K433 PolarHBondContact N-O 3.36Å; L425-K433 PolarHBondContact O-N 2.91Å
434	V	96.3	Very high	80.1	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	131	172.4	-174.9	0	0	0	0	108.9	R350 I351 V352 I402 M406 H416 L419 I424	R350-V434 PolarHBondContact O-N 3.28Å; I351-V434 HydrophobicContact CD1-CB 3.78Å; I351-V434 HydrophobicContact CD1-CG1 4.47Å; I351-V434 HydrophobicContact CD1-CG2 4.21Å; V352-V434 WeakPolarHBondContact CG2-O 3.47Å; V352-V434 PolarHBondContact N-O 3.25Å; I402-V434 HydrophobicContact CG2-CG2 4.26Å; M406-V434 HydrophobicContact CG-CG2 4.33Å; M406-V434 HydrophobicContact SD-CG1 4.06Å; M406-V434 HydrophobicContact SD-CG2 4.31Å; H416-V434 WeakPolarHBondContact CD2-CG1 3.38Å; H416-V434 WeakPolarHBondContact NE2-CG1 3.21Å; L419-V434 HydrophobicContact CD1-CG1 4.15Å; I424-V434 HydrophobicContact CD1-CB 4.26Å; I424-V434 HydrophobicContact CD1-CG1 4.34Å; I424-V434 HydrophobicContact CD1-CG2 3.92Å
435	S	92.5	Very high	77.7	Confident	6 Å²	6	35.9 Å²	35.9	4%	0.042	19%	0.189	C	C	.	.			trans	-127.3	169.5	-177.9	75.2	0	0	0	0	111	H416 N423 F437	H416-S435 PolarHBondContact CE1-O 2.91Å; H416-S435 PolarHBondContact NE2-O 3.43Å; N423-S435 VanDerWaalsContact C-OG 3.26Å; N423-S435 WeakPolarHBondContact O-CA 3.29Å; N423-S435 WeakPolarHBondContact O-CB 3.4Å; N423-S435 PolarHBondContact O-N 3.39Å; N423-S435 PolarHBondContact O-OG 3.07Å; S435-F437 PolarHBondContact O-N 3.45Å
436	D	84.9	Confident	75.4	Confident	39 Å²	39	38.5 Å²	38.5	21%	0.209	20%	0.203	C	C	.	.	S	Bend	trans	59	17	174.4	-73.7	-15.5	0	0	0	115.7	K325 N423 L439	K325-D436 IonicContact NZ-OD1 2.91Å; K325-D436 PolarHBondContact NZ-OD1 3.42Å; K325-D436 IonicContact NZ-OD2 2.77Å; K325-D436 PolarHBondContact NZ-OD2 3.21Å; N423-D436 HydrophobicContact CB-CB 4.45Å; D436-L439 HydrophobicContact CB-CD1 4.35Å; D436-L439 WeakPolarHBondContact OD1-CD1 3.49Å
437	F	78	Confident	72.8	Confident	3 Å²	3	43.6 Å²	43.6	1%	0.013	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	147.8	169.4	57.3	-88.8	0	0	0	110.5	M343 F346 I351 L409 H416 S435 L439	M343-F437 HydrophobicContact CB-CE2 3.99Å; M343-F437 HydrophobicContact CE-CD2 4.17Å; M343-F437 HydrophobicContact CE-CE2 3.8Å; M343-F437 HydrophobicContact CE-CZ 4.06Å; M343-F437 WeakPolarHBondContact CE-O 3.5Å; M343-F437 HydrophobicContact CG-CD2 4.21Å; M343-F437 HydrophobicContact CG-CE2 3.77Å; M343-F437 VanDerWaalsContact SD-O 3.37Å; F346-F437 HydrophobicContact CD2-CD2 4.13Å; F346-F437 AromaticContact CD2-CE2 3.46Å; F346-F437 HydrophobicContact CD2-CE2 3.46Å; F346-F437 VanDerWaalsContact CD2-CE2 3.46Å; F346-F437 HydrophobicContact CD2-CZ 4.22Å; F346-F437 HydrophobicContact CE2-CD2 4.19Å; F346-F437 AromaticContact CE2-CE2 3.93Å; F346-F437 HydrophobicContact CE2-CE2 3.93Å; I351-F437 HydrophobicContact CG2-CD1 4.08Å; I351-F437 HydrophobicContact CG2-CE1 3.22Å; I351-F437 HydrophobicContact CG2-CE2 4.37Å; I351-F437 HydrophobicContact CG2-CZ 3.38Å; L409-F437 HydrophobicContact CD1-CB 4.11Å; L409-F437 HydrophobicContact CD1-CG 4.36Å; L409-F437 HydrophobicContact CD2-CD2 4.5Å; H416-F437 VanDerWaalsContact CD2-CB 3.48Å; H416-F437 WeakPolarHBondContact CD2-CB 3.35Å; S435-F437 PolarHBondContact O-N 3.45Å; F437-L439 PolarHBondContact O-N 2.81Å
438	G	66.4	Low	70.4	Confident	16 Å²	16	50.7 Å²	50.7	17%	0.165	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	-37.8	179.1	0	0	0	0	0	114.7	E339 A440 K441	E339-G438 VanDerWaalsContact OE2-O 3.14Å; G438-A440 PolarHBondContact O-N 3.18Å; G438-A440 VanDerWaalsContact O-N 3.1Å; G438-K441 VanDerWaalsContact O-CB 3.29Å; G438-K441 WeakPolarHBondContact O-CB 3.49Å; G438-K441 PolarHBondContact O-N 3.07Å
439	L	64.2	Low	68.3	Low	12 Å²	12	46.9 Å²	46.9	6%	0.063	26%	0.26	C	S	.	.	H	α-helix	trans	-57.8	-32.3	-176.5	-64.2	179.8	0	0	0	113.9	M343 I368 D436 F437 K441 I442 I443	M343-L439 HydrophobicContact CE-CD2 4.29Å; M343-L439 HydrophobicContact CE-CG 4.13Å; M343-L439 HydrophobicContact SD-CD2 3.82Å; M343-L439 HydrophobicContact SD-CG 4.12Å; I368-L439 HydrophobicContact CD1-CD1 4.03Å; I368-L439 HydrophobicContact CD1-CD2 3.82Å; D436-L439 HydrophobicContact CB-CD1 4.35Å; D436-L439 WeakPolarHBondContact OD1-CD1 3.49Å; F437-L439 PolarHBondContact O-N 2.81Å; L439-K441 PolarHBondContact O-N 2.82Å; L439-I442 HydrophobicContact CD2-CD1 4.23Å; L439-I442 PolarHBondContact O-N 3.05Å; L439-I443 VanDerWaalsContact O-CD1 3.31Å; L439-I443 WeakPolarHBondContact O-CD1 3.41Å; L439-I443 WeakPolarHBondContact O-CG1 3.4Å
440	A	57.4	Low	66.6	Low	25 Å²	25	49.4 Å²	49.4	21%	0.207	27%	0.273	C	S	.	.	H	α-helix	trans	-61	-26.4	176.7	0	0	0	0	0	113.3	R417 G438 I443 S444	R417-A440 HydrophobicContact CB-CB 4.09Å; G438-A440 PolarHBondContact O-N 3.18Å; G438-A440 VanDerWaalsContact O-N 3.1Å; A440-I443 PolarHBondContact O-N 3.32Å; A440-S444 PolarHBondContact O-N 3.06Å
441	K	58.4	Low	64.6	Low	106 Å²	106	49.2 Å²	49.2	46%	0.461	28%	0.284	S	S	.	.	H	α-helix	trans	-71.5	-40.9	179.9	-169.7	178.5	175.6	-164.5	0	111.6	E339 G438 L439 I443 S444	E339-K441 WeakPolarHBondContact OE1-CD 3.39Å; E339-K441 WeakPolarHBondContact OE1-CG 3.44Å; G438-K441 VanDerWaalsContact O-CB 3.29Å; G438-K441 WeakPolarHBondContact O-CB 3.49Å; G438-K441 PolarHBondContact O-N 3.07Å; L439-K441 PolarHBondContact O-N 2.82Å; K441-I443 PolarHBondContact O-N 3.05Å; K441-S444 PolarHBondContact O-N 3.3Å; K441-S444 PolarHBondContact O-OG 3.01Å
442	I	53.9	Low	62.6	Low	28 Å²	28	53.8 Å²	53.8	14%	0.144	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-33.6	173.3	-44.9	-180	0	0	0	111.6	T331 F336 E339 L439	T331-I442 HydrophobicContact CG2-CG2 4.39Å; F336-I442 HydrophobicContact CD2-CD1 3.9Å; E339-I442 HydrophobicContact CB-CD1 3.95Å; E339-I442 HydrophobicContact CB-CG1 4.14Å; E339-I442 HydrophobicContact CG-CD1 4.45Å; E339-I442 HydrophobicContact CG-CG1 4.12Å; E339-I442 WeakPolarHBondContact OE2-CG1 3.29Å; L439-I442 HydrophobicContact CD2-CD1 4.23Å; L439-I442 PolarHBondContact O-N 3.05Å
443	I	49.2	Very low	60.4	Low	34 Å²	34	58.7 Å²	58.7	17%	0.174	34%	0.338	C	S	.	.	H	α-helix	trans	-82.5	-26.2	-172.9	-62.6	154.9	0	0	0	111.9	F308 L439 A440 K441 D445 D446	F308-I443 HydrophobicContact CD1-CD1 3.27Å; F308-I443 HydrophobicContact CD1-CG1 4.34Å; F308-I443 HydrophobicContact CE1-CD1 3.22Å; F308-I443 HydrophobicContact CE1-CG1 4.39Å; F308-I443 HydrophobicContact CG-CD1 4.05Å; F308-I443 HydrophobicContact CZ-CD1 3.91Å; L439-I443 VanDerWaalsContact O-CD1 3.31Å; L439-I443 WeakPolarHBondContact O-CD1 3.41Å; L439-I443 WeakPolarHBondContact O-CG1 3.4Å; A440-I443 PolarHBondContact O-N 3.32Å; K441-I443 PolarHBondContact O-N 3.05Å; I443-D445 PolarHBondContact O-N 3.49Å; I443-D445 VanDerWaalsContact O-N 3.09Å; I443-D446 PolarHBondContact O-N 2.81Å
444	S	48.2	Very low	58.6	Low	76 Å²	76	62.7 Å²	62.7	53%	0.531	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-6.9	-172.6	54.4	0	0	0	0	116	A440 K441	A440-S444 PolarHBondContact O-N 3.06Å; K441-S444 PolarHBondContact O-N 3.3Å; K441-S444 PolarHBondContact O-OG 3.01Å
445	D	46.9	Very low	57.4	Low	106 Å²	106	65.8 Å²	65.8	57%	0.567	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	2.4	177.3	-91.5	2.1	0	0	0	114	R335 I443 S447	R335-D445 IonicContact CZ-OD2 2.95Å; R335-D445 IonicContact NH1-OD2 2.96Å; R335-D445 PolarHBondContact NH1-OD2 3.04Å; R335-D445 IonicContact NH2-OD2 2.68Å; R335-D445 PolarHBondContact NH2-OD2 3.45Å; I443-D445 PolarHBondContact O-N 3.49Å; I443-D445 VanDerWaalsContact O-N 3.09Å; D445-S447 VanDerWaalsContact C-N 3.34Å; D445-S447 PolarHBondContact O-N 2.99Å
446	D	48.2	Very low	57	Low	90 Å²	90	66.5 Å²	66.5	48%	0.481	37%	0.374	S	S	.	.			trans	-77.9	86.1	175.1	-129.3	-3.2	0	0	0	110.3	I443 H448 A449	I443-D446 PolarHBondContact O-N 2.81Å; D446-H448 PolarHBondContact O-N 2.88Å; D446-A449 HydrophobicContact CB-CB 4.37Å; D446-A449 PolarHBondContact O-N 3.12Å
447	S	42.5	Very low	57.2	Low	108 Å²	108	65.5 Å²	65.5	76%	0.755	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-6	179.4	55.4	0	0	0	0	115.5	D445	D445-S447 VanDerWaalsContact C-N 3.34Å; D445-S447 PolarHBondContact O-N 2.99Å
448	H	41.8	Very low	58	Low	173 Å²	173	66.7 Å²	66.7	80%	0.801	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111	-4.2	179.9	-64.3	-49.3	0	0	0	115	D446	D446-H448 PolarHBondContact O-N 2.88Å
449	A	44.8	Very low	59.3	Low	37 Å²	37	67.9 Å²	67.9	31%	0.306	37%	0.373	S	S	.	.	S	Bend	trans	-77.6	126.5	175.8	0	0	0	0	0	110.4	D446 P451	D446-A449 HydrophobicContact CB-CB 4.37Å; D446-A449 PolarHBondContact O-N 3.12Å; A449-P451 VanDerWaalsContact O-CD 3.23Å; A449-P451 WeakPolarHBondContact O-CD 3.38Å; A449-P451 VanDerWaalsContact O-N 3.08Å
450	D	49.4	Very low	60.7	Low	82 Å²	82	67.9 Å²	67.9	44%	0.439	37%	0.373	S	S	.	.			trans	-58	114.8	171.4	176.3	1.7	0	0	0	108.6	N452 T453	D450-N452 PolarHBondContact O-N 3.5Å; D450-N452 WeakPolarHBondContact OD1-CB 3.48Å; D450-N452 PolarHBondContact OD1-N 3.09Å; D450-T453 PolarHBondContact O-N 2.96Å; D450-T453 VanDerWaalsContact O-N 3.08Å; D450-T453 PolarHBondContact O-OG1 2.94Å
451	P	48.6	Very low	62.5	Low	90 Å²	90	66.7 Å²	66.7	58%	0.584	36%	0.363	S	S	*	.	H	α-helix	trans	-55.5	-25.9	-176.8	-19.5	27.6	0	0	0	112.4	A449 F455	A449-P451 VanDerWaalsContact O-CD 3.23Å; A449-P451 WeakPolarHBondContact O-CD 3.38Å; A449-P451 VanDerWaalsContact O-N 3.08Å; P451-F455 WeakPolarHBondContact O-CB 3.36Å
452	N	49.6	Very low	64.2	Low	96 Å²	96	62.6 Å²	62.6	51%	0.513	35%	0.347	S	S	.	.	H	α-helix	trans	-80.6	-17.7	-177	-77.5	-31.3	0	0	0	115.1	D450 I457	D450-N452 PolarHBondContact O-N 3.5Å; D450-N452 WeakPolarHBondContact OD1-CB 3.48Å; D450-N452 PolarHBondContact OD1-N 3.09Å; N452-I457 WeakPolarHBondContact OD1-CD1 3.38Å
453	T	50.2	Low	66.1	Low	103 Å²	103	62.2 Å²	62.2	63%	0.632	35%	0.345	S	S	*	.	H	α-helix	trans	-101.8	-24.7	-170.6	49.7	0	0	0	0	114.8	D450	D450-T453 PolarHBondContact O-N 2.96Å; D450-T453 VanDerWaalsContact O-N 3.08Å; D450-T453 PolarHBondContact O-OG1 2.94Å
454	K	59.7	Low	68.1	Low	86 Å²	86	60.6 Å²	60.6	37%	0.374	34%	0.337	S	S	.	.	H	α-helix	trans	-107.8	-15.7	-179.7	-70.6	-172.3	178.3	-177.6	0	114.3	T307	T307-K454 HydrophobicContact CG2-CB 4.27Å; T307-K454 HydrophobicContact CG2-CD 4.38Å; T307-K454 HydrophobicContact CG2-CG 3.98Å
455	F	70.5	Confident	70	Confident	66 Å²	66	58.2 Å²	58.2	29%	0.289	32%	0.321	S	S	.	.	S	Bend	trans	-94.7	132.6	-170.3	-167.9	-110.4	0	0	0	111.4	P451 I457 T460 F470	P451-F455 WeakPolarHBondContact O-CB 3.36Å; F455-I457 HydrophobicContact CB-CG1 4.36Å; F455-I457 HydrophobicContact CD1-CG1 3.56Å; F455-I457 HydrophobicContact CE1-CG1 4.32Å; F455-I457 HydrophobicContact CG-CG1 4.45Å; F455-I457 PolarHBondContact O-N 3.25Å; F455-T460 HydrophobicContact CE1-CG2 3.55Å; F455-T460 WeakPolarHBondContact CE1-OG1 3.15Å; F455-T460 HydrophobicContact CZ-CG2 3.59Å; F455-T460 VanDerWaalsContact CZ-OG1 3.25Å; F455-T460 WeakPolarHBondContact CZ-OG1 3.28Å; F455-F470 HydrophobicContact CE1-CZ 4.37Å; F455-F470 AromaticContact CE2-CE1 3.78Å; F455-F470 HydrophobicContact CE2-CE1 3.78Å; F455-F470 AromaticContact CE2-CZ 3.52Å; F455-F470 HydrophobicContact CE2-CZ 3.52Å; F455-F470 AromaticContact CZ-CE1 3.5Å; F455-F470 HydrophobicContact CZ-CE1 3.5Å; F455-F470 VanDerWaalsContact CZ-CE1 3.5Å; F455-F470 AromaticContact CZ-CZ 3.32Å; F455-F470 HydrophobicContact CZ-CZ 3.32Å
456	P	84.6	Confident	71.9	Confident	21 Å²	21	56.9 Å²	56.9	14%	0.136	31%	0.314	C	S	.	.			trans	-75.1	59.9	-176.9	37	-43.6	0	0	0	111.5	D418 K458 W459 T460	D418-P456 HydrophobicContact CB-CG 4.47Å; D418-P456 WeakPolarHBondContact OD1-CB 3.45Å; D418-P456 WeakPolarHBondContact OD1-CG 3.34Å; P456-K458 PolarHBondContact O-N 3.31Å; P456-K458 VanDerWaalsContact O-N 3.1Å; P456-W459 HydrophobicContact CB-CE3 4.03Å; P456-W459 PolarHBondContact O-N 3.46Å; P456-T460 PolarHBondContact O-N 2.92Å; P456-T460 PolarHBondContact O-OG1 2.83Å
457	I	88.8	Confident	73.9	Confident	17 Å²	17	58.7 Å²	58.7	9%	0.087	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-55.4	-36.9	-169.7	-72.3	169.7	0	0	0	112.6	N452 F455 W459 T460 T499 V503	N452-I457 WeakPolarHBondContact OD1-CD1 3.38Å; F455-I457 HydrophobicContact CB-CG1 4.36Å; F455-I457 HydrophobicContact CD1-CG1 3.56Å; F455-I457 HydrophobicContact CE1-CG1 4.32Å; F455-I457 HydrophobicContact CG-CG1 4.45Å; F455-I457 PolarHBondContact O-N 3.25Å; I457-W459 PolarHBondContact O-N 3.36Å; I457-T460 PolarHBondContact O-N 3.33Å; I457-T499 HydrophobicContact CB-CG2 3.21Å; I457-T499 HydrophobicContact CD1-CG2 3.4Å; I457-T499 VanDerWaalsContact CD1-CG2 3.4Å; I457-T499 HydrophobicContact CG1-CG2 3.8Å; I457-T499 HydrophobicContact CG2-CG2 3.28Å; I457-V503 HydrophobicContact CG2-CG2 3.1Å
458	K	93.9	Very high	75.9	Confident	29 Å²	29	59.7 Å²	59.7	13%	0.126	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-64.8	-20.9	179	-71.7	-173.6	167.9	-160.9	0	114	P456 P493 Y494 M497 A502	P456-K458 PolarHBondContact O-N 3.31Å; P456-K458 VanDerWaalsContact O-N 3.1Å; K458-P493 HydrophobicContact CB-CB 4.46Å; K458-P493 WeakPolarHBondContact CD-O 3.47Å; K458-P493 PolarHBondContact NZ-O 3.39Å; K458-Y494 HydrophobicContact CB-CD2 4.2Å; K458-Y494 HydrophobicContact CD-CD2 4.48Å; K458-Y494 HydrophobicContact CG-CD2 4.27Å; K458-Y494 PolarHBondContact NZ-O 2.88Å; K458-Y494 WeakPolarHBondContact O-CE2 3.26Å; K458-M497 WeakPolarHBondContact CE-O 3.46Å; K458-M497 PolarHBondContact NZ-O 3.42Å; K458-A502 HydrophobicContact CG-CB 4.45Å
459	W	95.3	Very high	78.3	Confident	40 Å²	40	55.5 Å²	55.5	15%	0.152	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-96.1	-13.2	174.1	-68.5	-100	0	0	0	112.2	R420 P456 I457 W477 S478 I481 E485 P493	R420-W459 VanDerWaalsContact CB-CD1 3.45Å; R420-W459 HydrophobicContact CB-CD2 4.11Å; R420-W459 HydrophobicContact CB-CG 3.9Å; P456-W459 HydrophobicContact CB-CE3 4.03Å; P456-W459 PolarHBondContact O-N 3.46Å; I457-W459 PolarHBondContact O-N 3.36Å; W459-W477 VanDerWaalsContact O-CD1 3.3Å; W459-S478 WeakPolarHBondContact O-CA 3.48Å; W459-S478 WeakPolarHBondContact O-CB 3.25Å; W459-S478 PolarHBondContact O-OG 2.95Å; W459-I481 HydrophobicContact CD2-CG2 4.39Å; W459-I481 HydrophobicContact CG-CB 4.43Å; W459-I481 HydrophobicContact CG-CG2 3.92Å; W459-E485 HydrophobicContact CZ2-CG 4.47Å; W459-E485 WeakPolarHBondContact CZ2-OE1 3.05Å; W459-E485 PolarHBondContact NE1-OE2 3.2Å; W459-P493 HydrophobicContact CH2-CG 4.38Å; W459-P493 HydrophobicContact CZ2-CG 3.75Å
460	T	93.2	Very high	80.4	Confident	12 Å²	12	56 Å²	56	7%	0.074	29%	0.29	C	S	.	.	S	Bend	trans	-83.4	133.4	-170.6	-53.2	0	0	0	0	110.8	F455 P456 I457 A464 A465 F470	F455-T460 HydrophobicContact CE1-CG2 3.55Å; F455-T460 WeakPolarHBondContact CE1-OG1 3.15Å; F455-T460 HydrophobicContact CZ-CG2 3.59Å; F455-T460 VanDerWaalsContact CZ-OG1 3.25Å; F455-T460 WeakPolarHBondContact CZ-OG1 3.28Å; P456-T460 PolarHBondContact O-N 2.92Å; P456-T460 PolarHBondContact O-OG1 2.83Å; I457-T460 PolarHBondContact O-N 3.33Å; T460-A464 HydrophobicContact CG2-CB 3.46Å; T460-A464 VanDerWaalsContact CG2-CB 3.46Å; T460-A465 HydrophobicContact CG2-CB 3.98Å; T460-F470 HydrophobicContact CG2-CE1 4.46Å
461	A	95	Very high	82.5	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.281	C	S	.	.			trans	-58.6	147.3	172.5	0	0	0	0	0	111.8	E463 A464 A465 W477	A461-E463 VanDerWaalsContact C-N 3.29Å; A461-E463 VanDerWaalsContact CB-CD 3.48Å; A461-E463 WeakPolarHBondContact CB-OE1 3.31Å; A461-E463 WeakPolarHBondContact CB-OE2 3.24Å; A461-E463 PolarHBondContact O-N 3.1Å; A461-A464 HydrophobicContact CB-CB 4.38Å; A461-A464 PolarHBondContact O-N 2.92Å; A461-A465 PolarHBondContact O-N 3.27Å; A461-W477 HydrophobicContact CB-CB 3.67Å; A461-W477 HydrophobicContact CB-CD2 4Å; A461-W477 HydrophobicContact CB-CE3 4.39Å; A461-W477 HydrophobicContact CB-CG 3.66Å
462	P	93.3	Very high	84.8	Confident	20 Å²	20	51 Å²	51	13%	0.13	26%	0.261	C	S	.	.	H	α-helix	trans	-57.8	-39.3	-175.2	21.9	-32.7	0	0	0	112.9	A464 A465 L466 W477 V506	P462-A464 VanDerWaalsContact C-N 3.34Å; P462-A464 PolarHBondContact O-N 2.93Å; P462-A465 PolarHBondContact O-N 3.12Å; P462-L466 VanDerWaalsContact O-CB 3.25Å; P462-L466 WeakPolarHBondContact O-CB 3.44Å; P462-L466 VanDerWaalsContact O-CG 3.29Å; P462-L466 WeakPolarHBondContact O-CG 3.42Å; P462-L466 PolarHBondContact O-N 3.2Å; P462-W477 HydrophobicContact CG-CH2 4.13Å; P462-W477 HydrophobicContact CG-CZ3 4.04Å; P462-V506 HydrophobicContact CB-CG1 4.24Å; P462-V506 HydrophobicContact CG-CG1 4.28Å
463	E	93.4	Very high	87.1	Confident	21 Å²	21	48.4 Å²	48.4	10%	0.098	25%	0.245	C	C	.	.	H	α-helix	trans	-66.9	-33.6	176.6	73.6	-74	178.3	0	0	113	A461 Q467 H468 I469 P538 R541	A461-E463 VanDerWaalsContact C-N 3.29Å; A461-E463 VanDerWaalsContact CB-CD 3.48Å; A461-E463 WeakPolarHBondContact CB-OE1 3.31Å; A461-E463 WeakPolarHBondContact CB-OE2 3.24Å; A461-E463 PolarHBondContact O-N 3.1Å; E463-Q467 CarbonylContact O-C 3.27Å; E463-Q467 WeakPolarHBondContact O-CA 3.34Å; E463-Q467 VanDerWaalsContact O-CB 3.31Å; E463-Q467 WeakPolarHBondContact O-CB 3.36Å; E463-Q467 PolarHBondContact O-N 2.65Å; E463-H468 PolarHBondContact O-N 2.85Å; E463-I469 HydrophobicContact CG-CB 4.44Å; E463-I469 PolarHBondContact O-N 3.22Å; E463-P538 HydrophobicContact CG-CG 4.02Å; E463-R541 IonicContact OE1-CZ 3.54Å; E463-R541 IonicContact OE1-NH1 2.71Å; E463-R541 PolarHBondContact OE1-NH1 2.74Å; E463-R541 IonicContact OE1-NH2 3.17Å; E463-R541 PolarHBondContact OE1-NH2 3.01Å; E463-R541 IonicContact OE2-CZ 2.71Å; E463-R541 IonicContact OE2-NH1 2.69Å; E463-R541 IonicContact OE2-NH2 2.83Å; E463-R541 PolarHBondContact OE2-NH2 3.28Å
464	A	92	Very high	89.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-75.3	-37.6	176.6	0	0	0	0	0	111.4	T460 A461 P462 H468 I469 F470	T460-A464 HydrophobicContact CG2-CB 3.46Å; T460-A464 VanDerWaalsContact CG2-CB 3.46Å; A461-A464 HydrophobicContact CB-CB 4.38Å; A461-A464 PolarHBondContact O-N 2.92Å; P462-A464 VanDerWaalsContact C-N 3.34Å; P462-A464 PolarHBondContact O-N 2.93Å; A464-H468 VanDerWaalsContact O-CA 3.24Å; A464-H468 WeakPolarHBondContact O-CA 3.48Å; A464-H468 PolarHBondContact O-N 3.14Å; A464-I469 WeakPolarHBondContact CA-O 3.36Å; A464-I469 WeakPolarHBondContact CB-O 3.33Å; A464-F470 HydrophobicContact CB-CD1 4.01Å; A464-F470 HydrophobicContact CB-CE1 4Å; A464-F470 HydrophobicContact CB-CG 4.39Å; A464-F470 HydrophobicContact CB-CZ 4.34Å
465	A	88.5	Confident	91.1	Very high	25 Å²	25	39.5 Å²	39.5	21%	0.207	20%	0.198	C	C	.	.	H	α-helix	trans	-73.2	-39.9	178.7	0	0	0	0	0	112.9	T460 A461 P462	T460-A465 HydrophobicContact CG2-CB 3.98Å; A461-A465 PolarHBondContact O-N 3.27Å; P462-A465 PolarHBondContact O-N 3.12Å
466	L	87.2	Confident	92.4	Very high	79 Å²	79	36.4 Å²	36.4	41%	0.414	18%	0.184	S	C	.	.	H	α-helix	trans	-93	-34.5	-173.6	-63.4	171.8	0	0	0	113.4	P462 V503 E507	P462-L466 VanDerWaalsContact O-CB 3.25Å; P462-L466 WeakPolarHBondContact O-CB 3.44Å; P462-L466 VanDerWaalsContact O-CG 3.29Å; P462-L466 WeakPolarHBondContact O-CG 3.42Å; P462-L466 PolarHBondContact O-N 3.2Å; L466-V503 HydrophobicContact CD2-CG1 3.69Å; L466-V503 HydrophobicContact CG-CG1 4.15Å; L466-E507 HydrophobicContact CD1-CB 4.37Å; L466-E507 HydrophobicContact CD1-CG 4.02Å
467	Q	89	Confident	93.1	Very high	127 Å²	127	35.4 Å²	35.4	59%	0.593	18%	0.178	S	C	*	.	H	α-helix	trans	-118.5	1.4	-172.6	-54.9	176.8	-2.2	0	0	112.9	E463 I469	E463-Q467 CarbonylContact O-C 3.27Å; E463-Q467 WeakPolarHBondContact O-CA 3.34Å; E463-Q467 VanDerWaalsContact O-CB 3.31Å; E463-Q467 WeakPolarHBondContact O-CB 3.36Å; E463-Q467 PolarHBondContact O-N 2.65Å; Q467-I469 HydrophobicContact CB-CD1 3.92Å; Q467-I469 HydrophobicContact CB-CG1 3.88Å; Q467-I469 PolarHBondContact O-N 3.43Å; Q467-I469 VanDerWaalsContact OE1-CD1 3.26Å
468	H	85.8	Confident	93.5	Very high	130 Å²	130	34.9 Å²	34.9	60%	0.602	18%	0.175	S	C	*	.			trans	56.8	29.2	-175.4	-60.6	-71.3	0	0	0	114.1	E463 A464 F470	E463-H468 PolarHBondContact O-N 2.85Å; A464-H468 VanDerWaalsContact O-CA 3.24Å; A464-H468 WeakPolarHBondContact O-CA 3.48Å; A464-H468 PolarHBondContact O-N 3.14Å; H468-F470 HydrophobicContact CB-CE2 4.48Å; H468-F470 WeakPolarHBondContact O-CD2 3.48Å; H468-F470 PolarHBondContact O-N 3.15Å
469	I	90.7	Very high	93.7	Very high	85 Å²	85	33.5 Å²	33.5	44%	0.436	17%	0.169	S	C	.	.			trans	-90.9	91.4	177.3	-56.8	178.1	0	0	0	109.6	E463 A464 Q467	E463-I469 HydrophobicContact CG-CB 4.44Å; E463-I469 PolarHBondContact O-N 3.22Å; A464-I469 WeakPolarHBondContact CA-O 3.36Å; A464-I469 WeakPolarHBondContact CB-O 3.33Å; Q467-I469 HydrophobicContact CB-CD1 3.92Å; Q467-I469 HydrophobicContact CB-CG1 3.88Å; Q467-I469 PolarHBondContact O-N 3.43Å; Q467-I469 VanDerWaalsContact OE1-CD1 3.26Å
470	F	90.7	Very high	93.9	Very high	48 Å²	48	31.6 Å²	31.6	21%	0.211	16%	0.162	C	C	.	.			trans	-89.5	128.7	174.4	-66.3	-90.2	0	0	0	111.3	V415 R417 F455 T460 A464 H468	V415-F470 HydrophobicContact CG1-CB 4.39Å; R417-F470 HydrophobicContact CB-CD1 3.91Å; R417-F470 HydrophobicContact CB-CE1 4.21Å; R417-F470 HydrophobicContact CG-CB 4.18Å; R417-F470 HydrophobicContact CG-CD1 3.81Å; R417-F470 HydrophobicContact CG-CG 4.17Å; F455-F470 HydrophobicContact CE1-CZ 4.37Å; F455-F470 AromaticContact CE2-CE1 3.78Å; F455-F470 HydrophobicContact CE2-CE1 3.78Å; F455-F470 AromaticContact CE2-CZ 3.52Å; F455-F470 HydrophobicContact CE2-CZ 3.52Å; F455-F470 AromaticContact CZ-CE1 3.5Å; F455-F470 HydrophobicContact CZ-CE1 3.5Å; F455-F470 VanDerWaalsContact CZ-CE1 3.5Å; F455-F470 AromaticContact CZ-CZ 3.32Å; F455-F470 HydrophobicContact CZ-CZ 3.32Å; T460-F470 HydrophobicContact CG2-CE1 4.46Å; A464-F470 HydrophobicContact CB-CD1 4.01Å; A464-F470 HydrophobicContact CB-CE1 4Å; A464-F470 HydrophobicContact CB-CG 4.39Å; A464-F470 HydrophobicContact CB-CZ 4.34Å; H468-F470 HydrophobicContact CB-CE2 4.48Å; H468-F470 WeakPolarHBondContact O-CD2 3.48Å; H468-F470 PolarHBondContact O-N 3.15Å
471	S	93.6	Very high	94.1	Very high	35 Å²	35	31 Å²	31	25%	0.245	16%	0.159	C	C	.	.			trans	-147.6	170.8	177.3	68.1	0	0	0	0	110.9	K473 S474 D475	S471-K473 PolarHBondContact O-N 3.49Å; S471-K473 VanDerWaalsContact O-N 3.15Å; S471-K473 PolarHBondContact OG-N 3.27Å; S471-S474 PolarHBondContact N-OG 2.96Å; S471-S474 PolarHBondContact O-N 2.95Å; S471-S474 PolarHBondContact O-OG 2.99Å; S471-S474 PolarHBondContact OG-N 3.17Å; S471-D475 PolarHBondContact O-N 2.79Å
472	I	95.3	Very high	94.3	Very high	32 Å²	32	31 Å²	31	16%	0.164	16%	0.159	C	C	.	.	H	α-helix	trans	-57.6	-29.4	171.5	-162.4	67	0	0	0	111.7	M406 E410 S474 D475 V476 F544	M406-I472 HydrophobicContact CE-CD1 4.22Å; E410-I472 HydrophobicContact CB-CD1 3.95Å; E410-I472 HydrophobicContact CB-CG1 3.82Å; E410-I472 HydrophobicContact CG-CG1 3.91Å; I472-S474 VanDerWaalsContact C-N 3.35Å; I472-S474 PolarHBondContact O-N 3.43Å; I472-D475 HydrophobicContact CD1-CB 4.47Å; I472-D475 WeakPolarHBondContact O-CB 3.47Å; I472-D475 PolarHBondContact O-N 3.31Å; I472-D475 VanDerWaalsContact O-N 3.12Å; I472-V476 WeakPolarHBondContact O-CG2 3.33Å; I472-V476 PolarHBondContact O-N 3.11Å; I472-F544 HydrophobicContact CD1-CD2 3.83Å; I472-F544 HydrophobicContact CD1-CE2 3.78Å; I472-F544 HydrophobicContact CG1-CD2 3.84Å; I472-F544 HydrophobicContact CG1-CE2 3.98Å
473	K	98	Very high	94.5	Very high	40 Å²	40	30 Å²	30	17%	0.174	15%	0.153	C	C	.	.	H	α-helix	trans	-71.1	-27.4	175.8	-61.8	-59.9	-173.7	174	0	113.2	S471 D475 V476 W477 P538 R541 P542	S471-K473 PolarHBondContact O-N 3.49Å; S471-K473 VanDerWaalsContact O-N 3.15Å; S471-K473 PolarHBondContact OG-N 3.27Å; K473-D475 VanDerWaalsContact C-N 3.35Å; K473-V476 PolarHBondContact O-N 3.41Å; K473-W477 PolarHBondContact O-N 3.48Å; K473-P538 HydrophobicContact CB-CB 3.84Å; K473-P538 WeakPolarHBondContact CD-O 3.39Å; K473-P538 HydrophobicContact CG-CB 4.46Å; K473-P538 WeakPolarHBondContact CG-O 3.49Å; K473-R541 HydrophobicContact CD-CB 4.35Å; K473-R541 PolarHBondContact NZ-O 3.11Å; K473-R541 WeakPolarHBondContact O-CD 3.48Å; K473-R541 PolarHBondContact O-NH1 3.41Å; K473-P542 PolarHBondContact NZ-O 3.39Å
474	S	96.7	Very high	94.7	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-73.7	-28.6	169.1	63.8	0	0	0	0	112.1	S471 I472 W477 S478	S471-S474 PolarHBondContact N-OG 2.96Å; S471-S474 PolarHBondContact O-N 2.95Å; S471-S474 PolarHBondContact O-OG 2.99Å; S471-S474 PolarHBondContact OG-N 3.17Å; I472-S474 VanDerWaalsContact C-N 3.35Å; I472-S474 PolarHBondContact O-N 3.43Å; S474-W477 WeakPolarHBondContact O-CB 3.44Å; S474-W477 PolarHBondContact O-N 2.89Å; S474-S478 PolarHBondContact O-N 2.85Å; S474-S478 VanDerWaalsContact O-N 3.14Å; S474-S478 PolarHBondContact O-OG 3.16Å
475	D	97.1	Very high	94.9	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-70.8	-35.5	170.5	-65.3	-28.4	0	0	0	111.3	M406 V415 H416 R417 S471 I472 K473 W477 S478 F479 F544	M406-D475 HydrophobicContact CE-CB 3.82Å; V415-D475 WeakPolarHBondContact CA-OD2 3.21Å; V415-D475 VanDerWaalsContact CG1-OD2 3.31Å; V415-D475 WeakPolarHBondContact CG1-OD2 3.28Å; H416-D475 PolarHBondContact N-OD2 3.06Å; R417-D475 PolarHBondContact N-OD1 3.28Å; S471-D475 PolarHBondContact O-N 2.79Å; I472-D475 HydrophobicContact CD1-CB 4.47Å; I472-D475 WeakPolarHBondContact O-CB 3.47Å; I472-D475 PolarHBondContact O-N 3.31Å; I472-D475 VanDerWaalsContact O-N 3.12Å; K473-D475 VanDerWaalsContact C-N 3.35Å; D475-W477 VanDerWaalsContact C-N 3.3Å; D475-W477 PolarHBondContact O-N 3.32Å; D475-S478 CarbonylContact O-C 3.58Å; D475-S478 WeakPolarHBondContact O-CA 3.35Å; D475-S478 WeakPolarHBondContact O-CB 3.32Å; D475-S478 PolarHBondContact O-N 3.16Å; D475-S478 VanDerWaalsContact O-N 3.11Å; D475-F479 WeakPolarHBondContact O-CB 3.49Å; D475-F479 PolarHBondContact O-N 3.49Å; D475-F544 HydrophobicContact CB-CE2 3.88Å; D475-F544 HydrophobicContact CB-CZ 4.05Å
476	V	98.6	Very high	95.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.8	-40.7	172.9	173.3	0	0	0	0	111.3	I472 K473 F479 G480 C533 R541 P542 F544 L547	I472-V476 WeakPolarHBondContact O-CG2 3.33Å; I472-V476 PolarHBondContact O-N 3.11Å; K473-V476 PolarHBondContact O-N 3.41Å; V476-F479 WeakPolarHBondContact O-CB 3.23Å; V476-F479 PolarHBondContact O-N 3.43Å; V476-G480 PolarHBondContact O-N 2.95Å; V476-C533 HydrophobicContact CG1-CB 4.07Å; V476-C533 WeakPolarHBondContact O-CB 3.36Å; V476-R541 HydrophobicContact CB-CB 4.48Å; V476-R541 HydrophobicContact CG1-CB 3.9Å; V476-P542 HydrophobicContact CG1-CG 4.08Å; V476-P542 WeakPolarHBondContact CG2-O 3.36Å; V476-F544 HydrophobicContact CB-CZ 4.5Å; V476-F544 HydrophobicContact CG2-CD2 3.9Å; V476-F544 HydrophobicContact CG2-CE1 4.45Å; V476-F544 HydrophobicContact CG2-CE2 3.61Å; V476-F544 HydrophobicContact CG2-CG 4.42Å; V476-F544 HydrophobicContact CG2-CZ 3.93Å; V476-L547 HydrophobicContact CG1-CD1 4.22Å
477	W	98.4	Very high	95.7	Very high	1 Å²	1	25.5 Å²	25.5	0%	0.004	12%	0.124	C	C	.	.	H	α-helix	trans	-58.6	-49.6	171.7	177.3	-72	0	0	0	111.5	W459 A461 P462 K473 S474 D475 F479 G480 I481 V506 W534	W459-W477 VanDerWaalsContact O-CD1 3.3Å; A461-W477 HydrophobicContact CB-CB 3.67Å; A461-W477 HydrophobicContact CB-CD2 4Å; A461-W477 HydrophobicContact CB-CE3 4.39Å; A461-W477 HydrophobicContact CB-CG 3.66Å; P462-W477 HydrophobicContact CG-CH2 4.13Å; P462-W477 HydrophobicContact CG-CZ3 4.04Å; K473-W477 PolarHBondContact O-N 3.48Å; S474-W477 WeakPolarHBondContact O-CB 3.44Å; S474-W477 PolarHBondContact O-N 2.89Å; D475-W477 VanDerWaalsContact C-N 3.3Å; D475-W477 PolarHBondContact O-N 3.32Å; W477-F479 PolarHBondContact O-N 3.3Å; W477-G480 WeakPolarHBondContact O-CA 3.45Å; W477-G480 PolarHBondContact O-N 2.97Å; W477-I481 PolarHBondContact O-N 3.33Å; W477-I481 VanDerWaalsContact O-N 3.16Å; W477-V506 HydrophobicContact CH2-CG1 3.47Å; W477-V506 VanDerWaalsContact CH2-CG1 3.47Å; W477-V506 HydrophobicContact CZ2-CG1 3.48Å; W477-V506 VanDerWaalsContact CZ2-CG1 3.48Å; W477-V506 HydrophobicContact CZ2-CG2 4.47Å; W477-W534 AromaticContact CD2-CD1 3.8Å; W477-W534 AromaticContact CE2-CD1 3.87Å; W477-W534 HydrophobicContact CE3-CB 4.12Å; W477-W534 HydrophobicContact CH2-CB 4.06Å; W477-W534 HydrophobicContact CZ2-CB 4.48Å; W477-W534 HydrophobicContact CZ3-CB 3.88Å; W477-W534 WeakPolarHBondContact CZ3-O 3.28Å; W477-W534 PolarHBondContact O-NE1 3.02Å
478	S	98	Very high	96	Very high	5 Å²	5	20.7 Å²	20.7	4%	0.035	10%	0.104	C	C	.	.	H	α-helix	trans	-58.3	-38.5	179.4	-50.3	0	0	0	0	110.9	L419 W459 S474 D475 I481 L482	L419-S478 WeakPolarHBondContact O-CB 3.41Å; W459-S478 WeakPolarHBondContact O-CA 3.48Å; W459-S478 WeakPolarHBondContact O-CB 3.25Å; W459-S478 PolarHBondContact O-OG 2.95Å; S474-S478 PolarHBondContact O-N 2.85Å; S474-S478 VanDerWaalsContact O-N 3.14Å; S474-S478 PolarHBondContact O-OG 3.16Å; D475-S478 CarbonylContact O-C 3.58Å; D475-S478 WeakPolarHBondContact O-CA 3.35Å; D475-S478 WeakPolarHBondContact O-CB 3.32Å; D475-S478 PolarHBondContact O-N 3.16Å; D475-S478 VanDerWaalsContact O-N 3.11Å; S478-I481 WeakPolarHBondContact O-CB 3.32Å; S478-I481 PolarHBondContact O-N 3.03Å; S478-I481 VanDerWaalsContact O-N 3.16Å; S478-L482 PolarHBondContact O-N 3.11Å
479	F	98.7	Very high	96.5	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-65.5	-37.3	175.1	-174.3	-125.9	0	0	0	112.7	M399 I402 A403 L419 D475 V476 W477 I481 L482 M483 F544 L547 F551	M399-F479 HydrophobicContact CB-CZ 4.43Å; I402-F479 HydrophobicContact CB-CE2 3.91Å; I402-F479 HydrophobicContact CG2-CD2 3.87Å; I402-F479 HydrophobicContact CG2-CE2 3.53Å; A403-F479 HydrophobicContact CB-CE1 4.09Å; A403-F479 HydrophobicContact CB-CZ 3.86Å; L419-F479 HydrophobicContact CD2-CB 3.78Å; L419-F479 HydrophobicContact CD2-CD2 4.29Å; L419-F479 HydrophobicContact CD2-CG 4.43Å; D475-F479 WeakPolarHBondContact O-CB 3.49Å; D475-F479 PolarHBondContact O-N 3.49Å; V476-F479 WeakPolarHBondContact O-CB 3.23Å; V476-F479 PolarHBondContact O-N 3.43Å; W477-F479 PolarHBondContact O-N 3.3Å; F479-I481 VanDerWaalsContact C-N 3.3Å; F479-I481 PolarHBondContact O-N 3.47Å; F479-L482 HydrophobicContact CD2-CB 4.43Å; F479-L482 HydrophobicContact CD2-CD2 4.15Å; F479-L482 HydrophobicContact CD2-CG 4.45Å; F479-L482 CarbonylContact O-C 3.54Å; F479-L482 WeakPolarHBondContact O-CB 3.3Å; F479-L482 PolarHBondContact O-N 3.32Å; F479-L482 VanDerWaalsContact O-N 3.16Å; F479-M483 HydrophobicContact CD1-CE 3.29Å; F479-M483 HydrophobicContact CE1-CE 3.15Å; F479-M483 HydrophobicContact CG-CE 4.15Å; F479-M483 HydrophobicContact CZ-CE 3.87Å; F479-M483 WeakPolarHBondContact O-CG 3.08Å; F479-M483 PolarHBondContact O-N 3.42Å; F479-F544 HydrophobicContact CB-CE1 3.71Å; F479-F544 HydrophobicContact CB-CZ 4Å; F479-F544 HydrophobicContact CD1-CD1 4.3Å; F479-F544 AromaticContact CD1-CE1 3.72Å; F479-F544 HydrophobicContact CD1-CE1 3.72Å; F479-F544 HydrophobicContact CD2-CE1 4.41Å; F479-F544 HydrophobicContact CE1-CE1 4.39Å; F479-F544 AromaticContact CG-CE1 3.71Å; F479-F544 HydrophobicContact CG-CE1 3.71Å; F479-F544 HydrophobicContact CG-CZ 4.48Å; F479-L547 HydrophobicContact CD1-CD1 3.71Å; F479-L547 HydrophobicContact CE1-CB 4.31Å; F479-L547 HydrophobicContact CE1-CD1 3.91Å; F479-F551 AromaticContact CE1-CE2 3.79Å; F479-F551 HydrophobicContact CE1-CE2 3.79Å; F479-F551 AromaticContact CZ-CE2 3.92Å; F479-F551 HydrophobicContact CZ-CE2 3.92Å
480	G	98.5	Very high	96.6	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-60	-39.7	170.7	0	0	0	0	0	112.5	V476 W477 M483 Y484 W534	V476-G480 PolarHBondContact O-N 2.95Å; W477-G480 WeakPolarHBondContact O-CA 3.45Å; W477-G480 PolarHBondContact O-N 2.97Å; G480-M483 PolarHBondContact O-N 2.85Å; G480-Y484 PolarHBondContact O-N 3.41Å; G480-W534 VanDerWaalsContact C-CZ2 3.48Å; G480-W534 VanDerWaalsContact O-CZ2 3.23Å; G480-W534 WeakPolarHBondContact O-CZ2 3.43Å
481	I	98.3	Very high	96.8	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-68.4	-37.8	173.8	-55.9	-66.1	0	0	0	111	W459 W477 S478 F479 M483 Y484 E485 P493 Y494 L512 W534	W459-I481 HydrophobicContact CD2-CG2 4.39Å; W459-I481 HydrophobicContact CG-CB 4.43Å; W459-I481 HydrophobicContact CG-CG2 3.92Å; W477-I481 PolarHBondContact O-N 3.33Å; W477-I481 VanDerWaalsContact O-N 3.16Å; S478-I481 WeakPolarHBondContact O-CB 3.32Å; S478-I481 PolarHBondContact O-N 3.03Å; S478-I481 VanDerWaalsContact O-N 3.16Å; F479-I481 VanDerWaalsContact C-N 3.3Å; F479-I481 PolarHBondContact O-N 3.47Å; I481-M483 PolarHBondContact O-N 3.22Å; I481-Y484 WeakPolarHBondContact O-CA 3.39Å; I481-Y484 VanDerWaalsContact O-CB 3.28Å; I481-Y484 WeakPolarHBondContact O-CB 3.43Å; I481-Y484 PolarHBondContact O-N 2.82Å; I481-Y484 VanDerWaalsContact O-N 3.11Å; I481-E485 PolarHBondContact O-N 2.72Å; I481-P493 HydrophobicContact CG2-CB 3.75Å; I481-P493 HydrophobicContact CG2-CG 3.4Å; I481-Y494 HydrophobicContact CD1-CE2 3.93Å; I481-Y494 WeakPolarHBondContact CD1-OH 3.49Å; I481-L512 HydrophobicContact CD1-CD1 3.89Å; I481-W534 HydrophobicContact CD1-CZ2 3.7Å; I481-W534 HydrophobicContact CG1-CZ2 4.48Å
482	L	98.4	Very high	96.8	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-62.6	-39.4	174.1	176.9	48.4	0	0	0	112.1	I402 L419 A421 I424 S478 F479 Y484 E485 I486	I402-L482 HydrophobicContact CD1-CD2 4.19Å; I402-L482 HydrophobicContact CG2-CD2 4.07Å; L419-L482 HydrophobicContact CD1-CD2 4.12Å; L419-L482 HydrophobicContact CG-CD2 4.06Å; A421-L482 VanDerWaalsContact CA-CD1 3.45Å; A421-L482 HydrophobicContact CB-CD1 3.6Å; A421-L482 VanDerWaalsContact N-CD1 3.28Å; I424-L482 HydrophobicContact CD1-CD2 4.16Å; I424-L482 HydrophobicContact CG1-CD2 3.84Å; S478-L482 PolarHBondContact O-N 3.11Å; F479-L482 HydrophobicContact CD2-CB 4.43Å; F479-L482 HydrophobicContact CD2-CD2 4.15Å; F479-L482 HydrophobicContact CD2-CG 4.45Å; F479-L482 CarbonylContact O-C 3.54Å; F479-L482 WeakPolarHBondContact O-CB 3.3Å; F479-L482 PolarHBondContact O-N 3.32Å; F479-L482 VanDerWaalsContact O-N 3.16Å; L482-Y484 VanDerWaalsContact C-N 3.26Å; L482-Y484 PolarHBondContact O-N 3.29Å; L482-E485 HydrophobicContact CD1-CB 4.49Å; L482-E485 WeakPolarHBondContact O-CB 3.38Å; L482-E485 PolarHBondContact O-N 3.31Å; L482-E485 VanDerWaalsContact O-N 3.13Å; L482-I486 HydrophobicContact CD1-CD1 3.99Å; L482-I486 HydrophobicContact CD1-CG1 4.08Å; L482-I486 HydrophobicContact CG-CD1 4Å; L482-I486 VanDerWaalsContact O-CG1 3.29Å; L482-I486 WeakPolarHBondContact O-CG1 3.5Å; L482-I486 PolarHBondContact O-N 3.5Å
483	M	98.1	Very high	96.8	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-57.6	-41.5	171.7	-64	173.8	-162.3	0	0	111.2	M399 F479 G480 I481 I486 V487 L526 L529 M530 L547 F551	M399-M483 HydrophobicContact CE-CB 4.37Å; M399-M483 HydrophobicContact CG-CG 4.43Å; M399-M483 HydrophobicContact SD-CB 4.24Å; M399-M483 HydrophobicContact SD-CG 3.92Å; F479-M483 HydrophobicContact CD1-CE 3.29Å; F479-M483 HydrophobicContact CE1-CE 3.15Å; F479-M483 HydrophobicContact CG-CE 4.15Å; F479-M483 HydrophobicContact CZ-CE 3.87Å; F479-M483 WeakPolarHBondContact O-CG 3.08Å; F479-M483 PolarHBondContact O-N 3.42Å; G480-M483 PolarHBondContact O-N 2.85Å; I481-M483 PolarHBondContact O-N 3.22Å; M483-I486 PolarHBondContact O-N 3.01Å; M483-V487 WeakPolarHBondContact O-CG2 3.47Å; M483-V487 PolarHBondContact O-N 2.88Å; M483-L526 HydrophobicContact SD-CD1 4.39Å; M483-L529 HydrophobicContact CE-CD2 4.39Å; M483-M530 HydrophobicContact CB-CE 3.58Å; M483-M530 HydrophobicContact CB-CG 3.92Å; M483-M530 HydrophobicContact CB-SD 4.37Å; M483-M530 HydrophobicContact SD-CG 3.79Å; M483-L547 HydrophobicContact CE-CD2 4.42Å; M483-F551 HydrophobicContact CE-CE2 3.7Å; M483-F551 HydrophobicContact CE-CZ 3.61Å; M483-F551 HydrophobicContact CG-CZ 4.49Å; M483-F551 HydrophobicContact SD-CZ 3.93Å
484	Y	96.9	Very high	96.6	Very high	25 Å²	25	8.1 Å²	8.1	10%	0.098	5%	0.05	C	C	.	.	H	α-helix	trans	-60.3	-45.7	174.9	173.8	-81.4	0	0	0	111.3	G480 I481 L482 I486 V487 T488 P493 L512 P515	G480-Y484 PolarHBondContact O-N 3.41Å; I481-Y484 WeakPolarHBondContact O-CA 3.39Å; I481-Y484 VanDerWaalsContact O-CB 3.28Å; I481-Y484 WeakPolarHBondContact O-CB 3.43Å; I481-Y484 PolarHBondContact O-N 2.82Å; I481-Y484 VanDerWaalsContact O-N 3.11Å; L482-Y484 VanDerWaalsContact C-N 3.26Å; L482-Y484 PolarHBondContact O-N 3.29Å; Y484-I486 VanDerWaalsContact C-N 3.32Å; Y484-I486 PolarHBondContact O-N 3.34Å; Y484-V487 PolarHBondContact O-N 3.24Å; Y484-T488 HydrophobicContact CD1-CG2 4.4Å; Y484-T488 HydrophobicContact CD2-CG2 4.46Å; Y484-T488 HydrophobicContact CE1-CG2 4.09Å; Y484-T488 HydrophobicContact CE2-CG2 4.17Å; Y484-T488 WeakPolarHBondContact O-CB 3.48Å; Y484-T488 WeakPolarHBondContact O-CG2 3.38Å; Y484-T488 PolarHBondContact O-N 2.96Å; Y484-T488 VanDerWaalsContact O-N 3.07Å; Y484-T488 PolarHBondContact O-OG1 3.4Å; Y484-P493 HydrophobicContact CD1-CG 4.35Å; Y484-L512 HydrophobicContact CD1-CD1 4.38Å; Y484-L512 HydrophobicContact CD2-CB 4.45Å; Y484-L512 HydrophobicContact CD2-CD1 3.94Å; Y484-L512 HydrophobicContact CE2-CD1 4.26Å; Y484-L512 HydrophobicContact CE2-CD2 4.44Å; Y484-L512 HydrophobicContact CG-CD1 4.01Å; Y484-P515 HydrophobicContact CD2-CB 3.77Å; Y484-P515 HydrophobicContact CD2-CG 3.94Å; Y484-P515 HydrophobicContact CE2-CB 3.76Å; Y484-P515 HydrophobicContact CE2-CG 4.41Å
485	E	97.2	Very high	96.5	Very high	1 Å²	1	12.1 Å²	12.1	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-58.6	-44.1	176	-65.8	-179	98.1	0	0	111.6	A421 W459 I481 L482 T488 Y489 G490 P493	A421-E485 HydrophobicContact CB-CB 4.1Å; A421-E485 HydrophobicContact CB-CG 4.49Å; A421-E485 WeakPolarHBondContact CB-OE1 3.47Å; A421-E485 PolarHBondContact N-OE2 3.28Å; W459-E485 HydrophobicContact CZ2-CG 4.47Å; W459-E485 WeakPolarHBondContact CZ2-OE1 3.05Å; W459-E485 PolarHBondContact NE1-OE2 3.2Å; I481-E485 PolarHBondContact O-N 2.72Å; L482-E485 HydrophobicContact CD1-CB 4.49Å; L482-E485 WeakPolarHBondContact O-CB 3.38Å; L482-E485 PolarHBondContact O-N 3.31Å; L482-E485 VanDerWaalsContact O-N 3.13Å; E485-T488 CarbonylContact O-C 3.6Å; E485-T488 PolarHBondContact O-N 3.07Å; E485-T488 PolarHBondContact O-OG1 3.47Å; E485-Y489 PolarHBondContact O-N 3.02Å; E485-Y489 VanDerWaalsContact O-N 3.17Å; E485-G490 PolarHBondContact O-N 3.3Å; E485-P493 HydrophobicContact CG-CG 4.14Å
486	I	96.8	Very high	96.3	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-63.5	-50.5	-178.6	-67.5	164.5	0	0	0	110.7	L378 L382 L395 I398 M399 I402 L482 M483 Y484 T488 Y489	L378-I486 HydrophobicContact CD2-CD1 4.28Å; L378-I486 HydrophobicContact CD2-CG1 4.07Å; L382-I486 HydrophobicContact CD1-CG1 4.4Å; L395-I486 HydrophobicContact CB-CG2 3.82Å; L395-I486 HydrophobicContact CD1-CG2 4.42Å; L395-I486 HydrophobicContact CD2-CG2 3.81Å; L395-I486 HydrophobicContact CG-CG2 4.21Å; I398-I486 HydrophobicContact CG2-CD1 4.06Å; M399-I486 HydrophobicContact CE-CB 3.83Å; M399-I486 HydrophobicContact CE-CD1 4.46Å; M399-I486 HydrophobicContact CE-CG2 3.49Å; M399-I486 VanDerWaalsContact CE-CG2 3.49Å; M399-I486 HydrophobicContact CG-CD1 3.78Å; M399-I486 HydrophobicContact CG-CG2 4.46Å; I402-I486 HydrophobicContact CD1-CD1 3.82Å; L482-I486 HydrophobicContact CD1-CD1 3.99Å; L482-I486 HydrophobicContact CD1-CG1 4.08Å; L482-I486 HydrophobicContact CG-CD1 4Å; L482-I486 VanDerWaalsContact O-CG1 3.29Å; L482-I486 WeakPolarHBondContact O-CG1 3.5Å; L482-I486 PolarHBondContact O-N 3.5Å; M483-I486 PolarHBondContact O-N 3.01Å; Y484-I486 VanDerWaalsContact C-N 3.32Å; Y484-I486 PolarHBondContact O-N 3.34Å; I486-T488 PolarHBondContact O-N 3.27Å; I486-Y489 PolarHBondContact O-N 3.07Å; I486-Y489 VanDerWaalsContact O-N 3.16Å
487	V	95.3	Very high	96	Very high	4 Å²	4	18.7 Å²	18.7	2%	0.024	13%	0.131	C	C	.	.	H	α-helix	trans	-67	-25	-178.4	177.7	0	0	0	0	112.6	M399 M483 Y484 P515 C522 L526 M530	M399-V487 HydrophobicContact CE-CG2 3.6Å; M483-V487 WeakPolarHBondContact O-CG2 3.47Å; M483-V487 PolarHBondContact O-N 2.88Å; Y484-V487 PolarHBondContact O-N 3.24Å; V487-P515 HydrophobicContact CB-CG 4.37Å; V487-P515 HydrophobicContact CG1-CB 4.43Å; V487-P515 HydrophobicContact CG1-CG 4.08Å; V487-C522 HydrophobicContact CG1-CB 3.86Å; V487-L526 HydrophobicContact CG2-CD2 3.57Å; V487-M530 HydrophobicContact CG2-CE 3.93Å
488	T	95	Very high	95.7	Very high	26 Å²	26	22.4 Å²	22.4	16%	0.16	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	10.2	178.3	59.1	0	0	0	0	113.5	Y484 E485 I486 G490 G491 P515	Y484-T488 HydrophobicContact CD1-CG2 4.4Å; Y484-T488 HydrophobicContact CD2-CG2 4.46Å; Y484-T488 HydrophobicContact CE1-CG2 4.09Å; Y484-T488 HydrophobicContact CE2-CG2 4.17Å; Y484-T488 WeakPolarHBondContact O-CB 3.48Å; Y484-T488 WeakPolarHBondContact O-CG2 3.38Å; Y484-T488 PolarHBondContact O-N 2.96Å; Y484-T488 VanDerWaalsContact O-N 3.07Å; Y484-T488 PolarHBondContact O-OG1 3.4Å; E485-T488 CarbonylContact O-C 3.6Å; E485-T488 PolarHBondContact O-N 3.07Å; E485-T488 PolarHBondContact O-OG1 3.47Å; I486-T488 PolarHBondContact O-N 3.27Å; T488-G490 PolarHBondContact O-N 3.27Å; T488-G491 PolarHBondContact O-N 3.19Å; T488-G491 WeakPolarHBondContact OG1-CA 3.24Å; T488-G491 PolarHBondContact OG1-N 3.38Å; T488-P515 HydrophobicContact CG2-CB 3.52Å
489	Y	95.3	Very high	95.2	Very high	8 Å²	8	24.6 Å²	24.6	3%	0.031	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	49	-178.4	-61.8	-89.5	0	0	0	113	L382 R383 G387 H388 L390 L395 E485 I486 H520	L382-Y489 HydrophobicContact CD2-CD1 4.33Å; R383-Y489 WeakPolarHBondContact CG-O 3.49Å; G387-Y489 WeakPolarHBondContact O-CE1 3.41Å; H388-Y489 AromaticContact ND1-CG 3.9Å; L390-Y489 HydrophobicContact CB-CE1 4.41Å; L390-Y489 PolarHBondContact O-OH 3.33Å; L395-Y489 HydrophobicContact CD1-CE1 4.32Å; L395-Y489 HydrophobicContact CD1-CE2 4.39Å; L395-Y489 HydrophobicContact CD2-CE1 4.27Å; E485-Y489 PolarHBondContact O-N 3.02Å; E485-Y489 VanDerWaalsContact O-N 3.17Å; I486-Y489 PolarHBondContact O-N 3.07Å; I486-Y489 VanDerWaalsContact O-N 3.16Å; Y489-H520 PolarHBondContact OH-CD2 3.03Å
490	G	94.7	Very high	94.5	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	82.6	28.2	-178.3	0	0	0	0	0	113.6	Y379 E485 T488	Y379-G490 WeakPolarHBondContact CE2-O 3.36Å; E485-G490 PolarHBondContact O-N 3.3Å; T488-G490 PolarHBondContact O-N 3.27Å
491	G	93.8	Very high	94.2	Very high	19 Å²	19	38.9 Å²	38.9	20%	0.196	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-64.6	141	173	0	0	0	0	0	111.7	T488 P493	T488-G491 PolarHBondContact O-N 3.19Å; T488-G491 WeakPolarHBondContact OG1-CA 3.24Å; T488-G491 PolarHBondContact OG1-N 3.38Å; G491-P493 WeakPolarHBondContact O-CD 3.4Å
492	T	93.1	Very high	94	Very high	74 Å²	74	39 Å²	39	45%	0.454	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-74.8	125	179.7	-59.8	0	0	0	0	110.5
493	P	95.4	Very high	93.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.234	C	C	.	.	S	Bend	trans	-58.5	145.4	175.4	-24.8	34.5	0	0	0	112.2	K458 W459 I481 Y484 E485 G491 L512	K458-P493 HydrophobicContact CB-CB 4.46Å; K458-P493 WeakPolarHBondContact CD-O 3.47Å; K458-P493 PolarHBondContact NZ-O 3.39Å; W459-P493 HydrophobicContact CH2-CG 4.38Å; W459-P493 HydrophobicContact CZ2-CG 3.75Å; I481-P493 HydrophobicContact CG2-CB 3.75Å; I481-P493 HydrophobicContact CG2-CG 3.4Å; Y484-P493 HydrophobicContact CD1-CG 4.35Å; E485-P493 HydrophobicContact CG-CG 4.14Å; G491-P493 WeakPolarHBondContact O-CD 3.4Å; P493-L512 HydrophobicContact CB-CD1 4.32Å
494	Y	95.3	Very high	93.2	Very high	4 Å²	4	43 Å²	43	2%	0.016	25%	0.25	C	S	.	.	S	Bend	trans	52.1	61	-179.1	-50.1	-86.1	0	0	0	111.4	K458 I481 G496 M497 A502 V506 Y510 L512	K458-Y494 HydrophobicContact CB-CD2 4.2Å; K458-Y494 HydrophobicContact CD-CD2 4.48Å; K458-Y494 HydrophobicContact CG-CD2 4.27Å; K458-Y494 PolarHBondContact NZ-O 2.88Å; K458-Y494 WeakPolarHBondContact O-CE2 3.26Å; I481-Y494 HydrophobicContact CD1-CE2 3.93Å; I481-Y494 WeakPolarHBondContact CD1-OH 3.49Å; Y494-G496 PolarHBondContact O-N 3.42Å; Y494-M497 HydrophobicContact CD1-SD 4.32Å; Y494-M497 PolarHBondContact O-N 3.29Å; Y494-M497 VanDerWaalsContact O-N 3.11Å; Y494-A502 HydrophobicContact CD1-CB 4.39Å; Y494-A502 HydrophobicContact CD2-CB 4.19Å; Y494-A502 HydrophobicContact CG-CB 3.99Å; Y494-V506 HydrophobicContact CE1-CG2 3.69Å; Y494-V506 WeakPolarHBondContact OH-CG2 3.17Å; Y494-Y510 HydrophobicContact CD1-CD1 4.32Å; Y494-Y510 AromaticContact CD1-CE1 3.82Å; Y494-Y510 HydrophobicContact CD1-CE1 3.82Å; Y494-Y510 HydrophobicContact CE1-CD1 4.13Å; Y494-Y510 AromaticContact CE1-CE1 3.93Å; Y494-Y510 HydrophobicContact CE1-CE1 3.93Å; Y494-L512 HydrophobicContact CD1-CD2 3.58Å; Y494-L512 HydrophobicContact CD1-CG 3.91Å; Y494-L512 HydrophobicContact CD2-CD1 4.46Å; Y494-L512 HydrophobicContact CD2-CD2 4.45Å; Y494-L512 HydrophobicContact CE1-CD1 4.26Å; Y494-L512 HydrophobicContact CE1-CD2 3.87Å; Y494-L512 HydrophobicContact CE1-CG 3.63Å; Y494-L512 HydrophobicContact CE2-CD1 4.12Å; Y494-L512 HydrophobicContact CE2-CG 4.38Å; Y494-L512 HydrophobicContact CG-CD2 3.89Å; Y494-L512 HydrophobicContact CG-CG 4.39Å
495	P	93.1	Very high	93.1	Very high	87 Å²	87	44.8 Å²	44.8	57%	0.565	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	137.2	-177.5	25.8	-34.3	0	0	0	110.4	M497	P495-M497 PolarHBondContact O-N 3.31Å
496	G	92.8	Very high	93	Very high	89 Å²	89	45.2 Å²	45.2	92%	0.918	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	-8.4	-177.3	0	0	0	0	0	115.6	Y494	Y494-G496 PolarHBondContact O-N 3.42Å
497	M	93.9	Very high	92.8	Very high	49 Å²	49	51 Å²	51	24%	0.241	29%	0.29	C	S	.	.			trans	-97.1	135.7	174.9	-60.3	-176.4	-177.3	0	0	111.2	K458 Y494 P495 Q501 A502 Y510	K458-M497 WeakPolarHBondContact CE-O 3.46Å; K458-M497 PolarHBondContact NZ-O 3.42Å; Y494-M497 HydrophobicContact CD1-SD 4.32Å; Y494-M497 PolarHBondContact O-N 3.29Å; Y494-M497 VanDerWaalsContact O-N 3.11Å; P495-M497 PolarHBondContact O-N 3.31Å; M497-Q501 HydrophobicContact CB-CB 4.35Å; M497-A502 HydrophobicContact CB-CB 4.49Å; M497-Y510 HydrophobicContact CE-CE1 4.07Å; M497-Y510 HydrophobicContact CE-CE2 4.46Å
498	T	91.3	Very high	92.7	Very high	79 Å²	79	57.8 Å²	57.8	49%	0.485	32%	0.319	S	S	.	.			trans	-66.4	160.2	163.9	64	0	0	0	0	110.3	R500 Q501 A502	T498-R500 VanDerWaalsContact C-N 3.32Å; T498-R500 PolarHBondContact O-N 3.21Å; T498-Q501 PolarHBondContact O-N 3.23Å; T498-Q501 WeakPolarHBondContact OG1-CB 3.25Å; T498-Q501 VanDerWaalsContact OG1-CD 3.23Å; T498-Q501 VanDerWaalsContact OG1-CG 3.24Å; T498-Q501 WeakPolarHBondContact OG1-CG 3.29Å; T498-Q501 PolarHBondContact OG1-N 3.46Å; T498-Q501 PolarHBondContact OG1-OE1 2.98Å; T498-A502 PolarHBondContact O-N 2.87Å
499	T	87.4	Confident	92.7	Very high	51 Å²	51	58.8 Å²	58.8	31%	0.313	33%	0.334	S	S	.	.	H	α-helix	trans	-53.7	-45.7	177.7	-58.2	0	0	0	0	113.3	I457 A502 V503	I457-T499 HydrophobicContact CB-CG2 3.21Å; I457-T499 HydrophobicContact CD1-CG2 3.4Å; I457-T499 VanDerWaalsContact CD1-CG2 3.4Å; I457-T499 HydrophobicContact CG1-CG2 3.8Å; I457-T499 HydrophobicContact CG2-CG2 3.28Å; T499-A502 PolarHBondContact O-N 3.32Å; T499-V503 PolarHBondContact O-N 3.18Å
500	R	84.8	Confident	92.8	Very high	199 Å²	199	62.2 Å²	62.2	75%	0.751	35%	0.348	S	S	*	.	H	α-helix	trans	-66	-41.2	178.7	-171.9	176.6	-179.7	175.5	1.2	112.3	T498 V503 T504	T498-R500 VanDerWaalsContact C-N 3.32Å; T498-R500 PolarHBondContact O-N 3.21Å; R500-V503 PolarHBondContact O-N 3Å; R500-T504 PolarHBondContact O-N 3.06Å; R500-T504 PolarHBondContact O-OG1 3.39Å
501	Q	92.6	Very high	92.9	Very high	101 Å²	101	63.4 Å²	63.4	47%	0.472	35%	0.352	S	S	.	.	H	α-helix	trans	-63.2	-42.8	176.5	-75.2	166.4	-36.2	0	0	111.6	M497 T498 V503 T504 E505	M497-Q501 HydrophobicContact CB-CB 4.35Å; T498-Q501 PolarHBondContact O-N 3.23Å; T498-Q501 WeakPolarHBondContact OG1-CB 3.25Å; T498-Q501 VanDerWaalsContact OG1-CD 3.23Å; T498-Q501 VanDerWaalsContact OG1-CG 3.24Å; T498-Q501 WeakPolarHBondContact OG1-CG 3.29Å; T498-Q501 PolarHBondContact OG1-N 3.46Å; T498-Q501 PolarHBondContact OG1-OE1 2.98Å; Q501-V503 VanDerWaalsContact C-N 3.33Å; Q501-V503 PolarHBondContact O-N 3.35Å; Q501-T504 PolarHBondContact O-N 3.05Å; Q501-E505 WeakPolarHBondContact O-CG 3.41Å; Q501-E505 PolarHBondContact O-N 2.97Å
502	A	92.6	Very high	93	Very high	3 Å²	3	62.6 Å²	62.6	3%	0.025	34%	0.343	C	S	.	.	H	α-helix	trans	-57.6	-45.6	179.2	0	0	0	0	0	111.7	K458 Y494 M497 T498 T499 E505 V506	K458-A502 HydrophobicContact CG-CB 4.45Å; Y494-A502 HydrophobicContact CD1-CB 4.39Å; Y494-A502 HydrophobicContact CD2-CB 4.19Å; Y494-A502 HydrophobicContact CG-CB 3.99Å; M497-A502 HydrophobicContact CB-CB 4.49Å; T498-A502 PolarHBondContact O-N 2.87Å; T499-A502 PolarHBondContact O-N 3.32Å; A502-E505 PolarHBondContact O-N 3.21Å; A502-V506 VanDerWaalsContact O-CB 3.3Å; A502-V506 WeakPolarHBondContact O-CB 3.3Å; A502-V506 WeakPolarHBondContact O-CG2 3.19Å; A502-V506 PolarHBondContact O-N 3.37Å
503	V	88.2	Confident	93	Very high	27 Å²	27	62.7 Å²	62.7	16%	0.164	35%	0.345	C	S	.	.	H	α-helix	trans	-60.1	-49.2	176.6	177.8	0	0	0	0	111.4	I457 L466 T499 R500 Q501 E505 V506 E507	I457-V503 HydrophobicContact CG2-CG2 3.1Å; L466-V503 HydrophobicContact CD2-CG1 3.69Å; L466-V503 HydrophobicContact CG-CG1 4.15Å; T499-V503 PolarHBondContact O-N 3.18Å; R500-V503 PolarHBondContact O-N 3Å; Q501-V503 VanDerWaalsContact C-N 3.33Å; Q501-V503 PolarHBondContact O-N 3.35Å; V503-E505 VanDerWaalsContact C-N 3.35Å; V503-E505 PolarHBondContact O-N 2.89Å; V503-V506 PolarHBondContact O-N 3.24Å; V503-E507 WeakPolarHBondContact O-CB 3.37Å; V503-E507 PolarHBondContact O-N 2.94Å
504	T	91.5	Very high	93	Very high	56 Å²	56	63.8 Å²	63.8	34%	0.344	35%	0.352	S	S	.	.	H	α-helix	trans	-61.6	-41.1	-178.5	-60.7	0	0	0	0	112.3	R500 Q501 K508	R500-T504 PolarHBondContact O-N 3.06Å; R500-T504 PolarHBondContact O-OG1 3.39Å; Q501-T504 PolarHBondContact O-N 3.05Å; T504-K508 WeakPolarHBondContact O-CG 3.47Å; T504-K508 PolarHBondContact O-N 2.9Å
505	E	95.4	Very high	92.7	Very high	64 Å²	64	63.9 Å²	63.9	30%	0.299	35%	0.353	S	S	.	.	H	α-helix	trans	-72.1	-40.5	178.4	-66.9	-53.8	126.1	0	0	111.7	Q501 A502 V503 E507 K508 G509 Y510	Q501-E505 WeakPolarHBondContact O-CG 3.41Å; Q501-E505 PolarHBondContact O-N 2.97Å; A502-E505 PolarHBondContact O-N 3.21Å; V503-E505 VanDerWaalsContact C-N 3.35Å; V503-E505 PolarHBondContact O-N 2.89Å; E505-E507 VanDerWaalsContact C-N 3.29Å; E505-E507 PolarHBondContact O-N 2.94Å; E505-K508 WeakPolarHBondContact O-CB 3.4Å; E505-K508 PolarHBondContact O-N 3.22Å; E505-K508 VanDerWaalsContact O-N 3.1Å; E505-K508 IonicContact OE1-NZ 2.83Å; E505-K508 PolarHBondContact OE1-NZ 3.31Å; E505-G509 PolarHBondContact O-N 3.47Å; E505-Y510 HydrophobicContact CB-CD1 4.37Å; E505-Y510 HydrophobicContact CB-CG 4.23Å; E505-Y510 WeakPolarHBondContact O-CB 3.49Å; E505-Y510 PolarHBondContact O-N 2.99Å
506	V	95.2	Very high	91.9	Very high	10 Å²	10	65.7 Å²	65.7	6%	0.061	35%	0.354	C	S	.	.	H	α-helix	trans	-60	-40.5	176.1	165.3	0	0	0	0	111.8	P462 W477 Y494 A502 V503 K508 G509 R511	P462-V506 HydrophobicContact CB-CG1 4.24Å; P462-V506 HydrophobicContact CG-CG1 4.28Å; W477-V506 HydrophobicContact CH2-CG1 3.47Å; W477-V506 VanDerWaalsContact CH2-CG1 3.47Å; W477-V506 HydrophobicContact CZ2-CG1 3.48Å; W477-V506 VanDerWaalsContact CZ2-CG1 3.48Å; W477-V506 HydrophobicContact CZ2-CG2 4.47Å; Y494-V506 HydrophobicContact CE1-CG2 3.69Å; Y494-V506 WeakPolarHBondContact OH-CG2 3.17Å; A502-V506 VanDerWaalsContact O-CB 3.3Å; A502-V506 WeakPolarHBondContact O-CB 3.3Å; A502-V506 WeakPolarHBondContact O-CG2 3.19Å; A502-V506 PolarHBondContact O-N 3.37Å; V503-V506 PolarHBondContact O-N 3.24Å; V506-K508 VanDerWaalsContact C-N 3.31Å; V506-K508 PolarHBondContact O-N 3.39Å; V506-G509 PolarHBondContact O-N 3.47Å; V506-R511 PolarHBondContact O-NH1 3.44Å
507	E	91.5	Very high	91	Very high	121 Å²	121	63.1 Å²	63.1	57%	0.565	32%	0.321	S	S	*	.	H	α-helix	trans	-62	-37.8	175.1	-173.3	180	-162.2	0	0	111.9	L466 V503 E505 G509	L466-E507 HydrophobicContact CD1-CB 4.37Å; L466-E507 HydrophobicContact CD1-CG 4.02Å; V503-E507 WeakPolarHBondContact O-CB 3.37Å; V503-E507 PolarHBondContact O-N 2.94Å; E505-E507 VanDerWaalsContact C-N 3.29Å; E505-E507 PolarHBondContact O-N 2.94Å; E507-G509 PolarHBondContact O-N 3.23Å; E507-G509 VanDerWaalsContact O-N 3.17Å
508	K	94.7	Very high	90	Very high	147 Å²	147	66.7 Å²	66.7	64%	0.639	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-2.5	173.4	-66.1	170.6	-170.6	168.5	0	114	T504 E505 V506	T504-K508 WeakPolarHBondContact O-CG 3.47Å; T504-K508 PolarHBondContact O-N 2.9Å; E505-K508 WeakPolarHBondContact O-CB 3.4Å; E505-K508 PolarHBondContact O-N 3.22Å; E505-K508 VanDerWaalsContact O-N 3.1Å; E505-K508 IonicContact OE1-NZ 2.83Å; E505-K508 PolarHBondContact OE1-NZ 3.31Å; V506-K508 VanDerWaalsContact C-N 3.31Å; V506-K508 PolarHBondContact O-N 3.39Å
509	G	94.9	Very high	88.9	Confident	46 Å²	46	68.7 Å²	68.7	47%	0.474	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	98	3.5	-179.9	0	0	0	0	0	114.7	E505 V506 E507	E505-G509 PolarHBondContact O-N 3.47Å; V506-G509 PolarHBondContact O-N 3.47Å; E507-G509 PolarHBondContact O-N 3.23Å; E507-G509 VanDerWaalsContact O-N 3.17Å
510	Y	96.9	Very high	88.3	Confident	81 Å²	81	69.7 Å²	69.7	32%	0.318	36%	0.355	S	S	.	.			trans	-61.5	141.7	172.1	178.1	-93.8	0	0	0	110.4	Y494 M497 E505 P513	Y494-Y510 HydrophobicContact CD1-CD1 4.32Å; Y494-Y510 AromaticContact CD1-CE1 3.82Å; Y494-Y510 HydrophobicContact CD1-CE1 3.82Å; Y494-Y510 HydrophobicContact CE1-CD1 4.13Å; Y494-Y510 AromaticContact CE1-CE1 3.93Å; Y494-Y510 HydrophobicContact CE1-CE1 3.93Å; M497-Y510 HydrophobicContact CE-CE1 4.07Å; M497-Y510 HydrophobicContact CE-CE2 4.46Å; E505-Y510 HydrophobicContact CB-CD1 4.37Å; E505-Y510 HydrophobicContact CB-CG 4.23Å; E505-Y510 WeakPolarHBondContact O-CB 3.49Å; E505-Y510 PolarHBondContact O-N 2.99Å; Y510-P513 WeakPolarHBondContact OH-CD 3.43Å
511	R	96.6	Very high	88.2	Confident	25 Å²	25	64.7 Å²	64.7	9%	0.094	35%	0.348	C	S	.	.			trans	-134	152.2	171.7	-62.1	-62.1	-179.1	-93.2	3.9	108.5	V506 W534	V506-R511 PolarHBondContact O-NH1 3.44Å; R511-W534 HydrophobicContact CB-CE3 4.31Å; R511-W534 PolarHBondContact NE-O 3.24Å; R511-W534 PolarHBondContact NH2-O 3Å; R511-W534 VanDerWaalsContact NH2-O 3.08Å
512	L	95.3	Very high	88.1	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-55.6	137.5	175.5	-74.7	167.3	0	0	0	109.9	I481 Y484 P493 Y494 Y527 W534	I481-L512 HydrophobicContact CD1-CD1 3.89Å; Y484-L512 HydrophobicContact CD1-CD1 4.38Å; Y484-L512 HydrophobicContact CD2-CB 4.45Å; Y484-L512 HydrophobicContact CD2-CD1 3.94Å; Y484-L512 HydrophobicContact CE2-CD1 4.26Å; Y484-L512 HydrophobicContact CE2-CD2 4.44Å; Y484-L512 HydrophobicContact CG-CD1 4.01Å; P493-L512 HydrophobicContact CB-CD1 4.32Å; Y494-L512 HydrophobicContact CD1-CD2 3.58Å; Y494-L512 HydrophobicContact CD1-CG 3.91Å; Y494-L512 HydrophobicContact CD2-CD1 4.46Å; Y494-L512 HydrophobicContact CD2-CD2 4.45Å; Y494-L512 HydrophobicContact CE1-CD1 4.26Å; Y494-L512 HydrophobicContact CE1-CD2 3.87Å; Y494-L512 HydrophobicContact CE1-CG 3.63Å; Y494-L512 HydrophobicContact CE2-CD1 4.12Å; Y494-L512 HydrophobicContact CE2-CG 4.38Å; Y494-L512 HydrophobicContact CG-CD2 3.89Å; Y494-L512 HydrophobicContact CG-CG 4.39Å; L512-Y527 WeakPolarHBondContact O-CE2 3.36Å; L512-Y527 PolarHBondContact O-OH 3.07Å; L512-W534 HydrophobicContact CB-CH2 3.85Å; L512-W534 HydrophobicContact CB-CZ3 3.96Å; L512-W534 HydrophobicContact CD1-CH2 4.15Å; L512-W534 HydrophobicContact CD1-CZ2 4.26Å
513	P	94.3	Very high	88	Confident	76 Å²	76	61.6 Å²	61.6	49%	0.494	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-67.7	166.5	171.4	31.2	-35.4	0	0	0	110.4	Y510 P515	Y510-P513 WeakPolarHBondContact OH-CD 3.43Å; P513-P515 WeakPolarHBondContact O-CD 3.24Å
514	C	94.4	Very high	88.2	Confident	23 Å²	23	65.5 Å²	65.5	16%	0.155	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-56.1	122.9	175.7	-169.6	0	0	0	0	109.9	H516 Y527	C514-H516 PolarHBondContact O-CD2 3.48Å; C514-H516 PolarHBondContact O-N 2.84Å; C514-Y527 HydrophobicContact CB-CD1 3.91Å; C514-Y527 HydrophobicContact CB-CD2 3.91Å; C514-Y527 HydrophobicContact CB-CE1 4.1Å; C514-Y527 HydrophobicContact CB-CE2 4.11Å; C514-Y527 HydrophobicContact CB-CG 3.8Å; C514-Y527 VanDerWaalsContact N-CE2 3.34Å
515	P	90	Very high	88.3	Confident	6 Å²	6	64.2 Å²	64.2	4%	0.039	35%	0.348	C	S	.	.			trans	-71.3	111.1	179.9	24.7	-28.5	0	0	0	109.7	Y484 V487 T488 P513 C522 M530	Y484-P515 HydrophobicContact CD2-CB 3.77Å; Y484-P515 HydrophobicContact CD2-CG 3.94Å; Y484-P515 HydrophobicContact CE2-CB 3.76Å; Y484-P515 HydrophobicContact CE2-CG 4.41Å; V487-P515 HydrophobicContact CB-CG 4.37Å; V487-P515 HydrophobicContact CG1-CB 4.43Å; V487-P515 HydrophobicContact CG1-CG 4.08Å; T488-P515 HydrophobicContact CG2-CB 3.52Å; P513-P515 WeakPolarHBondContact O-CD 3.24Å; P515-C522 HydrophobicContact CG-CB 3.96Å; P515-C522 WeakPolarHBondContact O-CB 3.49Å; P515-C522 PolarHBondContact O-N 2.69Å; P515-M530 HydrophobicContact CG-CE 4.2Å; P515-M530 HydrophobicContact CG-SD 4.33Å
516	H	76.5	Confident	88.3	Confident	125 Å²	125	61.2 Å²	61.2	58%	0.579	33%	0.334	S	S	*	.	B	Isolated β-bridge	trans	-105.8	121.7	169.5	-61.9	-68.8	0	0	0	109.1	C514	C514-H516 PolarHBondContact O-CD2 3.48Å; C514-H516 PolarHBondContact O-N 2.84Å
517	T	73.7	Confident	88.4	Confident	35 Å²	35	62.4 Å²	62.4	22%	0.215	34%	0.338	C	S	.	.			trans	-93.7	157.8	163.1	68.2	0	0	0	0	108.7	E519 H520	T517-E519 PolarHBondContact O-N 3.38Å; T517-H520 PolarHBondContact N-O 3.32Å; T517-H520 PolarHBondContact OG1-N 3.25Å; T517-H520 PolarHBondContact OG1-O 3.37Å
518	S	71.3	Confident	88.6	Confident	125 Å²	125	60.5 Å²	60.5	87%	0.874	33%	0.332	S	S	*	.	S	Bend	trans	-61.6	-23.5	176.1	44.3	0	0	0	0	113.2
519	E	69.8	Low	88.7	Confident	121 Å²	121	54.2 Å²	54.2	57%	0.565	31%	0.305	S	S	*	.	S	Bend	trans	-99	-36	-172.5	-65.7	169.9	175.7	0	0	111.7	T517	T517-E519 PolarHBondContact O-N 3.38Å
520	H	73.3	Confident	88.9	Confident	72 Å²	72	52 Å²	52	33%	0.333	28%	0.282	S	S	.	.			trans	-140.2	107.7	-176	-59.6	-60.3	0	0	0	111.1	Y489 T517 C522	Y489-H520 PolarHBondContact OH-CD2 3.03Å; T517-H520 PolarHBondContact N-O 3.32Å; T517-H520 PolarHBondContact OG1-N 3.25Å; T517-H520 PolarHBondContact OG1-O 3.37Å; H520-C522 PolarHBondContact O-N 3.16Å
521	P	82.6	Confident	88.9	Confident	93 Å²	93	53.7 Å²	53.7	60%	0.604	29%	0.288	S	S	*	.	B	Isolated β-bridge	trans	-67.2	131.9	170.4	26.7	-30.8	0	0	0	109.6	P523	P521-P523 WeakPolarHBondContact O-CD 3.49Å
522	C	91.2	Very high	89	Confident	5 Å²	5	58.3 Å²	58.3	3%	0.034	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-61.5	128.4	170.6	180	0	0	0	0	109.7	V487 P515 H520	V487-C522 HydrophobicContact CG1-CB 3.86Å; P515-C522 HydrophobicContact CG-CB 3.96Å; P515-C522 WeakPolarHBondContact O-CB 3.49Å; P515-C522 PolarHBondContact O-N 2.69Å; H520-C522 PolarHBondContact O-N 3.16Å
523	P	91.6	Very high	89.2	Confident	35 Å²	35	58.3 Å²	58.3	23%	0.227	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-60.3	145.2	172.8	-20.2	30.3	0	0	0	111.6	L392 P521 D525 L526 Y527	L392-P523 HydrophobicContact CD1-CG 4.37Å; L392-P523 HydrophobicContact CD2-CG 3.5Å; P521-P523 WeakPolarHBondContact O-CD 3.49Å; P523-D525 VanDerWaalsContact C-N 3.27Å; P523-D525 PolarHBondContact O-N 3.28Å; P523-L526 HydrophobicContact CB-CB 4.31Å; P523-L526 HydrophobicContact CG-CB 4.48Å; P523-L526 WeakPolarHBondContact O-CB 3.49Å; P523-L526 PolarHBondContact O-N 3.07Å; P523-L526 VanDerWaalsContact O-N 3.13Å; P523-Y527 PolarHBondContact O-N 3.41Å
524	D	92.5	Very high	89.3	Confident	109 Å²	109	54.8 Å²	54.8	58%	0.583	29%	0.285	S	S	*	.	H	α-helix	trans	-60.3	-38.5	178	-71.5	-27.6	0	0	0	111.7	L526 Y527 N528	D524-L526 VanDerWaalsContact C-N 3.28Å; D524-L526 PolarHBondContact O-N 3.23Å; D524-Y527 PolarHBondContact O-N 3.15Å; D524-N528 WeakPolarHBondContact O-CB 3.5Å; D524-N528 PolarHBondContact O-N 2.85Å; D524-N528 PolarHBondContact O-ND2 2.96Å
525	D	93	Very high	89.5	Confident	29 Å²	29	56.2 Å²	56.2	16%	0.155	29%	0.292	C	S	.	.	H	α-helix	trans	-60.1	-39.3	177	-66.6	-33.8	0	0	0	112.5	P523 N528 L529 W554 T558 Q561	P523-D525 VanDerWaalsContact C-N 3.27Å; P523-D525 PolarHBondContact O-N 3.28Å; D525-N528 PolarHBondContact O-N 3Å; D525-L529 PolarHBondContact O-N 3.16Å; D525-W554 HydrophobicContact CB-CH2 3.93Å; D525-W554 HydrophobicContact CB-CZ2 4.27Å; D525-T558 HydrophobicContact CB-CG2 4.41Å; D525-Q561 PolarHBondContact OD1-OE1 2.75Å
526	L	95.2	Very high	89.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-70.6	-43	179.3	-179.5	58.3	0	0	0	110.2	L392 I396 M399 M483 V487 P523 D524 N528 L529 M530 F551 W554	L392-L526 HydrophobicContact CD1-CD2 4.45Å; I396-L526 HydrophobicContact CD1-CD1 4.05Å; I396-L526 HydrophobicContact CD1-CD2 4.07Å; M399-L526 HydrophobicContact CE-CD2 4.19Å; M399-L526 HydrophobicContact SD-CD1 3.9Å; M399-L526 HydrophobicContact SD-CD2 4.49Å; M483-L526 HydrophobicContact SD-CD1 4.39Å; V487-L526 HydrophobicContact CG2-CD2 3.57Å; P523-L526 HydrophobicContact CB-CB 4.31Å; P523-L526 HydrophobicContact CG-CB 4.48Å; P523-L526 WeakPolarHBondContact O-CB 3.49Å; P523-L526 PolarHBondContact O-N 3.07Å; P523-L526 VanDerWaalsContact O-N 3.13Å; D524-L526 VanDerWaalsContact C-N 3.28Å; D524-L526 PolarHBondContact O-N 3.23Å; L526-N528 VanDerWaalsContact C-N 3.34Å; L526-N528 PolarHBondContact O-N 2.99Å; L526-L529 WeakPolarHBondContact O-CB 3.47Å; L526-L529 PolarHBondContact O-N 3.08Å; L526-L529 VanDerWaalsContact O-N 3.17Å; L526-M530 HydrophobicContact CD2-CE 4.27Å; L526-M530 HydrophobicContact CG-CE 3.93Å; L526-M530 WeakPolarHBondContact O-CG 3.35Å; L526-M530 PolarHBondContact O-N 3.17Å; L526-F551 HydrophobicContact CD1-CE1 3.79Å; L526-F551 HydrophobicContact CD1-CZ 4.15Å; L526-W554 HydrophobicContact CB-CH2 3.73Å; L526-W554 HydrophobicContact CB-CZ2 4.07Å; L526-W554 HydrophobicContact CD1-CH2 4.22Å
527	Y	96.4	Very high	90.8	Very high	36 Å²	36	58.8 Å²	58.8	14%	0.141	31%	0.313	C	S	.	.	H	α-helix	trans	-64.7	-39	175.1	178.6	-116.8	0	0	0	112.1	L512 C514 P523 D524 L529 M530 R531 W534	L512-Y527 WeakPolarHBondContact O-CE2 3.36Å; L512-Y527 PolarHBondContact O-OH 3.07Å; C514-Y527 HydrophobicContact CB-CD1 3.91Å; C514-Y527 HydrophobicContact CB-CD2 3.91Å; C514-Y527 HydrophobicContact CB-CE1 4.1Å; C514-Y527 HydrophobicContact CB-CE2 4.11Å; C514-Y527 HydrophobicContact CB-CG 3.8Å; C514-Y527 VanDerWaalsContact N-CE2 3.34Å; P523-Y527 PolarHBondContact O-N 3.41Å; D524-Y527 PolarHBondContact O-N 3.15Å; Y527-L529 PolarHBondContact O-N 3.24Å; Y527-M530 HydrophobicContact CD2-SD 4.29Å; Y527-M530 WeakPolarHBondContact O-CB 3.38Å; Y527-M530 PolarHBondContact O-N 3.49Å; Y527-M530 VanDerWaalsContact O-N 3.16Å; Y527-R531 HydrophobicContact CD1-CG 4.26Å; Y527-R531 HydrophobicContact CD2-CG 4.42Å; Y527-R531 HydrophobicContact CE1-CG 3.91Å; Y527-R531 HydrophobicContact CE2-CG 4.07Å; Y527-R531 VanDerWaalsContact O-CG 3.29Å; Y527-R531 WeakPolarHBondContact O-CG 3.48Å; Y527-R531 PolarHBondContact O-N 3.44Å; Y527-W534 HydrophobicContact CE2-CZ3 4.29Å
528	N	96.5	Very high	91.9	Very high	81 Å²	81	58.8 Å²	58.8	43%	0.433	31%	0.313	S	S	.	.	H	α-helix	trans	-60.3	-36.6	173.5	-74.3	-30.5	0	0	0	111.4	D524 D525 L526 R531 K532	D524-N528 WeakPolarHBondContact O-CB 3.5Å; D524-N528 PolarHBondContact O-N 2.85Å; D524-N528 PolarHBondContact O-ND2 2.96Å; D525-N528 PolarHBondContact O-N 3Å; L526-N528 VanDerWaalsContact C-N 3.34Å; L526-N528 PolarHBondContact O-N 2.99Å; N528-R531 PolarHBondContact O-N 3.07Å; N528-K532 WeakPolarHBondContact O-CG 3.37Å; N528-K532 PolarHBondContact O-N 3.24Å
529	L	97	Very high	93.2	Very high	14 Å²	14	59 Å²	59	7%	0.073	30%	0.3	C	S	.	.	H	α-helix	trans	-67.5	-42.9	173.8	-162.3	63.1	0	0	0	112.3	M483 D525 L526 Y527 R531 K532 C533 L547 V550 F551	M483-L529 HydrophobicContact CE-CD2 4.39Å; D525-L529 PolarHBondContact O-N 3.16Å; L526-L529 WeakPolarHBondContact O-CB 3.47Å; L526-L529 PolarHBondContact O-N 3.08Å; L526-L529 VanDerWaalsContact O-N 3.17Å; Y527-L529 PolarHBondContact O-N 3.24Å; L529-R531 VanDerWaalsContact C-N 3.3Å; L529-R531 PolarHBondContact O-N 3.42Å; L529-K532 HydrophobicContact CD1-CD 4.45Å; L529-K532 WeakPolarHBondContact O-CB 3.38Å; L529-K532 PolarHBondContact O-N 3.34Å; L529-C533 PolarHBondContact O-N 3.13Å; L529-C533 PolarHBondContact O-SG 3.35Å; L529-L547 HydrophobicContact CD1-CD2 3.63Å; L529-L547 HydrophobicContact CD2-CD2 3.91Å; L529-L547 HydrophobicContact CG-CD2 3.76Å; L529-V550 HydrophobicContact CD2-CG1 4Å; L529-F551 HydrophobicContact CD2-CE1 3.87Å; L529-F551 HydrophobicContact CD2-CE2 3.8Å; L529-F551 HydrophobicContact CD2-CZ 3.39Å
530	M	98.1	Very high	94.5	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-57.6	-44.7	171.8	-63.8	173.2	-170.7	0	0	110.9	M483 V487 P515 L526 Y527 K532 C533 W534	M483-M530 HydrophobicContact CB-CE 3.58Å; M483-M530 HydrophobicContact CB-CG 3.92Å; M483-M530 HydrophobicContact CB-SD 4.37Å; M483-M530 HydrophobicContact SD-CG 3.79Å; V487-M530 HydrophobicContact CG2-CE 3.93Å; P515-M530 HydrophobicContact CG-CE 4.2Å; P515-M530 HydrophobicContact CG-SD 4.33Å; L526-M530 HydrophobicContact CD2-CE 4.27Å; L526-M530 HydrophobicContact CG-CE 3.93Å; L526-M530 WeakPolarHBondContact O-CG 3.35Å; L526-M530 PolarHBondContact O-N 3.17Å; Y527-M530 HydrophobicContact CD2-SD 4.29Å; Y527-M530 WeakPolarHBondContact O-CB 3.38Å; Y527-M530 PolarHBondContact O-N 3.49Å; Y527-M530 VanDerWaalsContact O-N 3.16Å; M530-K532 VanDerWaalsContact C-N 3.34Å; M530-K532 PolarHBondContact O-N 3.09Å; M530-C533 WeakPolarHBondContact O-CA 3.47Å; M530-C533 WeakPolarHBondContact O-CB 3.47Å; M530-C533 PolarHBondContact O-N 3.37Å; M530-C533 VanDerWaalsContact O-N 3.08Å; M530-W534 HydrophobicContact CB-CE3 4.24Å; M530-W534 HydrophobicContact CB-CH2 3.74Å; M530-W534 HydrophobicContact CB-CZ2 4.05Å; M530-W534 HydrophobicContact CB-CZ3 3.85Å; M530-W534 HydrophobicContact CG-CH2 4.34Å; M530-W534 VanDerWaalsContact O-CD2 3.29Å; M530-W534 PolarHBondContact O-N 3.17Å; M530-W534 HydrophobicContact SD-CH2 4.11Å
531	R	98.1	Very high	95.7	Very high	116 Å²	116	54.4 Å²	54.4	44%	0.438	28%	0.282	S	S	.	.	H	α-helix	trans	-61	-39.8	177.6	-71.3	-68.5	-61.8	-137.2	-1.3	112.6	Y527 N528 L529 C533 W534 D535	Y527-R531 HydrophobicContact CD1-CG 4.26Å; Y527-R531 HydrophobicContact CD2-CG 4.42Å; Y527-R531 HydrophobicContact CE1-CG 3.91Å; Y527-R531 HydrophobicContact CE2-CG 4.07Å; Y527-R531 VanDerWaalsContact O-CG 3.29Å; Y527-R531 WeakPolarHBondContact O-CG 3.48Å; Y527-R531 PolarHBondContact O-N 3.44Å; N528-R531 PolarHBondContact O-N 3.07Å; L529-R531 VanDerWaalsContact C-N 3.3Å; L529-R531 PolarHBondContact O-N 3.42Å; R531-C533 VanDerWaalsContact C-N 3.35Å; R531-W534 CarbonylContact O-C 3.48Å; R531-W534 PolarHBondContact O-N 2.87Å; R531-D535 PolarHBondContact O-N 3.09Å
532	K	98.1	Very high	96.5	Very high	123 Å²	123	51 Å²	51	54%	0.535	26%	0.26	S	S	.	.	H	α-helix	trans	-63.5	-39.4	172.3	-72.1	172.9	-177.6	176.9	0	111.8	N528 L529 M530 W534 D535	N528-K532 WeakPolarHBondContact O-CG 3.37Å; N528-K532 PolarHBondContact O-N 3.24Å; L529-K532 HydrophobicContact CD1-CD 4.45Å; L529-K532 WeakPolarHBondContact O-CB 3.38Å; L529-K532 PolarHBondContact O-N 3.34Å; M530-K532 VanDerWaalsContact C-N 3.34Å; M530-K532 PolarHBondContact O-N 3.09Å; K532-W534 PolarHBondContact O-N 2.98Å; K532-D535 PolarHBondContact O-N 3.35Å
533	C	98.7	Very high	96.8	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.1	-28.8	174.9	-62.9	0	0	0	0	112.5	V476 L529 M530 R531 R541	V476-C533 HydrophobicContact CG1-CB 4.07Å; V476-C533 WeakPolarHBondContact O-CB 3.36Å; L529-C533 PolarHBondContact O-N 3.13Å; L529-C533 PolarHBondContact O-SG 3.35Å; M530-C533 WeakPolarHBondContact O-CA 3.47Å; M530-C533 WeakPolarHBondContact O-CB 3.47Å; M530-C533 PolarHBondContact O-N 3.37Å; M530-C533 VanDerWaalsContact O-N 3.08Å; R531-C533 VanDerWaalsContact C-N 3.35Å; C533-R541 VanDerWaalsContact O-CD 3.24Å; C533-R541 WeakPolarHBondContact O-CD 3.37Å; C533-R541 WeakPolarHBondContact O-CG 3.4Å
534	W	98.3	Very high	97.1	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.008	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	23.2	178.2	-52.2	-38.7	0	0	0	114.5	W477 G480 I481 R511 L512 Y527 M530 R531 K532 A536	W477-W534 AromaticContact CD2-CD1 3.8Å; W477-W534 AromaticContact CE2-CD1 3.87Å; W477-W534 HydrophobicContact CE3-CB 4.12Å; W477-W534 HydrophobicContact CH2-CB 4.06Å; W477-W534 HydrophobicContact CZ2-CB 4.48Å; W477-W534 HydrophobicContact CZ3-CB 3.88Å; W477-W534 WeakPolarHBondContact CZ3-O 3.28Å; W477-W534 PolarHBondContact O-NE1 3.02Å; G480-W534 VanDerWaalsContact C-CZ2 3.48Å; G480-W534 VanDerWaalsContact O-CZ2 3.23Å; G480-W534 WeakPolarHBondContact O-CZ2 3.43Å; I481-W534 HydrophobicContact CD1-CZ2 3.7Å; I481-W534 HydrophobicContact CG1-CZ2 4.48Å; R511-W534 HydrophobicContact CB-CE3 4.31Å; R511-W534 PolarHBondContact NE-O 3.24Å; R511-W534 PolarHBondContact NH2-O 3Å; R511-W534 VanDerWaalsContact NH2-O 3.08Å; L512-W534 HydrophobicContact CB-CH2 3.85Å; L512-W534 HydrophobicContact CB-CZ3 3.96Å; L512-W534 HydrophobicContact CD1-CH2 4.15Å; L512-W534 HydrophobicContact CD1-CZ2 4.26Å; Y527-W534 HydrophobicContact CE2-CZ3 4.29Å; M530-W534 HydrophobicContact CB-CE3 4.24Å; M530-W534 HydrophobicContact CB-CH2 3.74Å; M530-W534 HydrophobicContact CB-CZ2 4.05Å; M530-W534 HydrophobicContact CB-CZ3 3.85Å; M530-W534 HydrophobicContact CG-CH2 4.34Å; M530-W534 VanDerWaalsContact O-CD2 3.29Å; M530-W534 PolarHBondContact O-N 3.17Å; M530-W534 HydrophobicContact SD-CH2 4.11Å; R531-W534 CarbonylContact O-C 3.48Å; R531-W534 PolarHBondContact O-N 2.87Å; K532-W534 PolarHBondContact O-N 2.98Å; W534-A536 PolarHBondContact O-N 2.96Å
535	D	98.1	Very high	97.2	Very high	54 Å²	54	51.3 Å²	51.3	29%	0.289	25%	0.254	S	S	.	.			trans	-57	138.4	171.3	-162.7	-58.2	0	0	0	109.9	R531 K532 K537 N540 R541	R531-D535 PolarHBondContact O-N 3.09Å; K532-D535 PolarHBondContact O-N 3.35Å; D535-K537 PolarHBondContact O-N 3.1Å; D535-K537 PolarHBondContact OD1-N 3.24Å; D535-N540 HydrophobicContact CB-CB 3.97Å; D535-N540 VanDerWaalsContact CG-CB 3.42Å; D535-N540 PolarHBondContact OD1-ND2 3.01Å; D535-N540 WeakPolarHBondContact OD2-CB 2.97Å; D535-N540 PolarHBondContact OD2-ND2 2.81Å; D535-R541 HydrophobicContact CB-CG 4.07Å; D535-R541 PolarHBondContact O-NE 3.23Å; D535-R541 PolarHBondContact O-NH2 2.95Å
536	A	96.5	Very high	97.4	Very high	66 Å²	66	52.3 Å²	52.3	55%	0.545	26%	0.263	S	S	.	.	S	Bend	trans	-62.3	-33.6	178.9	0	0	0	0	0	111.7	W534 P538	W534-A536 PolarHBondContact O-N 2.96Å; A536-P538 WeakPolarHBondContact O-CD 3.27Å
537	K	96.9	Very high	97.5	Very high	119 Å²	119	52.3 Å²	52.3	52%	0.517	26%	0.263	S	S	.	.	S	Bend	trans	-88.8	116.7	175.2	-68.7	-173.6	178.5	-174	0	110.1	D535 E539 N540	D535-K537 PolarHBondContact O-N 3.1Å; D535-K537 PolarHBondContact OD1-N 3.24Å; K537-E539 HydrophobicContact CB-CG 4.4Å; K537-E539 PolarHBondContact O-N 3.44Å; K537-N540 HydrophobicContact CB-CB 4.25Å; K537-N540 WeakPolarHBondContact O-CB 3.49Å; K537-N540 PolarHBondContact O-N 2.7Å; K537-N540 VanDerWaalsContact O-N 3.09Å
538	P	97.7	Very high	97.4	Very high	34 Å²	34	51.1 Å²	51.1	22%	0.221	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-54.8	-36.7	-178.9	-27	35.5	0	0	0	114.1	E463 K473 A536 N540 R541	E463-P538 HydrophobicContact CG-CG 4.02Å; K473-P538 HydrophobicContact CB-CB 3.84Å; K473-P538 WeakPolarHBondContact CD-O 3.39Å; K473-P538 HydrophobicContact CG-CB 4.46Å; K473-P538 WeakPolarHBondContact CG-O 3.49Å; A536-P538 WeakPolarHBondContact O-CD 3.27Å; P538-N540 VanDerWaalsContact C-N 3.29Å; P538-N540 PolarHBondContact O-N 3.07Å; P538-R541 WeakPolarHBondContact O-CB 3.35Å; P538-R541 PolarHBondContact O-N 3.21Å
539	E	96.9	Very high	97.2	Very high	130 Å²	130	50.7 Å²	50.7	61%	0.607	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-66.8	-24.7	-179.9	61.5	-86.6	-162	0	0	114.2	K537 R541	K537-E539 HydrophobicContact CB-CG 4.4Å; K537-E539 PolarHBondContact O-N 3.44Å; E539-R541 VanDerWaalsContact C-N 3.32Å
540	N	98.1	Very high	97	Very high	93 Å²	93	51.2 Å²	51.2	50%	0.497	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-80.1	-17.2	176.7	-73.5	-5.5	0	0	0	112.6	D535 K537 P538	D535-N540 HydrophobicContact CB-CB 3.97Å; D535-N540 VanDerWaalsContact CG-CB 3.42Å; D535-N540 PolarHBondContact OD1-ND2 3.01Å; D535-N540 WeakPolarHBondContact OD2-CB 2.97Å; D535-N540 PolarHBondContact OD2-ND2 2.81Å; K537-N540 HydrophobicContact CB-CB 4.25Å; K537-N540 WeakPolarHBondContact O-CB 3.49Å; K537-N540 PolarHBondContact O-N 2.7Å; K537-N540 VanDerWaalsContact O-N 3.09Å; P538-N540 VanDerWaalsContact C-N 3.29Å; P538-N540 PolarHBondContact O-N 3.07Å
541	R	98.6	Very high	96.8	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.015	26%	0.262	C	S	.	.	S	Bend	trans	-68.4	145.5	179.2	-56.7	174.6	-169	153.4	8.1	109.1	E463 K473 V476 C533 D535 P538 E539	E463-R541 IonicContact OE1-CZ 3.54Å; E463-R541 IonicContact OE1-NH1 2.71Å; E463-R541 PolarHBondContact OE1-NH1 2.74Å; E463-R541 IonicContact OE1-NH2 3.17Å; E463-R541 PolarHBondContact OE1-NH2 3.01Å; E463-R541 IonicContact OE2-CZ 2.71Å; E463-R541 IonicContact OE2-NH1 2.69Å; E463-R541 IonicContact OE2-NH2 2.83Å; E463-R541 PolarHBondContact OE2-NH2 3.28Å; K473-R541 HydrophobicContact CD-CB 4.35Å; K473-R541 PolarHBondContact NZ-O 3.11Å; K473-R541 WeakPolarHBondContact O-CD 3.48Å; K473-R541 PolarHBondContact O-NH1 3.41Å; V476-R541 HydrophobicContact CB-CB 4.48Å; V476-R541 HydrophobicContact CG1-CB 3.9Å; C533-R541 VanDerWaalsContact O-CD 3.24Å; C533-R541 WeakPolarHBondContact O-CD 3.37Å; C533-R541 WeakPolarHBondContact O-CG 3.4Å; D535-R541 HydrophobicContact CB-CG 4.07Å; D535-R541 PolarHBondContact O-NE 3.23Å; D535-R541 PolarHBondContact O-NH2 2.95Å; P538-R541 WeakPolarHBondContact O-CB 3.35Å; P538-R541 PolarHBondContact O-N 3.21Å; E539-R541 VanDerWaalsContact C-N 3.32Å
542	P	98.4	Very high	96.3	Very high	22 Å²	22	48.1 Å²	48.1	14%	0.143	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-62.2	167.3	179.6	26.2	-34.2	0	0	0	112.3	K473 V476 L547	K473-P542 PolarHBondContact NZ-O 3.39Å; V476-P542 HydrophobicContact CG1-CG 4.08Å; V476-P542 WeakPolarHBondContact CG2-O 3.36Å; P542-L547 HydrophobicContact CB-CD2 4.17Å; P542-L547 HydrophobicContact CB-CG 4.07Å; P542-L547 HydrophobicContact CG-CD1 4.02Å; P542-L547 HydrophobicContact CG-CD2 3.72Å; P542-L547 HydrophobicContact CG-CG 3.9Å
543	T	98.3	Very high	95.7	Very high	56 Å²	56	45 Å²	45	34%	0.344	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-84.6	157.6	166.8	56.5	0	0	0	0	109.7	R545 S546 L547	T543-R545 PolarHBondContact O-N 2.83Å; T543-S546 PolarHBondContact O-N 3.32Å; T543-S546 WeakPolarHBondContact OG1-CB 3.34Å; T543-S546 PolarHBondContact OG1-N 3.08Å; T543-S546 VanDerWaalsContact OG1-N 3.15Å; T543-L547 WeakPolarHBondContact O-CG 3.43Å; T543-L547 PolarHBondContact O-N 3.47Å
544	F	98.2	Very high	95.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.5	-33.1	174.4	-83.3	-68.7	0	0	0	111.7	M406 E410 L419 I472 D475 V476 F479 S546 L547 C548	M406-F544 HydrophobicContact CB-CB 4.19Å; M406-F544 HydrophobicContact CB-CD1 3.3Å; M406-F544 HydrophobicContact CB-CD2 3.76Å; M406-F544 HydrophobicContact CB-CE1 3.4Å; M406-F544 HydrophobicContact CB-CE2 3.86Å; M406-F544 HydrophobicContact CB-CG 3.48Å; M406-F544 VanDerWaalsContact CB-CG 3.48Å; M406-F544 HydrophobicContact CB-CZ 3.68Å; M406-F544 HydrophobicContact CE-CD2 4.28Å; M406-F544 HydrophobicContact CE-CE1 4.47Å; M406-F544 HydrophobicContact CE-CE2 3.55Å; M406-F544 HydrophobicContact CE-CZ 3.66Å; M406-F544 HydrophobicContact CG-CD1 4.16Å; M406-F544 HydrophobicContact CG-CE1 3.75Å; M406-F544 HydrophobicContact CG-CE2 4.41Å; M406-F544 HydrophobicContact CG-CZ 3.89Å; E410-F544 PolarHBondContact OE2-N 3.16Å; L419-F544 HydrophobicContact CD2-CE1 4.48Å; L419-F544 HydrophobicContact CD2-CZ 4.11Å; I472-F544 HydrophobicContact CD1-CD2 3.83Å; I472-F544 HydrophobicContact CD1-CE2 3.78Å; I472-F544 HydrophobicContact CG1-CD2 3.84Å; I472-F544 HydrophobicContact CG1-CE2 3.98Å; D475-F544 HydrophobicContact CB-CE2 3.88Å; D475-F544 HydrophobicContact CB-CZ 4.05Å; V476-F544 HydrophobicContact CB-CZ 4.5Å; V476-F544 HydrophobicContact CG2-CD2 3.9Å; V476-F544 HydrophobicContact CG2-CE1 4.45Å; V476-F544 HydrophobicContact CG2-CE2 3.61Å; V476-F544 HydrophobicContact CG2-CG 4.42Å; V476-F544 HydrophobicContact CG2-CZ 3.93Å; F479-F544 HydrophobicContact CB-CE1 3.71Å; F479-F544 HydrophobicContact CB-CZ 4Å; F479-F544 HydrophobicContact CD1-CD1 4.3Å; F479-F544 AromaticContact CD1-CE1 3.72Å; F479-F544 HydrophobicContact CD1-CE1 3.72Å; F479-F544 HydrophobicContact CD2-CE1 4.41Å; F479-F544 HydrophobicContact CE1-CE1 4.39Å; F479-F544 AromaticContact CG-CE1 3.71Å; F479-F544 HydrophobicContact CG-CE1 3.71Å; F479-F544 HydrophobicContact CG-CZ 4.48Å; F544-S546 PolarHBondContact O-N 3.03Å; F544-L547 HydrophobicContact CD1-CD1 4.13Å; F544-L547 HydrophobicContact CE1-CD1 4.45Å; F544-L547 PolarHBondContact O-N 2.87Å; F544-C548 WeakPolarHBondContact O-CB 3.45Å; F544-C548 PolarHBondContact O-N 3.32Å
545	R	95	Very high	94.3	Very high	98 Å²	98	49.1 Å²	49.1	37%	0.37	27%	0.267	S	S	.	.	H	α-helix	trans	-54.1	-51.5	170.5	-174.2	175.5	-174.8	121.6	27.7	112.6	T81 S407 E410 T543 L547 C548 D549	T81-R545 VanDerWaalsContact CG2-NH2 3.34Å; T81-R545 PolarHBondContact O-NH1 3.19Å; T81-R545 PolarHBondContact O-NH2 2.95Å; S407-R545 WeakPolarHBondContact OG-CA 3.31Å; E410-R545 PolarHBondContact OE2-N 3.37Å; T543-R545 PolarHBondContact O-N 2.83Å; R545-L547 VanDerWaalsContact C-N 3.31Å; R545-L547 PolarHBondContact O-N 3.24Å; R545-C548 WeakPolarHBondContact O-CB 3.49Å; R545-C548 PolarHBondContact O-N 3.36Å; R545-D549 PolarHBondContact O-N 3.38Å
546	S	96.1	Very high	93.2	Very high	51 Å²	51	49.9 Å²	49.9	36%	0.357	27%	0.274	S	S	.	.	H	α-helix	trans	-62.6	-38.5	178.1	168.8	0	0	0	0	112.1	T543 F544 V550	T543-S546 PolarHBondContact O-N 3.32Å; T543-S546 WeakPolarHBondContact OG1-CB 3.34Å; T543-S546 PolarHBondContact OG1-N 3.08Å; T543-S546 VanDerWaalsContact OG1-N 3.15Å; F544-S546 PolarHBondContact O-N 3.03Å; S546-V550 VanDerWaalsContact O-CG2 3.28Å; S546-V550 WeakPolarHBondContact O-CG2 3.36Å; S546-V550 PolarHBondContact O-N 2.76Å; S546-V550 VanDerWaalsContact O-N 3.09Å
547	L	97.1	Very high	91.9	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.1	-42.8	176.8	-68.7	170.6	0	0	0	111.7	A403 V476 F479 M483 L529 P542 T543 F544 R545 D549 V550 F551	A403-L547 HydrophobicContact CB-CB 4.41Å; V476-L547 HydrophobicContact CG1-CD1 4.22Å; F479-L547 HydrophobicContact CD1-CD1 3.71Å; F479-L547 HydrophobicContact CE1-CB 4.31Å; F479-L547 HydrophobicContact CE1-CD1 3.91Å; M483-L547 HydrophobicContact CE-CD2 4.42Å; L529-L547 HydrophobicContact CD1-CD2 3.63Å; L529-L547 HydrophobicContact CD2-CD2 3.91Å; L529-L547 HydrophobicContact CG-CD2 3.76Å; P542-L547 HydrophobicContact CB-CD2 4.17Å; P542-L547 HydrophobicContact CB-CG 4.07Å; P542-L547 HydrophobicContact CG-CD1 4.02Å; P542-L547 HydrophobicContact CG-CD2 3.72Å; P542-L547 HydrophobicContact CG-CG 3.9Å; T543-L547 WeakPolarHBondContact O-CG 3.43Å; T543-L547 PolarHBondContact O-N 3.47Å; F544-L547 HydrophobicContact CD1-CD1 4.13Å; F544-L547 HydrophobicContact CE1-CD1 4.45Å; F544-L547 PolarHBondContact O-N 2.87Å; R545-L547 VanDerWaalsContact C-N 3.31Å; R545-L547 PolarHBondContact O-N 3.24Å; L547-D549 PolarHBondContact O-N 3.41Å; L547-V550 PolarHBondContact O-N 2.94Å; L547-F551 HydrophobicContact CB-CE2 4.48Å; L547-F551 WeakPolarHBondContact O-CD2 3.49Å; L547-F551 PolarHBondContact O-N 3.09Å
548	C	94.4	Very high	90.5	Very high	10 Å²	10	46 Å²	46	7%	0.068	25%	0.248	C	C	.	.	H	α-helix	trans	-57	-50.1	175.3	-167.9	0	0	0	0	110.5	A403 F544 R545 V550 F551 E552	A403-C548 HydrophobicContact CB-CB 4.08Å; F544-C548 WeakPolarHBondContact O-CB 3.45Å; F544-C548 PolarHBondContact O-N 3.32Å; R545-C548 WeakPolarHBondContact O-CB 3.49Å; R545-C548 PolarHBondContact O-N 3.36Å; C548-V550 VanDerWaalsContact C-N 3.31Å; C548-V550 PolarHBondContact O-N 3.39Å; C548-F551 PolarHBondContact O-N 3.21Å; C548-E552 WeakPolarHBondContact O-CB 3.13Å; C548-E552 WeakPolarHBondContact O-CG 3.35Å; C548-E552 PolarHBondContact O-N 3.38Å
549	D	91.6	Very high	88.6	Confident	73 Å²	73	50.6 Å²	50.6	39%	0.39	27%	0.266	S	S	.	.	H	α-helix	trans	-59.6	-40.1	178.9	-68.1	-26.1	0	0	0	112.4	R545 L547 N553	R545-D549 PolarHBondContact O-N 3.38Å; L547-D549 PolarHBondContact O-N 3.41Å; D549-N553 WeakPolarHBondContact O-CB 3.39Å; D549-N553 PolarHBondContact O-N 2.86Å; D549-N553 PolarHBondContact O-ND2 3.22Å
550	V	93.9	Very high	86.3	Confident	25 Å²	25	47 Å²	47	15%	0.152	26%	0.258	C	S	.	.	H	α-helix	trans	-63.5	-48.5	177	167.8	0	0	0	0	111.1	L529 S546 L547 C548 N553 W554	L529-V550 HydrophobicContact CD2-CG1 4Å; S546-V550 VanDerWaalsContact O-CG2 3.28Å; S546-V550 WeakPolarHBondContact O-CG2 3.36Å; S546-V550 PolarHBondContact O-N 2.76Å; S546-V550 VanDerWaalsContact O-N 3.09Å; L547-V550 PolarHBondContact O-N 2.94Å; C548-V550 VanDerWaalsContact C-N 3.31Å; C548-V550 PolarHBondContact O-N 3.39Å; V550-N553 CarbonylContact O-C 3.48Å; V550-N553 VanDerWaalsContact O-C 3.27Å; V550-N553 PolarHBondContact O-N 3.39Å; V550-W554 HydrophobicContact CG1-CE3 4.17Å; V550-W554 HydrophobicContact CG1-CZ3 4.18Å; V550-W554 VanDerWaalsContact O-CA 3.27Å; V550-W554 WeakPolarHBondContact O-CA 3.5Å; V550-W554 PolarHBondContact O-N 3.01Å
551	F	93.9	Very high	83.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-72.3	-38.5	-177.7	-71	-60.7	0	0	0	113	R187 I396 M399 A400 A403 F479 M483 L526 L529 L547 C548 N553 W554	R187-F551 PolarHBondContact NE-O 2.99Å; I396-F551 HydrophobicContact CD1-CD1 4.1Å; I396-F551 HydrophobicContact CD1-CE1 3.96Å; I396-F551 HydrophobicContact CG2-CD1 4.15Å; M399-F551 HydrophobicContact CB-CD1 4.11Å; M399-F551 HydrophobicContact CB-CD2 4.21Å; M399-F551 HydrophobicContact CB-CE1 3.94Å; M399-F551 HydrophobicContact CB-CE2 4.09Å; M399-F551 HydrophobicContact CB-CG 4.23Å; M399-F551 HydrophobicContact CB-CZ 3.92Å; M399-F551 HydrophobicContact CG-CZ 4.45Å; M399-F551 HydrophobicContact SD-CE1 3.74Å; M399-F551 HydrophobicContact SD-CZ 3.89Å; A400-F551 HydrophobicContact CB-CB 3.62Å; A403-F551 HydrophobicContact CB-CD2 4.28Å; F479-F551 AromaticContact CE1-CE2 3.79Å; F479-F551 HydrophobicContact CE1-CE2 3.79Å; F479-F551 AromaticContact CZ-CE2 3.92Å; F479-F551 HydrophobicContact CZ-CE2 3.92Å; M483-F551 HydrophobicContact CE-CE2 3.7Å; M483-F551 HydrophobicContact CE-CZ 3.61Å; M483-F551 HydrophobicContact CG-CZ 4.49Å; M483-F551 HydrophobicContact SD-CZ 3.93Å; L526-F551 HydrophobicContact CD1-CE1 3.79Å; L526-F551 HydrophobicContact CD1-CZ 4.15Å; L529-F551 HydrophobicContact CD2-CE1 3.87Å; L529-F551 HydrophobicContact CD2-CE2 3.8Å; L529-F551 HydrophobicContact CD2-CZ 3.39Å; L547-F551 HydrophobicContact CB-CE2 4.48Å; L547-F551 WeakPolarHBondContact O-CD2 3.49Å; L547-F551 PolarHBondContact O-N 3.09Å; C548-F551 PolarHBondContact O-N 3.21Å; F551-N553 PolarHBondContact O-N 3.23Å; F551-W554 HydrophobicContact CD1-CE3 4.02Å; F551-W554 HydrophobicContact CD1-CZ3 4.35Å; F551-W554 HydrophobicContact CE1-CE3 4.34Å; F551-W554 HydrophobicContact CE1-CZ3 4.22Å; F551-W554 WeakPolarHBondContact O-CB 3.43Å; F551-W554 PolarHBondContact O-N 3.04Å
552	E	87	Confident	80.6	Confident	51 Å²	51	55.2 Å²	55.2	24%	0.238	29%	0.288	C	S	.	.	H	α-helix	trans	-60.3	-33.2	174.4	-75.6	-169	175	0	0	111.9	C548	C548-E552 WeakPolarHBondContact O-CB 3.13Å; C548-E552 WeakPolarHBondContact O-CG 3.35Å; C548-E552 PolarHBondContact O-N 3.38Å
553	N	86.3	Confident	77.7	Confident	56 Å²	56	61 Å²	61	30%	0.299	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	31.5	-178.6	-57.9	-68.8	0	0	0	112.3	D549 V550 F551 S555 T556 H557	D549-N553 WeakPolarHBondContact O-CB 3.39Å; D549-N553 PolarHBondContact O-N 2.86Å; D549-N553 PolarHBondContact O-ND2 3.22Å; V550-N553 CarbonylContact O-C 3.48Å; V550-N553 VanDerWaalsContact O-C 3.27Å; V550-N553 PolarHBondContact O-N 3.39Å; F551-N553 PolarHBondContact O-N 3.23Å; N553-S555 PolarHBondContact O-N 2.77Å; N553-T556 WeakPolarHBondContact CB-OG1 3.29Å; N553-T556 PolarHBondContact O-N 3.18Å; N553-T556 PolarHBondContact O-OG1 3.35Å; N553-H557 WeakPolarHBondContact CB-ND1 3.37Å; N553-H557 PolarHBondContact O-N 3.39Å; N553-H557 PolarHBondContact O-ND1 3.47Å
554	W	88.2	Confident	74.7	Confident	24 Å²	24	65.2 Å²	65.2	9%	0.091	34%	0.338	C	S	.	.	H	α-helix	trans	-53.1	-49.5	-172.1	-177.7	-104.6	0	0	0	113.5	I396 D525 L526 V550 F551 T556 H557 T558	I396-W554 HydrophobicContact CD1-CD2 3.99Å; I396-W554 HydrophobicContact CD1-CE3 4.28Å; I396-W554 HydrophobicContact CD1-CH2 4.41Å; I396-W554 HydrophobicContact CD1-CZ2 4.11Å; I396-W554 HydrophobicContact CD1-CZ3 4.47Å; I396-W554 HydrophobicContact CG1-CD2 4.44Å; I396-W554 HydrophobicContact CG1-CG 4.49Å; I396-W554 HydrophobicContact CG2-CB 3.82Å; I396-W554 HydrophobicContact CG2-CD2 4.21Å; I396-W554 HydrophobicContact CG2-CG 3.77Å; D525-W554 HydrophobicContact CB-CH2 3.93Å; D525-W554 HydrophobicContact CB-CZ2 4.27Å; L526-W554 HydrophobicContact CB-CH2 3.73Å; L526-W554 HydrophobicContact CB-CZ2 4.07Å; L526-W554 HydrophobicContact CD1-CH2 4.22Å; V550-W554 HydrophobicContact CG1-CE3 4.17Å; V550-W554 HydrophobicContact CG1-CZ3 4.18Å; V550-W554 VanDerWaalsContact O-CA 3.27Å; V550-W554 WeakPolarHBondContact O-CA 3.5Å; V550-W554 PolarHBondContact O-N 3.01Å; F551-W554 HydrophobicContact CD1-CE3 4.02Å; F551-W554 HydrophobicContact CD1-CZ3 4.35Å; F551-W554 HydrophobicContact CE1-CE3 4.34Å; F551-W554 HydrophobicContact CE1-CZ3 4.22Å; F551-W554 WeakPolarHBondContact O-CB 3.43Å; F551-W554 PolarHBondContact O-N 3.04Å; W554-T556 VanDerWaalsContact C-N 3.34Å; W554-T556 PolarHBondContact O-N 3.34Å; W554-H557 PolarHBondContact O-N 3.02Å; W554-H557 VanDerWaalsContact O-N 3.09Å; W554-T558 HydrophobicContact CD2-CG2 4.22Å; W554-T558 HydrophobicContact CZ2-CG2 3.88Å; W554-T558 PolarHBondContact O-N 3.27Å; W554-T558 PolarHBondContact O-OG1 3.1Å
555	S	78.9	Confident	71.4	Confident	65 Å²	65	74.8 Å²	74.8	46%	0.455	39%	0.389	S	S	.	.	H	α-helix	trans	-59.9	-42	-177.7	47.8	0	0	0	0	112.8	N553 T558 E559	N553-S555 PolarHBondContact O-N 2.77Å; S555-T558 PolarHBondContact O-OG1 3.17Å; S555-E559 WeakPolarHBondContact O-CB 3.33Å; S555-E559 WeakPolarHBondContact O-CG 3.44Å; S555-E559 PolarHBondContact O-N 3.45Å; S555-E559 VanDerWaalsContact O-N 3.07Å
556	T	74.9	Confident	70.2	Confident	71 Å²	71	73.7 Å²	73.7	44%	0.436	39%	0.39	S	S	.	.	H	α-helix	trans	-71.8	-32.2	176.9	53.4	0	0	0	0	112.3	N553 W554 A560	N553-T556 WeakPolarHBondContact CB-OG1 3.29Å; N553-T556 PolarHBondContact O-N 3.18Å; N553-T556 PolarHBondContact O-OG1 3.35Å; W554-T556 VanDerWaalsContact C-N 3.34Å; W554-T556 PolarHBondContact O-N 3.34Å; T556-A560 WeakPolarHBondContact O-CB 3.1Å; T556-A560 PolarHBondContact O-N 3.32Å; T556-A560 VanDerWaalsContact O-N 3.1Å
557	H	68.6	Low	68.8	Low	75 Å²	75	74.8 Å²	74.8	35%	0.347	39%	0.392	S	S	.	.	H	α-helix	trans	-69.1	-39.7	177.3	-82.7	85.2	0	0	0	112.1	N553 W554	N553-H557 WeakPolarHBondContact CB-ND1 3.37Å; N553-H557 PolarHBondContact O-N 3.39Å; N553-H557 PolarHBondContact O-ND1 3.47Å; W554-H557 PolarHBondContact O-N 3.02Å; W554-H557 VanDerWaalsContact O-N 3.09Å
558	T	67.3	Low	67.2	Low	29 Å²	29	79 Å²	79	18%	0.178	41%	0.413	C	S	.	.	H	α-helix	trans	-70.9	-43.8	176.5	53.9	0	0	0	0	110.9	D525 W554 S555 A560 Q561 Y562	D525-T558 HydrophobicContact CB-CG2 4.41Å; W554-T558 HydrophobicContact CD2-CG2 4.22Å; W554-T558 HydrophobicContact CZ2-CG2 3.88Å; W554-T558 PolarHBondContact O-N 3.27Å; W554-T558 PolarHBondContact O-OG1 3.1Å; S555-T558 PolarHBondContact O-OG1 3.17Å; T558-A560 PolarHBondContact O-N 3.42Å; T558-Q561 PolarHBondContact O-N 3.32Å; T558-Y562 WeakPolarHBondContact O-CD2 3.4Å
559	E	58.4	Low	65.6	Low	130 Å²	130	83.1 Å²	83.1	61%	0.607	43%	0.434	S	S	*	.	H	α-helix	trans	-64	-37.6	179.7	-76.8	177.3	-178.5	0	0	113.3	S555 Q561 Y562 L563	S555-E559 WeakPolarHBondContact O-CB 3.33Å; S555-E559 WeakPolarHBondContact O-CG 3.44Å; S555-E559 PolarHBondContact O-N 3.45Å; S555-E559 VanDerWaalsContact O-N 3.07Å; E559-Q561 VanDerWaalsContact C-N 3.29Å; E559-Q561 PolarHBondContact O-N 3.43Å; E559-Y562 PolarHBondContact O-N 2.84Å; E559-L563 PolarHBondContact O-N 3.39Å
560	A	48.8	Very low	64	Low	53 Å²	53	83.7 Å²	83.7	44%	0.438	44%	0.436	S	S	.	.	H	α-helix	trans	-63	-33.4	-179.5	0	0	0	0	0	113.1	T556 T558	T556-A560 WeakPolarHBondContact O-CB 3.1Å; T556-A560 PolarHBondContact O-N 3.32Å; T556-A560 VanDerWaalsContact O-N 3.1Å; T558-A560 PolarHBondContact O-N 3.42Å
561	Q	38.8	Very low	62	Low	108 Å²	108	87.6 Å²	87.6	51%	0.505	46%	0.455	S	S	.	.	H	α-helix	trans	-77.7	-23.4	179.7	-69.5	-172.5	19.4	0	0	113.4	D525 T558 E559 L563	D525-Q561 PolarHBondContact OD1-OE1 2.75Å; T558-Q561 PolarHBondContact O-N 3.32Å; E559-Q561 VanDerWaalsContact C-N 3.29Å; E559-Q561 PolarHBondContact O-N 3.43Å; Q561-L563 VanDerWaalsContact C-N 3.34Å
562	Y	38.6	Very low	59.8	Low	163 Å²	163	93.9 Å²	93.9	64%	0.639	49%	0.488	S	S	*	.	H	α-helix	trans	-80.4	-14.9	175.3	-72.9	-71.2	0	0	0	113.5	T558 E559	T558-Y562 WeakPolarHBondContact O-CD2 3.4Å; E559-Y562 PolarHBondContact O-N 2.84Å
563	L	36.8	Very low	57.7	Low	142 Å²	142	97.2 Å²	97.2	74%	0.743	51%	0.507	S	S	*	.	S	Bend	trans	-88.6	-10.7	177.4	-71.8	165.1	0	0	0	113.5	E559 Q561	E559-L563 PolarHBondContact O-N 3.39Å; Q561-L563 VanDerWaalsContact C-N 3.34Å
564	D	36.4	Very low	55.3	Low	145 Å²	145	100.6 Å²	100.6	78%	0.775	53%	0.525	S	S	*	.			trans	-99.2	8.2	-179.7	-78.6	-18.6	0	0	0	114.1
565	N	27.7	Very low	52.3	Low	202 Å²	202	107.5 Å²	107.5	100%	1.08	56%	0.564	S	S	*	*			trans	-113.1	0	168	-72.3	-40.7	0	0	0	110.5

Retrieved 565 of 565 residues in 716.8 ms (Link to these results)

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