A0A3Q0KI60_SCHMA Loading...

Putative zinc finger protein

AlphaFold DB , UniProt , Accession A0A3Q0KI60, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 486 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.5	Very low	26	Very low	246 Å²	246	139.4 Å²	139.4	100%	1.212	80%	0.801	S	S	*	*				0	137.3	0	-69.4	-178.3	-165.1	0	0	107.9
2	A	27.6	Very low	26.1	Very low	97 Å²	97	139.3 Å²	139.3	80%	0.802	79%	0.793	S	S	*	*			trans	-40.7	128.4	-157.2	0	0	0	0	0	118
3	I	22	Very low	26.1	Very low	164 Å²	164	138.5 Å²	138.5	84%	0.841	79%	0.793	S	S	*	*			trans	-114.9	125.2	144.5	-61.6	174	0	0	0	106
4	P	27.5	Very low	25.8	Very low	107 Å²	107	136.2 Å²	136.2	70%	0.695	79%	0.788	S	S	*	*			trans	-124.8	117.4	142	13	7.9	0	0	0	111.9
5	V	23.7	Very low	25.7	Very low	114 Å²	114	139.2 Å²	139.2	69%	0.691	79%	0.788	S	S	*	*				41.4	116.1	126.4	-87.3	0	0	0	0	121.8
6	S	25.5	Very low	25.6	Very low	88 Å²	88	138.6 Å²	138.6	62%	0.615	79%	0.788	S	S	*	*				41.5	97	127	65.6	0	0	0	0	119.5
7	D	27.6	Very low	25.5	Very low	160 Å²	160	140.2 Å²	140.2	86%	0.856	79%	0.787	S	S	*	*			trans	-91.7	101	148.8	-92.5	-29	0	0	0	109.1
8	F	22.8	Very low	25.4	Very low	181 Å²	181	142.2 Å²	142.2	79%	0.794	79%	0.789	S	S	*	*			trans	-59.3	164.5	163	-106.1	-103.7	0	0	0	112.1
9	C	23.9	Very low	25.5	Very low	98 Å²	98	141.6 Å²	141.6	66%	0.662	79%	0.792	S	S	*	*			trans	92.4	103.9	168	-58.5	0	0	0	0	116.7
10	F	28.7	Very low	25.5	Very low	207 Å²	207	143.9 Å²	143.9	91%	0.908	80%	0.799	S	S	*	*				-149.8	91.2	99.3	-90.2	-75.4	0	0	0	108.2	I12	F10-I12 PolarHBondContact O-N 3.33Å
11	G	24.8	Very low	25.5	Very low	71 Å²	71	140.5 Å²	140.5	73%	0.732	80%	0.796	S	S	*	*			trans	-61.6	114.6	165.1	0	0	0	0	0	108.9	T13	G11-T13 VanDerWaalsContact C-N 3.33Å; G11-T13 PolarHBondContact O-N 3.12Å
12	I	27.3	Very low	25.2	Very low	138 Å²	138	137.1 Å²	137.1	71%	0.708	78%	0.782	S	S	*	*			trans	-82.4	87.2	162.3	-60	170	0	0	0	104.8	F10 C14	F10-I12 PolarHBondContact O-N 3.33Å; I12-C14 PolarHBondContact O-N 3.36Å
13	T	25.6	Very low	25.1	Very low	130 Å²	130	139.9 Å²	139.9	80%	0.798	78%	0.783	S	S	*	*			trans	-87	92.6	163.5	43.2	0	0	0	0	107.3	G11 K15	G11-T13 VanDerWaalsContact C-N 3.33Å; G11-T13 PolarHBondContact O-N 3.12Å; T13-K15 VanDerWaalsContact C-N 3.29Å; T13-K15 PolarHBondContact O-N 3.13Å
14	C	22.6	Very low	25.2	Very low	106 Å²	106	135.7 Å²	135.7	72%	0.716	78%	0.781	S	S	*	*			trans	-67.7	92	159.3	-75.6	0	0	0	0	107.2	I12 V16	I12-C14 PolarHBondContact O-N 3.36Å; C14-V16 PolarHBondContact O-N 2.85Å
15	K	23.9	Very low	25.2	Very low	181 Å²	181	136.3 Å²	136.3	79%	0.787	78%	0.782	S	S	*	*			trans	-75.4	109.6	155.6	-88.5	-172.2	174.1	-176	0	106.9	T13 E17	T13-K15 VanDerWaalsContact C-N 3.29Å; T13-K15 PolarHBondContact O-N 3.13Å; K15-E17 PolarHBondContact O-N 3.01Å
16	V	23	Very low	25.2	Very low	130 Å²	130	137.5 Å²	137.5	79%	0.788	78%	0.783	S	S	*	*			trans	-71.1	100.1	165.5	176.1	0	0	0	0	105.7	C14	C14-V16 PolarHBondContact O-N 2.85Å
17	E	24	Very low	25.2	Very low	165 Å²	165	143.7 Å²	143.7	77%	0.771	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-98	122.9	164.1	-78.6	179.5	-179.8	0	0	108.1	K15	K15-E17 PolarHBondContact O-N 3.01Å
18	Q	23.9	Very low	24.9	Very low	176 Å²	176	144.8 Å²	144.8	82%	0.822	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-63.8	152.9	-175.8	-71.8	175.1	-44.1	0	0	111.6	M20	Q18-M20 PolarHBondContact O-N 3.4Å
19	P	28	Very low	25.2	Very low	131 Å²	131	141.3 Å²	141.3	85%	0.851	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-81.3	118.9	-165.3	31.3	-31.7	0	0	0	111.3
20	M	25.8	Very low	25.2	Very low	188 Å²	188	141.7 Å²	141.7	93%	0.926	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-87.1	126.2	160.3	-76.4	-165.3	66.5	0	0	110	Q18	Q18-M20 PolarHBondContact O-N 3.4Å
21	G	24.9	Very low	25.2	Very low	73 Å²	73	139.4 Å²	139.4	75%	0.753	79%	0.791	S	S	*	*			trans	86.4	106.2	142.9	0	0	0	0	0	116.5	D23	G21-D23 PolarHBondContact O-N 3.43Å
22	L	25.6	Very low	25	Very low	175 Å²	175	144.3 Å²	144.3	92%	0.916	80%	0.795	S	S	*	*			trans	-43.6	113.8	155.6	-70.2	144.2	0	0	0	111.3
23	D	26.6	Very low	24.8	Very low	154 Å²	154	143.4 Å²	143.4	82%	0.824	80%	0.8	S	S	*	*			trans	-162.5	129.3	135.3	-96.7	-31.9	0	0	0	109.7	G21 V25	G21-D23 PolarHBondContact O-N 3.43Å; D23-V25 PolarHBondContact O-N 3.04Å
24	G	24.8	Very low	24.7	Very low	76 Å²	76	144.5 Å²	144.5	78%	0.784	80%	0.799	S	S	*	*			trans	-62.1	99.3	-171.4	0	0	0	0	0	112.6	I26	G24-I26 VanDerWaalsContact C-N 3.31Å; G24-I26 PolarHBondContact O-N 2.9Å
25	V	26	Very low	24.5	Very low	120 Å²	120	145 Å²	145	73%	0.727	80%	0.804	S	S	*	*			trans	-79.9	87.5	164.1	-175.6	0	0	0	0	108.2	D23 Y27	D23-V25 PolarHBondContact O-N 3.04Å; V25-Y27 PolarHBondContact O-N 3.42Å
26	I	23.8	Very low	24.6	Very low	139 Å²	139	141.1 Å²	141.1	71%	0.713	80%	0.8	S	S	*	*			trans	-57.5	108.6	160.4	-62.4	172.3	0	0	0	106.6	G24 K28	G24-I26 VanDerWaalsContact C-N 3.31Å; G24-I26 PolarHBondContact O-N 2.9Å; I26-K28 HydrophobicContact CG2-CG 4.29Å; I26-K28 PolarHBondContact O-N 3.21Å
27	Y	25	Very low	24.5	Very low	218 Å²	218	142.6 Å²	142.6	86%	0.855	80%	0.803	S	S	*	*			trans	-63.9	88.1	165.6	-85.5	-90	0	0	0	108.2	V25 S29	V25-Y27 PolarHBondContact O-N 3.42Å; Y27-S29 PolarHBondContact O-N 3.01Å
28	K	22.8	Very low	24.5	Very low	183 Å²	183	141.7 Å²	141.7	80%	0.796	80%	0.803	S	S	*	*			trans	-62.7	103.3	162.1	-75.1	-176.1	177.4	178.8	0	106.9	I26 S30	I26-K28 HydrophobicContact CG2-CG 4.29Å; I26-K28 PolarHBondContact O-N 3.21Å; K28-S30 PolarHBondContact O-N 2.85Å
29	S	28.6	Very low	24.4	Very low	109 Å²	109	141.2 Å²	141.2	76%	0.762	81%	0.806	S	S	*	*			trans	-60.1	103.4	160	51.3	0	0	0	0	107.4	Y27 N31	Y27-S29 PolarHBondContact O-N 3.01Å; S29-N31 PolarHBondContact O-N 3.43Å
30	S	24.1	Very low	24.1	Very low	106 Å²	106	142 Å²	142	74%	0.741	80%	0.801	S	S	*	*			trans	-63.7	85.1	168.7	52.6	0	0	0	0	109.4	K28	K28-S30 PolarHBondContact O-N 2.85Å
31	N	28.9	Very low	23.9	Very low	158 Å²	158	135.9 Å²	135.9	85%	0.845	79%	0.786	S	S	*	*			trans	-123	90.5	148	-86.3	-19.7	0	0	0	105.3	S29	S29-N31 PolarHBondContact O-N 3.43Å
32	E	21	Very low	23.9	Very low	175 Å²	175	138.4 Å²	138.4	82%	0.818	79%	0.79	S	S	*	*			trans	-66.8	150.8	165.2	-68.2	173.3	144.3	0	0	110.1
33	C	21.9	Very low	23.8	Very low	119 Å²	119	139 Å²	139	80%	0.804	79%	0.788	S	S	*	*			trans	76.1	125.4	165.5	-51.6	0	0	0	0	114
34	I	23.2	Very low	23.5	Very low	152 Å²	152	139.7 Å²	139.7	78%	0.779	79%	0.786	S	S	*	*			cis	-148.9	132.1	28.5	-68	173.7	0	0	0	108.3	S36	I34-S36 PolarHBondContact O-N 2.98Å
35	S	19.8	Very low	23.3	Very low	117 Å²	117	147 Å²	147	82%	0.818	79%	0.792	S	S	*	*			trans	-63.8	118.3	161.6	16.2	0	0	0	0	110.2
36	S	24.8	Very low	23	Very low	100 Å²	100	149.5 Å²	149.5	70%	0.699	80%	0.799	S	S	*	*			trans	-135.9	102.6	154.3	57.2	0	0	0	0	107.9	I34 L38	I34-S36 PolarHBondContact O-N 2.98Å; S36-L38 PolarHBondContact O-N 3.49Å
37	N	21.8	Very low	22.8	Very low	160 Å²	160	151.6 Å²	151.6	86%	0.856	80%	0.803	S	S	*	*			trans	-50.3	117.4	168.7	-71	-36.2	0	0	0	110
38	L	22.9	Very low	22.5	Very low	146 Å²	146	145.5 Å²	145.5	76%	0.764	80%	0.797	S	S	*	*			trans	-131.1	88.9	154.6	-90	162.6	0	0	0	106.8	S36 I40	S36-L38 PolarHBondContact O-N 3.49Å; L38-I40 PolarHBondContact O-N 3.4Å
39	N	21.4	Very low	22.4	Very low	166 Å²	166	146 Å²	146	89%	0.888	80%	0.803	S	S	*	*			trans	-59.1	109.3	156.3	-89.6	-28.5	0	0	0	107.2
40	I	22.8	Very low	22	Very low	147 Å²	147	149.4 Å²	149.4	75%	0.754	81%	0.807	S	S	*	*			trans	-118.3	103.1	161.4	-58.7	179.3	0	0	0	105.3	L38	L38-I40 PolarHBondContact O-N 3.4Å
41	G	21.7	Very low	21.8	Very low	60 Å²	60	150.4 Å²	150.4	62%	0.619	81%	0.812	S	S	*	*			trans	-68.9	169.1	173.6	0	0	0	0	0	111.9
42	P	25.3	Very low	21.4	Very low	127 Å²	127	149.9 Å²	149.9	83%	0.825	81%	0.809	S	S	*	*			trans	-99.9	104.5	-168.9	33.5	-22.7	0	0	0	110.3
43	E	22	Very low	21.5	Very low	186 Å²	186	151.7 Å²	151.7	87%	0.869	81%	0.81	S	S	*	*			trans	-150.4	148.3	164.9	-84.2	-152.3	144.1	0	0	113.9
44	E	20.5	Very low	21.4	Very low	170 Å²	170	152.3 Å²	152.3	79%	0.794	81%	0.806	S	S	*	*			trans	90	81.7	161.3	-68.8	-178.3	167.2	0	0	120.1	I46	E44-I46 PolarHBondContact O-N 3.25Å
45	Y	20.5	Very low	21.5	Very low	230 Å²	230	151.9 Å²	151.9	90%	0.902	81%	0.805	S	S	*	*			trans	-21	118.6	131.6	-82	-100.7	0	0	0	114.9
46	I	20.5	Very low	21.7	Very low	171 Å²	171	151.4 Å²	151.4	88%	0.877	80%	0.797	S	S	*	*			trans	-96.1	113.1	156.1	-62.3	176.2	0	0	0	107.9	E44	E44-I46 PolarHBondContact O-N 3.25Å
47	K	18.7	Very low	21.5	Very low	184 Å²	184	155.4 Å²	155.4	80%	0.8	81%	0.807	S	S	*	*			trans	-73.2	151.4	170.1	-84.3	176.4	173	174.4	0	111.2
48	A	18.8	Very low	21.7	Very low	89 Å²	89	154.5 Å²	154.5	74%	0.736	80%	0.802	S	S	*	*			trans	63.9	116.4	146.8	0	0	0	0	0	118.3
49	E	21.4	Very low	21.6	Very low	194 Å²	194	155.1 Å²	155.1	91%	0.907	81%	0.806	S	S	*	*				-150.1	123.2	122.2	-107.2	170	-158.3	0	0	108.9
50	E	20	Very low	21.9	Very low	181 Å²	181	151.1 Å²	151.1	85%	0.846	79%	0.791	S	S	*	*			trans	-71.7	120.6	-178.8	-64.1	169.6	155.2	0	0	109.5
51	C	20.7	Very low	22.1	Very low	127 Å²	127	151.9 Å²	151.9	86%	0.858	80%	0.796	S	S	*	*			trans	-113.5	82.3	164.7	-68.4	0	0	0	0	108	Y53	C51-Y53 PolarHBondContact O-N 3.45Å
52	N	19.7	Very low	22.2	Very low	146 Å²	146	155.9 Å²	155.9	78%	0.781	80%	0.802	S	S	*	*			trans	-56.6	115.9	157.9	-88.9	-28.4	0	0	0	108.5
53	Y	23.2	Very low	22.3	Very low	213 Å²	213	156.8 Å²	156.8	84%	0.835	80%	0.8	S	S	*	*			trans	-136.2	86.1	154	-124.3	-81.7	0	0	0	107.8	C51 N55	C51-Y53 PolarHBondContact O-N 3.45Å; Y53-N55 PolarHBondContact O-N 2.87Å
54	D	19.2	Very low	22.5	Very low	133 Å²	133	153.9 Å²	153.9	71%	0.711	79%	0.79	S	S	*	*			trans	-49.6	124.1	155.1	-106.5	-38.3	0	0	0	109.3
55	N	26.9	Very low	22.9	Very low	143 Å²	143	155.7 Å²	155.7	77%	0.765	80%	0.795	S	S	*	*			trans	-147.5	94.6	144.6	-94.9	-48.6	0	0	0	107	Y53	Y53-N55 PolarHBondContact O-N 2.87Å
56	T	22.6	Very low	23.1	Very low	107 Å²	107	152.4 Å²	152.4	66%	0.656	79%	0.793	S	S	*	*			trans	-40.1	137.5	164.7	48.6	0	0	0	0	114.4
57	M	21.5	Very low	23.3	Very low	183 Å²	183	147.6 Å²	147.6	90%	0.901	79%	0.785	S	S	*	*			trans	64.3	111.3	144.5	-60.2	-149.3	179.7	0	0	120.4
58	D	24.8	Very low	23.7	Very low	141 Å²	141	147.1 Å²	147.1	75%	0.754	79%	0.79	S	S	*	*				-150.5	86.5	111.9	-166.2	-2.6	0	0	0	108.8	S60	D58-S60 PolarHBondContact OD1-N 3.16Å; D58-S60 PolarHBondContact OD1-OG 3.47Å
59	D	22.4	Very low	23.8	Very low	159 Å²	159	150.4 Å²	150.4	85%	0.85	79%	0.794	S	S	*	*			trans	-97.1	86.6	163.2	-113.3	-17.8	0	0	0	106.7
60	S	25.9	Very low	23.8	Very low	83 Å²	83	151.7 Å²	151.7	58%	0.58	79%	0.791	S	S	*	*			trans	-156.4	80.9	163.4	62.7	0	0	0	0	111.4	D58	D58-S60 PolarHBondContact OD1-N 3.16Å; D58-S60 PolarHBondContact OD1-OG 3.47Å
61	L	27.9	Very low	24.1	Very low	163 Å²	163	150.6 Å²	150.6	85%	0.853	79%	0.791	S	S	*	*			trans	179.9	66.5	144.6	-96	146.3	0	0	0	108.7	D63	L61-D63 PolarHBondContact O-N 3.42Å
62	I	24.7	Very low	24.2	Very low	143 Å²	143	151.7 Å²	151.7	73%	0.733	79%	0.788	S	S	*	*			trans	-76.5	103.3	150.5	-64.5	172.7	0	0	0	105.1
63	D	26	Very low	24.5	Very low	146 Å²	146	153.2 Å²	153.2	78%	0.781	79%	0.79	S	S	*	*			trans	-121	94.3	154.9	-113.6	-20.2	0	0	0	108.1	L61 K65	L61-D63 PolarHBondContact O-N 3.42Å; D63-K65 PolarHBondContact O-N 2.87Å
64	N	26.5	Very low	24.5	Very low	126 Å²	126	146.8 Å²	146.8	67%	0.674	78%	0.776	S	S	*	*			trans	-65.6	108.9	161.5	-97.8	-41.3	0	0	0	108.4
65	K	28.9	Very low	24.7	Very low	207 Å²	207	148.6 Å²	148.6	90%	0.9	79%	0.785	S	S	*	*			trans	-123.2	91.7	148.1	-97.5	-177	177.1	-178.8	0	109.8	D63	D63-K65 PolarHBondContact O-N 2.87Å
66	L	24.6	Very low	24.4	Very low	162 Å²	162	150.9 Å²	150.9	85%	0.848	78%	0.784	S	S	*	*			trans	-62.5	151	156.8	-75.3	159.9	0	0	0	110.7
67	G	24	Very low	24.5	Very low	70 Å²	70	151.4 Å²	151.4	72%	0.722	79%	0.792	S	S	*	*			trans	103.9	121.8	171.3	0	0	0	0	0	111.6
68	I	27.1	Very low	24.4	Very low	174 Å²	174	150.6 Å²	150.6	89%	0.892	79%	0.786	S	S	*	*			cis	-149.6	143.2	41.2	-74.8	159.7	0	0	0	109.9
69	L	21.1	Very low	24.5	Very low	158 Å²	158	151.2 Å²	151.2	83%	0.827	79%	0.789	S	S	*	*			trans	-64.4	155.7	176.4	-74.8	152.4	0	0	0	113.8
70	R	22.3	Very low	24.6	Very low	221 Å²	221	148.5 Å²	148.5	83%	0.834	78%	0.783	S	S	*	*			trans	63.4	106.6	138.5	-169.4	175.3	176.4	169.3	-1.3	116.8
71	D	26.8	Very low	24.3	Very low	158 Å²	158	154.1 Å²	154.1	85%	0.845	80%	0.797	S	S	*	*				-155.5	118	119	-91.1	-28.6	0	0	0	111.7
72	N	22.4	Very low	24.1	Very low	149 Å²	149	155.8 Å²	155.8	80%	0.797	80%	0.798	S	S	*	*			trans	-74	125.8	156.1	-78.6	-35.2	0	0	0	106.8
73	H	26.9	Very low	23.9	Very low	179 Å²	179	156.8 Å²	156.8	83%	0.829	80%	0.799	S	S	*	*			trans	-157.7	120.7	131	-125.1	-88.4	0	0	0	112.3
74	S	22.5	Very low	23.8	Very low	78 Å²	78	159.6 Å²	159.6	55%	0.545	80%	0.804	S	S	.	*			trans	-38.8	125.5	154.2	165.8	0	0	0	0	112.2
75	L	24.1	Very low	23.4	Very low	170 Å²	170	163.3 Å²	163.3	89%	0.89	81%	0.81	S	S	*	*			trans	-129.1	101.2	148.4	-76.1	176.3	0	0	0	108.4
76	Y	19.4	Very low	23.1	Very low	191 Å²	191	161.3 Å²	161.3	75%	0.749	81%	0.809	S	S	*	*			trans	-45.7	135.1	154.3	-90.5	-110	0	0	0	110.4
77	S	25	Very low	23	Very low	119 Å²	119	157.8 Å²	157.8	83%	0.832	80%	0.798	S	S	*	*			trans	-151.5	100.4	146.6	-66.2	0	0	0	0	106.7
78	E	19.8	Very low	22.9	Very low	166 Å²	166	161 Å²	161	78%	0.776	80%	0.799	S	S	*	*			trans	-58.5	131.8	159.1	-64.8	175.7	141.3	0	0	107.9
79	D	25.8	Very low	22.8	Very low	153 Å²	153	160.1 Å²	160.1	82%	0.818	80%	0.796	S	S	*	*			trans	-165	121.2	137.6	-107.3	-39.4	0	0	0	113.5
80	S	24.3	Very low	22.8	Very low	102 Å²	102	155.6 Å²	155.6	71%	0.713	79%	0.788	S	S	*	*			trans	70.8	88.6	133.7	-62.2	0	0	0	0	120
81	F	19.9	Very low	22.8	Very low	201 Å²	201	153.8 Å²	153.8	88%	0.882	79%	0.788	S	S	*	*			trans	-21.2	133	133.9	-89	-109.2	0	0	0	115.9
82	K	23.2	Very low	22.5	Very low	199 Å²	199	153 Å²	153	87%	0.865	78%	0.783	S	S	*	*				174.5	133.8	110.2	-96.2	173.1	-176.2	173.5	0	113.1
83	H	22.2	Very low	22.5	Very low	163 Å²	163	151.6 Å²	151.6	76%	0.755	78%	0.779	S	S	*	*			trans	-13.9	142	158.3	-79.6	-85.5	0	0	0	119.3
84	K	23.4	Very low	22.2	Very low	205 Å²	205	148.3 Å²	148.3	89%	0.891	78%	0.777	S	S	*	*				-162.7	120.5	103.9	-101.4	169.5	-175.4	-179	0	111.3
85	Y	17.7	Very low	22.3	Very low	204 Å²	204	149.3 Å²	149.3	80%	0.8	79%	0.789	S	S	*	*			trans	-63	134	153.3	-101.9	-103.1	0	0	0	107.3
86	N	23.4	Very low	22.1	Very low	165 Å²	165	151.5 Å²	151.5	88%	0.882	79%	0.787	S	S	*	*			trans	-146.6	136.5	139.1	-114	-5.2	0	0	0	110.7
87	S	22.7	Very low	22.4	Very low	89 Å²	89	150.6 Å²	150.6	62%	0.622	80%	0.796	S	S	*	*			trans	-76.6	156.4	-173.5	-57.6	0	0	0	0	112.4
88	N	22.1	Very low	22.3	Very low	138 Å²	138	154.5 Å²	154.5	74%	0.738	79%	0.792	S	S	*	*			trans	72	137.9	150.2	-69.3	1.6	0	0	0	119.6
89	D	23.7	Very low	22.8	Very low	154 Å²	154	153.2 Å²	153.2	82%	0.824	79%	0.786	S	S	*	*			trans	71.9	118.3	165	-49.5	-31.8	0	0	0	114.1
90	G	21.2	Very low	22.8	Very low	64 Å²	64	153.2 Å²	153.2	66%	0.66	79%	0.786	S	S	*	*				99.1	101.5	51.7	0	0	0	0	0	105.9
91	H	22.5	Very low	22.8	Very low	182 Å²	182	151.9 Å²	151.9	84%	0.843	79%	0.788	S	S	*	*			trans	78.8	127.9	166.9	-76.2	-77	0	0	0	120.3
92	I	21.3	Very low	23.1	Very low	143 Å²	143	147.8 Å²	147.8	73%	0.733	78%	0.784	S	S	*	*			trans	101.6	110.8	135.8	-72.3	164.8	0	0	0	118.7
93	V	22.1	Very low	23.2	Very low	118 Å²	118	145 Å²	145	72%	0.715	78%	0.784	S	S	*	*			trans	89.6	119.3	135.5	177.3	0	0	0	0	119.6
94	S	21	Very low	23.5	Very low	111 Å²	111	143.9 Å²	143.9	78%	0.776	79%	0.789	S	S	*	*			trans	-31.6	121.2	153.7	47.1	0	0	0	0	114.7
95	A	23.6	Very low	23.7	Very low	98 Å²	98	143.8 Å²	143.8	81%	0.81	79%	0.789	S	S	*	*			trans	-138.2	126.3	150.4	0	0	0	0	0	109.3
96	Y	19.7	Very low	24.1	Very low	217 Å²	217	143.5 Å²	143.5	85%	0.851	79%	0.792	S	S	*	*			trans	-36	138	168.4	-91.1	-114.6	0	0	0	114
97	N	26.8	Very low	24.4	Very low	172 Å²	172	146.9 Å²	146.9	92%	0.92	79%	0.792	S	S	*	*			trans	-144.7	143.5	135.5	-106.3	-38.6	0	0	0	112.3
98	R	22.9	Very low	24.8	Very low	200 Å²	200	153.7 Å²	153.7	76%	0.755	80%	0.804	S	S	*	*			trans	-111.7	147.4	-156.7	-159.5	-172	153.3	142.9	-7.9	108.1
99	H	28.9	Very low	25	Very low	140 Å²	140	156.1 Å²	156.1	65%	0.648	81%	0.811	S	S	*	*			trans	68.8	140.4	167	-68.5	-64.9	0	0	0	115.9
100	N	26.3	Very low	25.3	Very low	153 Å²	153	156 Å²	156	82%	0.818	81%	0.809	S	S	*	*			cis	-152.6	160.4	13.8	-96.1	-27.2	0	0	0	109.7
101	G	25.1	Very low	25.5	Very low	74 Å²	74	157.7 Å²	157.7	76%	0.763	81%	0.811	S	S	*	*			trans	116.8	71.5	151.9	0	0	0	0	0	117.8
102	S	25.3	Very low	25.8	Very low	114 Å²	114	154.2 Å²	154.2	80%	0.797	81%	0.807	S	S	*	*			trans	42.6	125.8	134.3	-64.6	0	0	0	0	122.3
103	T	25.5	Very low	26.3	Very low	141 Å²	141	153.5 Å²	153.5	87%	0.865	81%	0.809	S	S	*	*			trans	86.6	46.6	156.7	67.9	0	0	0	0	119.5	F105	T103-F105 PolarHBondContact O-N 2.78Å
104	T	28.2	Very low	26.7	Very low	139 Å²	139	156.2 Å²	156.2	85%	0.853	81%	0.814	S	S	*	*			trans	-82.1	106.4	152.2	45.8	0	0	0	0	110.7	K106	T104-K106 PolarHBondContact O-N 2.84Å; T104-K106 VanDerWaalsContact O-N 3.15Å
105	F	27	Very low	27.3	Very low	203 Å²	203	158.2 Å²	158.2	89%	0.89	82%	0.816	S	S	*	*			trans	-34	111.3	164.3	-148.8	-106.3	0	0	0	111.4	T103 R107	T103-F105 PolarHBondContact O-N 2.78Å; F105-R107 PolarHBondContact O-N 3.1Å
106	K	27	Very low	27.8	Very low	198 Å²	198	159.2 Å²	159.2	86%	0.861	82%	0.817	S	S	*	*			trans	-60.2	100	175	-78.6	178.4	176.8	176.5	0	108.6	T104 R108	T104-K106 PolarHBondContact O-N 2.84Å; T104-K106 VanDerWaalsContact O-N 3.15Å; K106-R108 PolarHBondContact O-N 3.33Å
107	R	30.6	Very low	28.9	Very low	236 Å²	236	155.7 Å²	155.7	89%	0.891	81%	0.808	S	S	*	*			trans	-60.8	109.4	165.4	-164.8	178.1	-161.1	169	4.2	106.3	F105 Q109	F105-R107 PolarHBondContact O-N 3.1Å; R107-Q109 PolarHBondContact O-N 2.83Å
108	R	29.4	Very low	29.8	Very low	232 Å²	232	157 Å²	157	88%	0.875	81%	0.809	S	S	*	*			trans	-46.7	111.3	173.7	-78.1	178.2	172.5	170.8	-3.2	108.4	K106 I110	K106-R108 PolarHBondContact O-N 3.33Å; R108-I110 VanDerWaalsContact C-N 3.34Å; R108-I110 PolarHBondContact O-N 3.25Å; R108-I110 VanDerWaalsContact O-N 3.1Å
109	Q	26.9	Very low	31.6	Very low	189 Å²	189	151.1 Å²	151.1	88%	0.883	81%	0.81	S	S	*	*			trans	-66.1	101.9	159.1	-77.9	179.7	-10.7	0	0	105.3	R107 S111	R107-Q109 PolarHBondContact O-N 2.83Å; Q109-S111 PolarHBondContact O-N 3.29Å
110	I	29.8	Very low	33.8	Very low	151 Å²	151	149.1 Å²	149.1	77%	0.774	81%	0.808	S	S	*	*			trans	-77.1	106.4	161.5	-63.9	174.2	0	0	0	104.7	R108	R108-I110 VanDerWaalsContact C-N 3.34Å; R108-I110 PolarHBondContact O-N 3.25Å; R108-I110 VanDerWaalsContact O-N 3.1Å
111	S	26.4	Very low	36.5	Very low	100 Å²	100	148.3 Å²	148.3	70%	0.699	80%	0.797	S	S	*	*			trans	-69.4	153.8	165.6	40.1	0	0	0	0	110.5	Q109	Q109-S111 PolarHBondContact O-N 3.29Å
112	S	28.5	Very low	39.4	Very low	110 Å²	110	146.8 Å²	146.8	77%	0.769	77%	0.773	S	S	*	*			trans	73.9	123.6	-177.5	76.2	0	0	0	0	113.9
113	V	32	Very low	42.4	Very low	128 Å²	128	144.1 Å²	144.1	78%	0.776	75%	0.754	S	S	*	*			cis	-144	148.4	37.1	172.6	0	0	0	0	110.1	D115	V113-D115 PolarHBondContact O-N 3.02Å
114	Q	29.2	Very low	45.3	Very low	174 Å²	174	137.4 Å²	137.4	81%	0.813	71%	0.713	S	S	*	*			trans	-51.3	118.1	173.9	-65.6	155.4	-41.3	0	0	111.5
115	D	33.7	Very low	48.1	Very low	154 Å²	154	134.7 Å²	134.7	82%	0.824	71%	0.705	S	S	*	*			trans	-148.2	80.5	150	-86.7	-34.4	0	0	0	105.9	V113 E117	V113-D115 PolarHBondContact O-N 3.02Å; D115-E117 PolarHBondContact O-N 2.96Å
116	S	35.5	Very low	50.8	Low	118 Å²	118	131.6 Å²	131.6	83%	0.825	69%	0.691	S	S	*	*			trans	-70.6	81.3	165	49.5	0	0	0	0	108.9
117	E	42.4	Very low	53.5	Low	143 Å²	143	124.6 Å²	124.6	67%	0.668	67%	0.667	S	S	*	*			trans	-119.2	91.2	156.5	-75.6	-169.6	170.8	0	0	107.7	D115 G119 V120	D115-E117 PolarHBondContact O-N 2.96Å; E117-G119 PolarHBondContact O-N 3.2Å; E117-V120 HydrophobicContact CB-CG2 4.12Å
118	E	45.8	Very low	56	Low	201 Å²	201	119.2 Å²	119.2	94%	0.939	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.1	110.9	169.7	-79.6	-177.9	138.4	0	0	109.8
119	G	59.8	Low	58.6	Low	75 Å²	75	114 Å²	114	77%	0.773	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	90.7	0.5	160.9	0	0	0	0	0	118	E117 K121	E117-G119 PolarHBondContact O-N 3.2Å; G119-K121 PolarHBondContact O-N 2.89Å; G119-K121 VanDerWaalsContact O-N 3.08Å
120	V	74.4	Confident	61.4	Low	99 Å²	99	109.3 Å²	109.3	60%	0.6	62%	0.624	S	S	*	*			trans	-75.3	104.6	176.7	-174.6	0	0	0	0	110.4	E117 P122	E117-V120 HydrophobicContact CB-CG2 4.12Å; V120-P122 WeakPolarHBondContact O-CD 3.28Å
121	K	83.6	Confident	64.3	Low	136 Å²	136	104.1 Å²	104.1	59%	0.591	60%	0.596	S	S	*	*			trans	-63.5	124.8	176	-72.6	177.8	-176.6	167.9	0	110	G119 S123 T130	G119-K121 PolarHBondContact O-N 2.89Å; G119-K121 VanDerWaalsContact O-N 3.08Å; K121-S123 PolarHBondContact O-N 3.45Å; K121-S123 VanDerWaalsContact O-N 3.15Å; K121-T130 HydrophobicContact CB-CG2 4.44Å
122	P	87.2	Confident	67.2	Low	42 Å²	42	104.8 Å²	104.8	27%	0.273	60%	0.601	S	S	.	*			trans	-52.2	121.6	177.9	-29.5	34.9	0	0	0	112.1	V120 T130 F131 R134 R137	V120-P122 WeakPolarHBondContact O-CD 3.28Å; P122-T130 CarbonylContact O-C 3.56Å; P122-F131 WeakPolarHBondContact CD-O 3.45Å; P122-F131 PolarHBondContact O-N 3.1Å; P122-R134 HydrophobicContact CB-CB 4.48Å; P122-R134 HydrophobicContact CG-CB 4.3Å; P122-R137 HydrophobicContact CB-CB 4.2Å; P122-R137 HydrophobicContact CB-CG 4.47Å
123	S	87.5	Confident	70.3	Confident	57 Å²	57	103 Å²	103	40%	0.399	59%	0.585	S	S	.	*	B	Isolated β-bridge	trans	-105.7	154.2	-178.4	67.7	0	0	0	0	112.5	K121 K129 R137	K121-S123 PolarHBondContact O-N 3.45Å; K121-S123 VanDerWaalsContact O-N 3.15Å; S123-K129 CarbonylContact C-O 3.57Å; S123-K129 VanDerWaalsContact CA-O 3.25Å; S123-K129 WeakPolarHBondContact CA-O 3.38Å; S123-R137 WeakPolarHBondContact O-CD 3.42Å; S123-R137 VanDerWaalsContact O-CG 3.24Å; S123-R137 WeakPolarHBondContact O-CG 3.46Å
124	C	86.8	Confident	73.1	Confident	0 Å²	0	105.2 Å²	105.2	0%	0	58%	0.579	C	S	.	*			trans	-84.1	118	172.5	177.7	0	0	0	0	110	F126 C127 N128 K129 F131 H145	C124-F126 PolarHBondContact O-N 3.03Å; C124-F126 VanDerWaalsContact O-N 3.13Å; C124-C127 PolarHBondContact O-N 3.29Å; C124-C127 VanDerWaalsContact SG-SG 3.69Å; C124-N128 WeakPolarHBondContact O-CA 3.33Å; C124-N128 PolarHBondContact O-N 3.13Å; C124-N128 PolarHBondContact O-OD1 3.12Å; C124-K129 PolarHBondContact N-O 3.17Å; C124-F131 HydrophobicContact CB-CE2 4.02Å; C124-H145 VanDerWaalsContact SG-CD2 3.56Å; C124-H145 PolarHBondContact SG-NE2 3.3Å; C124-H145 VanDerWaalsContact SG-NE2 3.41Å
125	A	87.3	Confident	76	Confident	82 Å²	82	100.2 Å²	100.2	68%	0.678	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-22.6	179.5	0	0	0	0	0	114.6
126	F	83.2	Confident	78.6	Confident	138 Å²	138	93.2 Å²	93.2	61%	0.605	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-22	-178.1	-60	-79.5	0	0	0	114.1	C124 I141 H145	C124-F126 PolarHBondContact O-N 3.03Å; C124-F126 VanDerWaalsContact O-N 3.13Å; F126-I141 HydrophobicContact CD2-CD1 4.38Å; F126-I141 HydrophobicContact CD2-CG1 4.31Å; F126-I141 HydrophobicContact CD2-CG2 4.35Å; F126-I141 HydrophobicContact CE2-CD1 4.35Å; F126-I141 HydrophobicContact CE2-CG2 3.93Å; F126-H145 WeakPolarHBondContact CB-CE1 3.44Å; F126-H145 WeakPolarHBondContact CB-ND1 3.18Å; F126-H145 HydrophobicContact CD2-CB 4.07Å; F126-H145 AromaticContact CD2-CD2 3.94Å; F126-H145 AromaticContact CD2-CG 3.82Å; F126-H145 HydrophobicContact CE2-CB 4.45Å; F126-H145 HydrophobicContact CG-CB 4.33Å; F126-H145 AromaticContact CG-CG 3.85Å; F126-H145 AromaticContact CG-ND1 3.89Å
127	C	83.3	Confident	81.3	Confident	52 Å²	52	90.1 Å²	90.1	35%	0.351	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145	7.7	-176.6	70.5	0	0	0	0	114.7	C124 K129 H140 H145	C124-C127 PolarHBondContact O-N 3.29Å; C124-C127 VanDerWaalsContact SG-SG 3.69Å; C127-K129 PolarHBondContact O-N 3.37Å; C127-H140 PolarHBondContact SG-NE2 3Å; C127-H145 PolarHBondContact SG-NE2 3.45Å
128	N	83.5	Confident	83.6	Confident	122 Å²	122	85.9 Å²	85.9	65%	0.652	48%	0.484	S	S	*	.			trans	54.6	13.9	179.5	-61.9	-20.2	0	0	0	116.1	C124 T130	C124-N128 WeakPolarHBondContact O-CA 3.33Å; C124-N128 PolarHBondContact O-N 3.13Å; C124-N128 PolarHBondContact O-OD1 3.12Å; N128-T130 PolarHBondContact O-N 2.79Å
129	K	83.5	Confident	85.7	Confident	122 Å²	122	82.8 Å²	82.8	53%	0.53	46%	0.464	S	S	.	.			trans	-62.6	131.8	171.8	-76	-176.3	-177.7	-178.9	0	110.6	S123 C124 C127 F131	S123-K129 CarbonylContact C-O 3.57Å; S123-K129 VanDerWaalsContact CA-O 3.25Å; S123-K129 WeakPolarHBondContact CA-O 3.38Å; C124-K129 PolarHBondContact N-O 3.17Å; C127-K129 PolarHBondContact O-N 3.37Å; K129-F131 HydrophobicContact CB-CE2 3.78Å; K129-F131 HydrophobicContact CB-CZ 3.94Å; K129-F131 VanDerWaalsContact O-CD2 3.32Å; K129-F131 WeakPolarHBondContact O-CD2 3.45Å; K129-F131 WeakPolarHBondContact O-CE2 3.46Å
130	T	86.7	Confident	86.9	Confident	91 Å²	91	80.1 Å²	80.1	56%	0.558	43%	0.431	S	S	*	.	B	Isolated β-bridge	trans	-94.6	146.6	177.2	53.7	0	0	0	0	111.5	K121 P122 N128	K121-T130 HydrophobicContact CB-CG2 4.44Å; P122-T130 CarbonylContact O-C 3.56Å; N128-T130 PolarHBondContact O-N 2.79Å
131	F	89.4	Confident	87.4	Confident	43 Å²	43	76.3 Å²	76.3	19%	0.189	41%	0.407	C	S	.	.			trans	-128.4	154.1	-175.9	-63.8	-90.3	0	0	0	110.3	P122 C124 K129 T133 R137 H140	P122-F131 WeakPolarHBondContact CD-O 3.45Å; P122-F131 PolarHBondContact O-N 3.1Å; C124-F131 HydrophobicContact CB-CE2 4.02Å; K129-F131 HydrophobicContact CB-CE2 3.78Å; K129-F131 HydrophobicContact CB-CZ 3.94Å; K129-F131 VanDerWaalsContact O-CD2 3.32Å; K129-F131 WeakPolarHBondContact O-CD2 3.45Å; K129-F131 WeakPolarHBondContact O-CE2 3.46Å; F131-T133 VanDerWaalsContact C-N 3.28Å; F131-T133 PolarHBondContact O-N 3.13Å; F131-R137 HydrophobicContact CB-CB 3.97Å; F131-R137 VanDerWaalsContact CD2-CA 3.48Å; F131-R137 HydrophobicContact CD2-CB 3.49Å; F131-R137 VanDerWaalsContact CD2-CB 3.49Å; F131-R137 HydrophobicContact CD2-CG 3.66Å; F131-R137 HydrophobicContact CE2-CB 4.23Å; F131-R137 HydrophobicContact CE2-CG 4.13Å; F131-R137 HydrophobicContact CG-CB 3.77Å; F131-R137 HydrophobicContact CG-CG 4.44Å; F131-H140 HydrophobicContact CD1-CB 4.46Å; F131-H140 HydrophobicContact CE1-CB 3.48Å; F131-H140 VanDerWaalsContact CE1-CB 3.48Å; F131-H140 AromaticContact CE1-CG 3.84Å; F131-H140 HydrophobicContact CE2-CB 4.09Å; F131-H140 AromaticContact CE2-CD2 3.67Å; F131-H140 AromaticContact CE2-CG 3.93Å; F131-H140 HydrophobicContact CZ-CB 3.28Å; F131-H140 AromaticContact CZ-CD2 3.35Å; F131-H140 WeakPolarHBondContact CZ-CD2 3.45Å; F131-H140 AromaticContact CZ-CG 3.16Å; F131-H140 AromaticContact CZ-ND1 3.78Å
132	S	89	Confident	87.6	Confident	114 Å²	114	74.9 Å²	74.9	80%	0.797	40%	0.401	S	S	*	.	S	Bend	trans	-73.2	-20.8	175.6	52.7	0	0	0	0	113.3
133	T	92.5	Very high	87.5	Confident	71 Å²	71	74.1 Å²	74.1	44%	0.436	40%	0.396	S	S	.	.	S	Bend	trans	-144.1	150.3	179.4	65.2	0	0	0	0	110.9	F131 A135 G136 R137	F131-T133 VanDerWaalsContact C-N 3.28Å; F131-T133 PolarHBondContact O-N 3.13Å; T133-A135 VanDerWaalsContact C-N 3.3Å; T133-A135 PolarHBondContact O-N 3.25Å; T133-G136 WeakPolarHBondContact O-CA 3.44Å; T133-G136 PolarHBondContact O-N 3.31Å; T133-G136 PolarHBondContact OG1-N 2.86Å; T133-G136 VanDerWaalsContact OG1-N 3.13Å; T133-R137 PolarHBondContact O-N 3.04Å; T133-R137 VanDerWaalsContact O-N 3.11Å
134	R	90.6	Very high	87.2	Confident	176 Å²	176	76 Å²	76	66%	0.664	40%	0.401	S	S	*	.	H	α-helix	trans	-58.4	-41.2	175.4	-173.5	173.3	178.2	160.3	-0.2	111.7	P122 G136 R137 D138	P122-R134 HydrophobicContact CB-CB 4.48Å; P122-R134 HydrophobicContact CG-CB 4.3Å; R134-G136 VanDerWaalsContact C-N 3.28Å; R134-G136 PolarHBondContact O-N 3.18Å; R134-R137 WeakPolarHBondContact O-CB 3.45Å; R134-R137 PolarHBondContact O-N 2.94Å; R134-R137 VanDerWaalsContact O-N 3.12Å; R134-D138 VanDerWaalsContact O-CG 3.23Å; R134-D138 PolarHBondContact O-N 3.44Å
135	A	89.9	Confident	87	Confident	69 Å²	69	79.1 Å²	79.1	57%	0.57	42%	0.415	S	S	*	.	H	α-helix	trans	-60	-35.9	173.8	0	0	0	0	0	113	T133 R139	T133-A135 VanDerWaalsContact C-N 3.3Å; T133-A135 PolarHBondContact O-N 3.25Å; A135-R139 VanDerWaalsContact O-CB 3.31Å; A135-R139 WeakPolarHBondContact O-CB 3.46Å; A135-R139 PolarHBondContact O-N 2.94Å
136	G	88.9	Confident	86.9	Confident	6 Å²	6	81.9 Å²	81.9	6%	0.062	41%	0.412	C	S	.	.	H	α-helix	trans	-63.1	-46.4	173.2	0	0	0	0	0	112.2	T133 R134 R139 H140	T133-G136 WeakPolarHBondContact O-CA 3.44Å; T133-G136 PolarHBondContact O-N 3.31Å; T133-G136 PolarHBondContact OG1-N 2.86Å; T133-G136 VanDerWaalsContact OG1-N 3.13Å; R134-G136 VanDerWaalsContact C-N 3.28Å; R134-G136 PolarHBondContact O-N 3.18Å; G136-R139 PolarHBondContact O-N 3.33Å; G136-H140 PolarHBondContact O-N 3.05Å
137	R	91.3	Very high	87	Confident	53 Å²	53	85 Å²	85	20%	0.2	42%	0.42	C	S	.	.	H	α-helix	trans	-60	-47.6	174.5	-173	-75.6	-56.4	-114.5	9.6	111.5	P122 S123 F131 T133 R134 R139 H140 I141	P122-R137 HydrophobicContact CB-CB 4.2Å; P122-R137 HydrophobicContact CB-CG 4.47Å; S123-R137 WeakPolarHBondContact O-CD 3.42Å; S123-R137 VanDerWaalsContact O-CG 3.24Å; S123-R137 WeakPolarHBondContact O-CG 3.46Å; F131-R137 HydrophobicContact CB-CB 3.97Å; F131-R137 VanDerWaalsContact CD2-CA 3.48Å; F131-R137 HydrophobicContact CD2-CB 3.49Å; F131-R137 VanDerWaalsContact CD2-CB 3.49Å; F131-R137 HydrophobicContact CD2-CG 3.66Å; F131-R137 HydrophobicContact CE2-CB 4.23Å; F131-R137 HydrophobicContact CE2-CG 4.13Å; F131-R137 HydrophobicContact CG-CB 3.77Å; F131-R137 HydrophobicContact CG-CG 4.44Å; T133-R137 PolarHBondContact O-N 3.04Å; T133-R137 VanDerWaalsContact O-N 3.11Å; R134-R137 WeakPolarHBondContact O-CB 3.45Å; R134-R137 PolarHBondContact O-N 2.94Å; R134-R137 VanDerWaalsContact O-N 3.12Å; R137-R139 PolarHBondContact O-N 3.26Å; R137-H140 WeakPolarHBondContact O-CB 3.38Å; R137-H140 PolarHBondContact O-N 3.33Å; R137-H140 VanDerWaalsContact O-N 3.14Å; R137-I141 PolarHBondContact O-N 3.13Å
138	D	91.2	Very high	87	Confident	55 Å²	55	85.8 Å²	85.8	29%	0.294	42%	0.42	S	S	.	.	H	α-helix	trans	-64.6	-42.1	-178.8	-64.6	-21.9	0	0	0	111.7	R134 H140 I141 K142	R134-D138 VanDerWaalsContact O-CG 3.23Å; R134-D138 PolarHBondContact O-N 3.44Å; D138-H140 VanDerWaalsContact C-N 3.3Å; D138-H140 PolarHBondContact O-N 3.36Å; D138-I141 PolarHBondContact O-N 3Å; D138-K142 WeakPolarHBondContact O-CG 3.33Å; D138-K142 PolarHBondContact O-N 3.24Å
139	R	89.2	Confident	87.3	Confident	136 Å²	136	85.7 Å²	85.7	51%	0.513	41%	0.414	S	S	.	.	H	α-helix	trans	-60.6	-39.9	172.7	174.1	176.4	50.6	167.5	-3.1	111.9	A135 G136 R137 S143 T161	A135-R139 VanDerWaalsContact O-CB 3.31Å; A135-R139 WeakPolarHBondContact O-CB 3.46Å; A135-R139 PolarHBondContact O-N 2.94Å; G136-R139 PolarHBondContact O-N 3.33Å; R137-R139 PolarHBondContact O-N 3.26Å; R139-S143 WeakPolarHBondContact O-CB 3.35Å; R139-S143 PolarHBondContact O-N 3.41Å; R139-S143 PolarHBondContact O-OG 3.41Å; R139-T161 HydrophobicContact CG-CG2 4.01Å
140	H	85.6	Confident	87.7	Confident	18 Å²	18	83.6 Å²	83.6	8%	0.083	40%	0.403	C	S	.	.	H	α-helix	trans	-62.7	-47.2	173.6	162.9	76.3	0	0	0	112	C127 F131 G136 R137 D138 K142 S143 I144 H145	C127-H140 PolarHBondContact SG-NE2 3Å; F131-H140 HydrophobicContact CD1-CB 4.46Å; F131-H140 HydrophobicContact CE1-CB 3.48Å; F131-H140 VanDerWaalsContact CE1-CB 3.48Å; F131-H140 AromaticContact CE1-CG 3.84Å; F131-H140 HydrophobicContact CE2-CB 4.09Å; F131-H140 AromaticContact CE2-CD2 3.67Å; F131-H140 AromaticContact CE2-CG 3.93Å; F131-H140 HydrophobicContact CZ-CB 3.28Å; F131-H140 AromaticContact CZ-CD2 3.35Å; F131-H140 WeakPolarHBondContact CZ-CD2 3.45Å; F131-H140 AromaticContact CZ-CG 3.16Å; F131-H140 AromaticContact CZ-ND1 3.78Å; G136-H140 PolarHBondContact O-N 3.05Å; R137-H140 WeakPolarHBondContact O-CB 3.38Å; R137-H140 PolarHBondContact O-N 3.33Å; R137-H140 VanDerWaalsContact O-N 3.14Å; D138-H140 VanDerWaalsContact C-N 3.3Å; D138-H140 PolarHBondContact O-N 3.36Å; H140-K142 VanDerWaalsContact C-N 3.34Å; H140-K142 PolarHBondContact O-N 3.41Å; H140-S143 PolarHBondContact O-N 2.88Å; H140-S143 PolarHBondContact O-OG 3.45Å; H140-I144 WeakPolarHBondContact ND1-CG1 3.31Å; H140-I144 WeakPolarHBondContact O-CB 3.41Å; H140-I144 PolarHBondContact O-N 3.45Å; H140-H145 AromaticContact NE2-CD2 3.74Å; H140-H145 AromaticContact NE2-NE2 3.41Å; H140-H145 PolarHBondContact NE2-NE2 3.31Å
141	I	85.6	Confident	87.8	Confident	20 Å²	20	82.9 Å²	82.9	10%	0.103	40%	0.4	C	S	.	.	I	π-helix	trans	-58.1	-48	176.6	-69.7	178	0	0	0	110.8	F126 R137 D138 S143 H145 K146	F126-I141 HydrophobicContact CD2-CD1 4.38Å; F126-I141 HydrophobicContact CD2-CG1 4.31Å; F126-I141 HydrophobicContact CD2-CG2 4.35Å; F126-I141 HydrophobicContact CE2-CD1 4.35Å; F126-I141 HydrophobicContact CE2-CG2 3.93Å; R137-I141 PolarHBondContact O-N 3.13Å; D138-I141 PolarHBondContact O-N 3Å; I141-S143 VanDerWaalsContact C-N 3.34Å; I141-S143 PolarHBondContact O-N 3.48Å; I141-H145 HydrophobicContact CG2-CB 4.45Å; I141-H145 WeakPolarHBondContact O-CA 3.02Å; I141-H145 WeakPolarHBondContact O-CB 3.39Å; I141-H145 PolarHBondContact O-N 3.04Å; I141-K146 HydrophobicContact CG2-CG 4.33Å; I141-K146 PolarHBondContact O-N 3.21Å
142	K	86.9	Confident	87.4	Confident	106 Å²	106	81.3 Å²	81.3	46%	0.461	39%	0.394	S	S	.	.	I	π-helix	trans	-58.1	-45.9	178.2	-72.5	179.9	-179.1	-176.5	0	111.9	D138 H140 K146 R147 I148	D138-K142 WeakPolarHBondContact O-CG 3.33Å; D138-K142 PolarHBondContact O-N 3.24Å; H140-K142 VanDerWaalsContact C-N 3.34Å; H140-K142 PolarHBondContact O-N 3.41Å; K142-K146 CarbonylContact O-C 3.59Å; K142-R147 PolarHBondContact O-N 3.49Å; K142-R147 VanDerWaalsContact O-N 3.09Å; K142-I148 HydrophobicContact CB-CB 4.5Å; K142-I148 HydrophobicContact CB-CD1 4.26Å; K142-I148 HydrophobicContact CG-CD1 4.22Å; K142-I148 WeakPolarHBondContact O-CB 3.36Å; K142-I148 PolarHBondContact O-N 3.47Å
143	S	85.3	Confident	87.4	Confident	25 Å²	25	83.1 Å²	83.1	18%	0.175	39%	0.393	C	S	.	.	I	π-helix	trans	-80.7	-35.7	-174	55	0	0	0	0	115	R139 H140 I141 R147	R139-S143 WeakPolarHBondContact O-CB 3.35Å; R139-S143 PolarHBondContact O-N 3.41Å; R139-S143 PolarHBondContact O-OG 3.41Å; H140-S143 PolarHBondContact O-N 2.88Å; H140-S143 PolarHBondContact O-OG 3.45Å; I141-S143 VanDerWaalsContact C-N 3.34Å; I141-S143 PolarHBondContact O-N 3.48Å; S143-R147 WeakPolarHBondContact O-CA 3.45Å
144	I	80.8	Confident	87.1	Confident	98 Å²	98	85.7 Å²	85.7	50%	0.503	40%	0.4	S	S	.	.	I	π-helix	trans	-97.3	-48.6	-174.3	-59.5	-56.5	0	0	0	111.7	H140	H140-I144 WeakPolarHBondContact ND1-CG1 3.31Å; H140-I144 WeakPolarHBondContact O-CB 3.41Å; H140-I144 PolarHBondContact O-N 3.45Å
145	H	82.9	Confident	86.6	Confident	64 Å²	64	79.2 Å²	79.2	30%	0.296	38%	0.381	S	S	.	.	I	π-helix	trans	-89.9	-46.7	-173.6	-64.3	-69.6	0	0	0	111.9	C124 F126 C127 H140 I141 R147	C124-H145 VanDerWaalsContact SG-CD2 3.56Å; C124-H145 PolarHBondContact SG-NE2 3.3Å; C124-H145 VanDerWaalsContact SG-NE2 3.41Å; F126-H145 WeakPolarHBondContact CB-CE1 3.44Å; F126-H145 WeakPolarHBondContact CB-ND1 3.18Å; F126-H145 HydrophobicContact CD2-CB 4.07Å; F126-H145 AromaticContact CD2-CD2 3.94Å; F126-H145 AromaticContact CD2-CG 3.82Å; F126-H145 HydrophobicContact CE2-CB 4.45Å; F126-H145 HydrophobicContact CG-CB 4.33Å; F126-H145 AromaticContact CG-CG 3.85Å; F126-H145 AromaticContact CG-ND1 3.89Å; C127-H145 PolarHBondContact SG-NE2 3.45Å; H140-H145 AromaticContact NE2-CD2 3.74Å; H140-H145 AromaticContact NE2-NE2 3.41Å; H140-H145 PolarHBondContact NE2-NE2 3.31Å; I141-H145 HydrophobicContact CG2-CB 4.45Å; I141-H145 WeakPolarHBondContact O-CA 3.02Å; I141-H145 WeakPolarHBondContact O-CB 3.39Å; I141-H145 PolarHBondContact O-N 3.04Å; H145-R147 VanDerWaalsContact C-N 3.3Å
146	K	85.8	Confident	86.3	Confident	140 Å²	140	83.7 Å²	83.7	61%	0.609	40%	0.396	S	S	*	.	S	Bend	trans	-83.1	-6.9	174.4	-56	-168.8	173	-166	0	113.4	I141 K142 I148	I141-K146 HydrophobicContact CG2-CG 4.33Å; I141-K146 PolarHBondContact O-N 3.21Å; K142-K146 CarbonylContact O-C 3.59Å; K146-I148 HydrophobicContact CB-CD1 3.84Å; K146-I148 HydrophobicContact CB-CG1 3.82Å; K146-I148 HydrophobicContact CD-CD1 4.16Å; K146-I148 PolarHBondContact O-N 3.22Å
147	R	84.5	Confident	86.1	Confident	204 Å²	204	91 Å²	91	77%	0.77	42%	0.422	S	S	*	.			trans	50.9	25.4	-180	-59.5	-177.6	178.6	-165.7	1.4	114.8	K142 S143 H145 K149	K142-R147 PolarHBondContact O-N 3.49Å; K142-R147 VanDerWaalsContact O-N 3.09Å; S143-R147 WeakPolarHBondContact O-CA 3.45Å; H145-R147 VanDerWaalsContact C-N 3.3Å; R147-K149 PolarHBondContact O-N 3.32Å
148	I	85.1	Confident	85.8	Confident	68 Å²	68	95.3 Å²	95.3	35%	0.349	44%	0.442	S	S	.	.			trans	-68.8	119.6	179.2	-59.6	172.1	0	0	0	108.2	K142 K146	K142-I148 HydrophobicContact CB-CB 4.5Å; K142-I148 HydrophobicContact CB-CD1 4.26Å; K142-I148 HydrophobicContact CG-CD1 4.22Å; K142-I148 WeakPolarHBondContact O-CB 3.36Å; K142-I148 PolarHBondContact O-N 3.47Å; K146-I148 HydrophobicContact CB-CD1 3.84Å; K146-I148 HydrophobicContact CB-CG1 3.82Å; K146-I148 HydrophobicContact CD-CD1 4.16Å; K146-I148 PolarHBondContact O-N 3.22Å
149	K	89.2	Confident	85.7	Confident	121 Å²	121	94.5 Å²	94.5	53%	0.526	44%	0.436	S	S	.	.			trans	-124.1	153.6	173.1	-60.6	-177.5	-177.8	176.5	0	109.5	R147 P151 K158 F159	R147-K149 PolarHBondContact O-N 3.32Å; K149-P151 WeakPolarHBondContact O-CD 3.35Å; K149-K158 HydrophobicContact CB-CB 3.96Å; K149-K158 HydrophobicContact CD-CB 3.93Å; K149-F159 CarbonylContact C-O 3.59Å; K149-F159 VanDerWaalsContact CA-O 3.28Å; K149-F159 WeakPolarHBondContact CA-O 3.17Å
150	Y	91.2	Very high	85.6	Confident	78 Å²	78	91.8 Å²	91.8	31%	0.306	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	102.2	178.4	-60.6	-87.8	0	0	0	108.3	F159 K162	Y150-F159 PolarHBondContact N-O 2.89Å; Y150-F159 PolarHBondContact O-N 3.5Å; Y150-K162 HydrophobicContact CD1-CB 4.13Å; Y150-K162 HydrophobicContact CE1-CB 4.05Å; Y150-K162 HydrophobicContact CG-CB 4.47Å
151	P	88	Confident	85.7	Confident	75 Å²	75	91.8 Å²	91.8	49%	0.487	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	146.6	179.5	29.8	-34	0	0	0	111.7	K149 K158 L165	K149-P151 WeakPolarHBondContact O-CD 3.35Å; P151-K158 HydrophobicContact CB-CG 4.16Å; P151-L165 WeakPolarHBondContact O-CD2 3.07Å
152	C	82.7	Confident	85.9	Confident	11 Å²	11	97.4 Å²	97.4	7%	0.074	46%	0.459	C	S	.	.			trans	-79.7	142.4	163.1	-166.9	0	0	0	0	109.6	C155 R157 F159 L165 H173	C152-C155 CarbonylContact C-O 3.57Å; C152-C155 WeakPolarHBondContact CB-O 3.35Å; C152-R157 PolarHBondContact N-O 3.48Å; C152-F159 HydrophobicContact CB-CE2 4.47Å; C152-L165 HydrophobicContact CB-CD1 3.74Å; C152-H173 PolarHBondContact SG-NE2 2.7Å
153	I	87.5	Confident	86	Confident	152 Å²	152	98.1 Å²	98.1	78%	0.779	46%	0.463	S	S	*	.	S	Bend	trans	-81.6	-25.5	178	-59.5	168.3	0	0	0	110.3
154	Q	87.6	Confident	86.1	Confident	125 Å²	125	101.2 Å²	101.2	58%	0.584	47%	0.474	S	S	*	.	S	Bend	trans	-99.5	-0.3	-174.6	-68.5	166.3	-25.3	0	0	113	H173	Q154-H173 WeakPolarHBondContact CB-CE1 3.33Å; Q154-H173 WeakPolarHBondContact CB-NE2 3.39Å; Q154-H173 PolarHBondContact O-CE1 2.94Å; Q154-H173 PolarHBondContact OE1-CD2 3.48Å
155	C	80.5	Confident	86.5	Confident	39 Å²	39	97.4 Å²	97.4	26%	0.264	46%	0.455	S	S	.	.	S	Bend	trans	-165.4	166.7	171	68.8	0	0	0	0	111.9	C152 R157 H168	C152-C155 CarbonylContact C-O 3.57Å; C152-C155 WeakPolarHBondContact CB-O 3.35Å; C155-R157 PolarHBondContact O-N 3Å; C155-H168 PolarHBondContact SG-NE2 2.92Å
156	D	83.3	Confident	86.7	Confident	163 Å²	163	97.9 Å²	97.9	87%	0.872	46%	0.459	S	S	*	.	S	Bend	trans	-71.6	5.6	-175.8	-57.1	-44.8	0	0	0	115.6
157	R	83.1	Confident	86.7	Confident	161 Å²	161	93.1 Å²	93.1	61%	0.608	44%	0.438	S	S	*	.			trans	-74.9	132.2	-178	-68.4	-175.1	-179.7	-105.5	0.4	111.2	C152 C155 F159	C152-R157 PolarHBondContact N-O 3.48Å; C155-R157 PolarHBondContact O-N 3Å; R157-F159 HydrophobicContact CB-CE2 3.69Å; R157-F159 HydrophobicContact CB-CZ 3.8Å
158	K	87	Confident	86.6	Confident	142 Å²	142	84.1 Å²	84.1	62%	0.617	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.5	134	176.4	-55.8	-176.3	-178.6	178.9	0	110.4	K149 P151	K149-K158 HydrophobicContact CB-CB 3.96Å; K149-K158 HydrophobicContact CD-CB 3.93Å; P151-K158 HydrophobicContact CB-CG 4.16Å
159	F	87.9	Confident	86.6	Confident	39 Å²	39	83.7 Å²	83.7	17%	0.171	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	151.8	-173.5	-61.9	-89.9	0	0	0	112.2	K149 Y150 C152 R157 T161 H164 L165 H168	K149-F159 CarbonylContact C-O 3.59Å; K149-F159 VanDerWaalsContact CA-O 3.28Å; K149-F159 WeakPolarHBondContact CA-O 3.17Å; Y150-F159 PolarHBondContact N-O 2.89Å; Y150-F159 PolarHBondContact O-N 3.5Å; C152-F159 HydrophobicContact CB-CE2 4.47Å; R157-F159 HydrophobicContact CB-CE2 3.69Å; R157-F159 HydrophobicContact CB-CZ 3.8Å; F159-T161 VanDerWaalsContact C-N 3.34Å; F159-H164 HydrophobicContact CB-CB 4.22Å; F159-H164 HydrophobicContact CD1-CB 3.85Å; F159-H164 HydrophobicContact CG-CB 4.35Å; F159-L165 HydrophobicContact CB-CB 4.16Å; F159-L165 HydrophobicContact CD2-CB 3.88Å; F159-L165 HydrophobicContact CD2-CD1 3.67Å; F159-L165 HydrophobicContact CD2-CG 4.39Å; F159-L165 HydrophobicContact CE2-CD1 3.91Å; F159-L165 HydrophobicContact CG-CB 4.14Å; F159-H168 HydrophobicContact CE1-CB 3.66Å; F159-H168 AromaticContact CE1-CG 3.98Å; F159-H168 HydrophobicContact CE2-CB 3.85Å; F159-H168 AromaticContact CE2-CD2 3.35Å; F159-H168 WeakPolarHBondContact CE2-CD2 3.36Å; F159-H168 AromaticContact CE2-CG 3.57Å; F159-H168 AromaticContact CE2-NE2 3.99Å; F159-H168 HydrophobicContact CZ-CB 3.29Å; F159-H168 AromaticContact CZ-CD2 3.42Å; F159-H168 VanDerWaalsContact CZ-CD2 3.42Å; F159-H168 WeakPolarHBondContact CZ-CD2 3.46Å; F159-H168 AromaticContact CZ-CG 3.11Å; F159-H168 AromaticContact CZ-ND1 3.61Å
160	T	87.3	Confident	86.4	Confident	78 Å²	78	81.6 Å²	81.6	48%	0.479	39%	0.392	S	S	.	.	S	Bend	trans	-80.2	-16	179.4	58.7	0	0	0	0	113.6
161	T	87.6	Confident	86	Confident	19 Å²	19	79.2 Å²	79.2	12%	0.117	39%	0.385	C	S	.	.	S	Bend	trans	-139.6	149.5	175.5	76.4	0	0	0	0	111.1	R139 F159 F163 H164 L165	R139-T161 HydrophobicContact CG-CG2 4.01Å; F159-T161 VanDerWaalsContact C-N 3.34Å; T161-F163 PolarHBondContact O-N 3.34Å; T161-H164 PolarHBondContact O-N 3.27Å; T161-H164 PolarHBondContact OG1-N 3.16Å; T161-H164 PolarHBondContact OG1-ND1 3.01Å; T161-L165 PolarHBondContact O-N 3.06Å
162	K	90	Very high	85.6	Confident	137 Å²	137	80.7 Å²	80.7	60%	0.596	39%	0.388	S	S	*	.	H	α-helix	trans	-56	-38.3	174.4	-169.9	175.4	-178.4	177.4	0	112.2	Y150 H164 L165 I166	Y150-K162 HydrophobicContact CD1-CB 4.13Å; Y150-K162 HydrophobicContact CE1-CB 4.05Å; Y150-K162 HydrophobicContact CG-CB 4.47Å; K162-H164 PolarHBondContact O-N 2.96Å; K162-L165 WeakPolarHBondContact O-CB 3.47Å; K162-L165 PolarHBondContact O-N 2.77Å; K162-I166 HydrophobicContact CG-CD1 4.14Å; K162-I166 WeakPolarHBondContact O-CG1 3.49Å; K162-I166 PolarHBondContact O-N 3.06Å
163	F	88.9	Confident	85.5	Confident	122 Å²	122	83.1 Å²	83.1	54%	0.535	40%	0.398	S	S	.	.	H	α-helix	trans	-55.8	-49.3	175.5	174.9	-97.3	0	0	0	112.6	T161 L165 I166 E167	T161-F163 PolarHBondContact O-N 3.34Å; F163-L165 VanDerWaalsContact C-N 3.31Å; F163-L165 PolarHBondContact O-N 3.12Å; F163-I166 PolarHBondContact O-N 3.11Å; F163-E167 HydrophobicContact CD1-CG 4.35Å; F163-E167 HydrophobicContact CD2-CG 4.49Å; F163-E167 HydrophobicContact CE1-CG 3.85Å; F163-E167 HydrophobicContact CE2-CG 4Å; F163-E167 HydrophobicContact CZ-CG 3.65Å; F163-E167 WeakPolarHBondContact O-CG 3.43Å; F163-E167 PolarHBondContact O-N 3.16Å
164	H	88.2	Confident	85.3	Confident	89 Å²	89	81.7 Å²	81.7	41%	0.412	39%	0.388	S	S	.	.	H	α-helix	trans	-68.4	-31.4	-179.7	-67.5	102.2	0	0	0	112.5	F159 T161 K162 H168	F159-H164 HydrophobicContact CB-CB 4.22Å; F159-H164 HydrophobicContact CD1-CB 3.85Å; F159-H164 HydrophobicContact CG-CB 4.35Å; T161-H164 PolarHBondContact O-N 3.27Å; T161-H164 PolarHBondContact OG1-N 3.16Å; T161-H164 PolarHBondContact OG1-ND1 3.01Å; K162-H164 PolarHBondContact O-N 2.96Å; H164-H168 VanDerWaalsContact O-CB 3.25Å; H164-H168 WeakPolarHBondContact O-CB 3.42Å; H164-H168 PolarHBondContact O-N 3.15Å
165	L	88.5	Confident	84.8	Confident	19 Å²	19	78 Å²	78	10%	0.099	38%	0.383	C	S	.	.	H	α-helix	trans	-63.1	-44.5	171.6	171.9	63	0	0	0	111.2	P151 C152 F159 T161 K162 F163 H168 K169	P151-L165 WeakPolarHBondContact O-CD2 3.07Å; C152-L165 HydrophobicContact CB-CD1 3.74Å; F159-L165 HydrophobicContact CB-CB 4.16Å; F159-L165 HydrophobicContact CD2-CB 3.88Å; F159-L165 HydrophobicContact CD2-CD1 3.67Å; F159-L165 HydrophobicContact CD2-CG 4.39Å; F159-L165 HydrophobicContact CE2-CD1 3.91Å; F159-L165 HydrophobicContact CG-CB 4.14Å; T161-L165 PolarHBondContact O-N 3.06Å; K162-L165 WeakPolarHBondContact O-CB 3.47Å; K162-L165 PolarHBondContact O-N 2.77Å; F163-L165 VanDerWaalsContact C-N 3.31Å; F163-L165 PolarHBondContact O-N 3.12Å; L165-H168 WeakPolarHBondContact O-CB 3.34Å; L165-H168 PolarHBondContact O-N 2.96Å; L165-K169 HydrophobicContact CD1-CG 4.31Å; L165-K169 WeakPolarHBondContact O-CG 3.17Å; L165-K169 PolarHBondContact O-N 3.26Å
166	I	87.6	Confident	84.8	Confident	74 Å²	74	80.9 Å²	80.9	38%	0.379	40%	0.395	S	S	.	.	H	α-helix	trans	-62.5	-48.1	178	-68.4	166.5	0	0	0	110.6	K162 F163 H168 K169 K170	K162-I166 HydrophobicContact CG-CD1 4.14Å; K162-I166 WeakPolarHBondContact O-CG1 3.49Å; K162-I166 PolarHBondContact O-N 3.06Å; F163-I166 PolarHBondContact O-N 3.11Å; I166-H168 VanDerWaalsContact C-N 3.29Å; I166-H168 PolarHBondContact O-N 2.78Å; I166-K169 PolarHBondContact O-N 3.46Å; I166-K169 VanDerWaalsContact O-N 3.16Å; I166-K170 HydrophobicContact CG2-CD 4.46Å; I166-K170 WeakPolarHBondContact O-CG 3.42Å; I166-K170 PolarHBondContact O-N 3.23Å
167	E	84.8	Confident	84.9	Confident	39 Å²	39	75.9 Å²	75.9	18%	0.182	37%	0.368	C	S	.	.	H	α-helix	trans	-63	-37	178.1	-68.1	-65.5	106	0	0	112	F163 K170 V171	F163-E167 HydrophobicContact CD1-CG 4.35Å; F163-E167 HydrophobicContact CD2-CG 4.49Å; F163-E167 HydrophobicContact CE1-CG 3.85Å; F163-E167 HydrophobicContact CE2-CG 4Å; F163-E167 HydrophobicContact CZ-CG 3.65Å; F163-E167 WeakPolarHBondContact O-CG 3.43Å; F163-E167 PolarHBondContact O-N 3.16Å; E167-K170 PolarHBondContact O-N 3.41Å; E167-K170 IonicContact OE1-NZ 3.84Å; E167-K170 PolarHBondContact OE1-NZ 3.48Å; E167-V171 WeakPolarHBondContact O-CG2 3.37Å; E167-V171 PolarHBondContact O-N 3.21Å; E167-V171 VanDerWaalsContact O-N 3.09Å
168	H	83.4	Confident	85	Confident	16 Å²	16	71.6 Å²	71.6	7%	0.074	36%	0.357	C	S	.	.	H	α-helix	trans	-61.6	-46.7	171.8	162.1	69.9	0	0	0	112.4	C155 F159 H164 L165 I166 K170 V171 I172 H173	C155-H168 PolarHBondContact SG-NE2 2.92Å; F159-H168 HydrophobicContact CE1-CB 3.66Å; F159-H168 AromaticContact CE1-CG 3.98Å; F159-H168 HydrophobicContact CE2-CB 3.85Å; F159-H168 AromaticContact CE2-CD2 3.35Å; F159-H168 WeakPolarHBondContact CE2-CD2 3.36Å; F159-H168 AromaticContact CE2-CG 3.57Å; F159-H168 AromaticContact CE2-NE2 3.99Å; F159-H168 HydrophobicContact CZ-CB 3.29Å; F159-H168 AromaticContact CZ-CD2 3.42Å; F159-H168 VanDerWaalsContact CZ-CD2 3.42Å; F159-H168 WeakPolarHBondContact CZ-CD2 3.46Å; F159-H168 AromaticContact CZ-CG 3.11Å; F159-H168 AromaticContact CZ-ND1 3.61Å; H164-H168 VanDerWaalsContact O-CB 3.25Å; H164-H168 WeakPolarHBondContact O-CB 3.42Å; H164-H168 PolarHBondContact O-N 3.15Å; L165-H168 WeakPolarHBondContact O-CB 3.34Å; L165-H168 PolarHBondContact O-N 2.96Å; I166-H168 VanDerWaalsContact C-N 3.29Å; I166-H168 PolarHBondContact O-N 2.78Å; H168-K170 VanDerWaalsContact C-N 3.34Å; H168-K170 PolarHBondContact O-N 2.85Å; H168-V171 PolarHBondContact O-N 2.94Å; H168-I172 VanDerWaalsContact ND1-CG1 3.32Å; H168-I172 WeakPolarHBondContact ND1-CG1 3.3Å; H168-I172 WeakPolarHBondContact O-CB 3.49Å; H168-I172 PolarHBondContact O-N 2.92Å; H168-H173 AromaticContact CE1-NE2 3.87Å; H168-H173 AromaticContact NE2-CD2 3.85Å; H168-H173 AromaticContact NE2-NE2 3.33Å; H168-H173 PolarHBondContact NE2-NE2 2.77Å
169	K	85.4	Confident	85	Confident	58 Å²	58	67.8 Å²	67.8	25%	0.252	35%	0.348	S	S	.	.	I	π-helix	trans	-60	-44.5	178.3	-74.9	-174.7	177.8	-168.8	0	111.6	L165 I166 V171 H173 Q174	L165-K169 HydrophobicContact CD1-CG 4.31Å; L165-K169 WeakPolarHBondContact O-CG 3.17Å; L165-K169 PolarHBondContact O-N 3.26Å; I166-K169 PolarHBondContact O-N 3.46Å; I166-K169 VanDerWaalsContact O-N 3.16Å; K169-V171 PolarHBondContact O-N 2.92Å; K169-H173 WeakPolarHBondContact O-CB 3.49Å; K169-H173 PolarHBondContact O-N 3.03Å; K169-H173 VanDerWaalsContact O-N 3.07Å; K169-Q174 PolarHBondContact O-N 3.43Å
170	K	84.9	Confident	85	Confident	78 Å²	78	66.3 Å²	66.3	34%	0.339	34%	0.343	S	S	.	.	I	π-helix	trans	-56.6	-51.4	175.9	-72.3	178	-174	168.8	0	111.7	I166 E167 H168 Q174 G175 I176	I166-K170 HydrophobicContact CG2-CD 4.46Å; I166-K170 WeakPolarHBondContact O-CG 3.42Å; I166-K170 PolarHBondContact O-N 3.23Å; E167-K170 PolarHBondContact O-N 3.41Å; E167-K170 IonicContact OE1-NZ 3.84Å; E167-K170 PolarHBondContact OE1-NZ 3.48Å; H168-K170 VanDerWaalsContact C-N 3.34Å; H168-K170 PolarHBondContact O-N 2.85Å; K170-Q174 CarbonylContact O-C 3.45Å; K170-Q174 WeakPolarHBondContact O-CB 3.33Å; K170-Q174 PolarHBondContact O-N 3.49Å; K170-G175 PolarHBondContact O-N 3.29Å; K170-G175 VanDerWaalsContact O-N 3.14Å; K170-I176 CarbonylContact C-O 3.59Å; K170-I176 HydrophobicContact CB-CB 4.36Å; K170-I176 PolarHBondContact O-N 2.84Å
171	V	82.5	Confident	85	Confident	28 Å²	28	70.3 Å²	70.3	17%	0.17	36%	0.361	C	S	.	.	I	π-helix	trans	-78.3	-43.7	-172.2	178.9	0	0	0	0	112.8	E167 H168 K169 I176 N177 T188	E167-V171 WeakPolarHBondContact O-CG2 3.37Å; E167-V171 PolarHBondContact O-N 3.21Å; E167-V171 VanDerWaalsContact O-N 3.09Å; H168-V171 PolarHBondContact O-N 2.94Å; K169-V171 PolarHBondContact O-N 2.92Å; V171-I176 WeakPolarHBondContact CA-O 3.46Å; V171-I176 WeakPolarHBondContact CG2-O 3.39Å; V171-N177 HydrophobicContact CG1-CB 4.42Å; V171-T188 HydrophobicContact CB-CG2 4.29Å; V171-T188 HydrophobicContact CG1-CG2 3.85Å; V171-T188 HydrophobicContact CG2-CG2 3.89Å
172	I	78.7	Confident	84.8	Confident	105 Å²	105	76.2 Å²	76.2	54%	0.538	39%	0.385	S	S	.	.	I	π-helix	trans	-87.5	-39.5	-170.8	-60.1	-57.3	0	0	0	112.3	H168	H168-I172 VanDerWaalsContact ND1-CG1 3.32Å; H168-I172 WeakPolarHBondContact ND1-CG1 3.3Å; H168-I172 WeakPolarHBondContact O-CB 3.49Å; H168-I172 PolarHBondContact O-N 2.92Å
173	H	80	Confident	84.6	Confident	63 Å²	63	71.5 Å²	71.5	29%	0.292	37%	0.369	S	S	.	.	I	π-helix	trans	-103.4	-34.3	-172.5	-60.3	-61.7	0	0	0	113.1	C152 Q154 H168 K169	C152-H173 PolarHBondContact SG-NE2 2.7Å; Q154-H173 WeakPolarHBondContact CB-CE1 3.33Å; Q154-H173 WeakPolarHBondContact CB-NE2 3.39Å; Q154-H173 PolarHBondContact O-CE1 2.94Å; Q154-H173 PolarHBondContact OE1-CD2 3.48Å; H168-H173 AromaticContact CE1-NE2 3.87Å; H168-H173 AromaticContact NE2-CD2 3.85Å; H168-H173 AromaticContact NE2-NE2 3.33Å; H168-H173 PolarHBondContact NE2-NE2 2.77Å; K169-H173 WeakPolarHBondContact O-CB 3.49Å; K169-H173 PolarHBondContact O-N 3.03Å; K169-H173 VanDerWaalsContact O-N 3.07Å
174	Q	84.5	Confident	84.3	Confident	122 Å²	122	73.6 Å²	73.6	57%	0.57	39%	0.386	S	S	*	.	S	Bend	trans	-93.9	-7.2	176.7	-58.3	172.5	-19	0	0	112.3	K169 K170 I176	K169-Q174 PolarHBondContact O-N 3.43Å; K170-Q174 CarbonylContact O-C 3.45Å; K170-Q174 WeakPolarHBondContact O-CB 3.33Å; K170-Q174 PolarHBondContact O-N 3.49Å; Q174-I176 HydrophobicContact CB-CD1 3.85Å; Q174-I176 HydrophobicContact CB-CG1 3.83Å; Q174-I176 PolarHBondContact O-N 2.77Å; Q174-I176 VanDerWaalsContact O-N 3.09Å
175	G	77.7	Confident	84.1	Confident	46 Å²	46	76.8 Å²	76.8	47%	0.474	39%	0.394	S	S	.	.			trans	66.2	6.1	-177.7	0	0	0	0	0	114.6	K170 N177	K170-G175 PolarHBondContact O-N 3.29Å; K170-G175 VanDerWaalsContact O-N 3.14Å; G175-N177 PolarHBondContact O-N 2.83Å; G175-N177 PolarHBondContact O-ND2 3.1Å
176	I	80.7	Confident	84	Confident	101 Å²	101	80.2 Å²	80.2	52%	0.518	41%	0.413	S	S	.	.			trans	-75.8	96.9	-177.7	-54.9	173.9	0	0	0	108	K170 V171 Q174	K170-I176 CarbonylContact C-O 3.59Å; K170-I176 HydrophobicContact CB-CB 4.36Å; K170-I176 PolarHBondContact O-N 2.84Å; V171-I176 WeakPolarHBondContact CA-O 3.46Å; V171-I176 WeakPolarHBondContact CG2-O 3.39Å; Q174-I176 HydrophobicContact CB-CD1 3.85Å; Q174-I176 HydrophobicContact CB-CG1 3.83Å; Q174-I176 PolarHBondContact O-N 2.77Å; Q174-I176 VanDerWaalsContact O-N 3.09Å
177	N	85	Confident	83.9	Confident	58 Å²	58	78 Å²	78	31%	0.31	40%	0.401	S	S	.	.			trans	-120.6	164.2	172.5	63.8	57.7	0	0	0	109.8	V171 G175 N186	V171-N177 HydrophobicContact CG1-CB 4.42Å; G175-N177 PolarHBondContact O-N 2.83Å; G175-N177 PolarHBondContact O-ND2 3.1Å; N177-N186 HydrophobicContact CB-CB 4.12Å; N177-N186 PolarHBondContact ND2-ND2 2.95Å; N177-N186 WeakPolarHBondContact OD1-CB 3.39Å; N177-N186 PolarHBondContact OD1-ND2 2.91Å
178	L	85.6	Confident	83.8	Confident	70 Å²	70	78.9 Å²	78.9	37%	0.366	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	105.7	176	-59.7	173.2	0	0	0	108.3	N186 F187 T189 K190 L193	L178-N186 CarbonylContact O-C 3.57Å; L178-F187 PolarHBondContact N-O 3.22Å; L178-F187 PolarHBondContact O-N 3.24Å; L178-T189 VanDerWaalsContact CD1-C 3.49Å; L178-K190 VanDerWaalsContact CD1-CA 3.49Å; L178-K190 HydrophobicContact CD1-CB 3.97Å; L178-L193 HydrophobicContact CB-CB 4.45Å; L178-L193 HydrophobicContact CB-CD2 3.91Å
179	S	85.4	Confident	83.9	Confident	62 Å²	62	80 Å²	80	43%	0.434	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	156.3	174.8	52	0	0	0	0	111.5	N186	S179-N186 WeakPolarHBondContact CA-OD1 3.29Å; S179-N186 WeakPolarHBondContact CB-OD1 3.26Å
180	C	87.8	Confident	84	Confident	9 Å²	9	84.3 Å²	84.3	6%	0.061	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	129.4	168.8	-177.4	0	0	0	0	110.2	K182 C183 R185 F187 L193 H201	C180-K182 PolarHBondContact O-N 2.77Å; C180-K182 VanDerWaalsContact O-N 3.1Å; C180-C183 PolarHBondContact O-N 2.89Å; C180-R185 PolarHBondContact N-O 3.15Å; C180-F187 HydrophobicContact CB-CE2 4.38Å; C180-L193 HydrophobicContact CB-CD1 3.79Å; C180-H201 PolarHBondContact SG-NE2 3.18Å
181	D	87.9	Confident	84.3	Confident	161 Å²	161	85.2 Å²	85.2	86%	0.861	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-11.8	-178.9	-49.9	-33.5	0	0	0	113.6
182	K	83.8	Confident	84.6	Confident	144 Å²	144	86.8 Å²	86.8	63%	0.626	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-5.9	-178.3	-62.8	-179.1	-178.6	-178.6	0	113.6	C180 H201	C180-K182 PolarHBondContact O-N 2.77Å; C180-K182 VanDerWaalsContact O-N 3.1Å; K182-H201 VanDerWaalsContact CB-CE1 3.4Å; K182-H201 WeakPolarHBondContact CB-CE1 3.49Å; K182-H201 HydrophobicContact CD-CB 3.79Å
183	C	86.1	Confident	85.2	Confident	38 Å²	38	82.9 Å²	82.9	26%	0.257	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	163	174	71.1	0	0	0	0	112.6	C180 R185 H196	C180-C183 PolarHBondContact O-N 2.89Å; C183-R185 PolarHBondContact O-N 2.81Å; C183-H196 VanDerWaalsContact SG-CE1 3.57Å; C183-H196 PolarHBondContact SG-NE2 3.38Å
184	D	82.8	Confident	85.8	Confident	166 Å²	166	83.3 Å²	83.3	89%	0.888	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	26.3	-174.8	-48	-45.1	0	0	0	115.3
185	R	84	Confident	86.2	Confident	155 Å²	155	83.4 Å²	83.4	59%	0.585	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	128.8	179.3	-70.1	-166.5	179.2	-158.8	1.5	111.6	C180 C183 F187	C180-R185 PolarHBondContact N-O 3.15Å; C183-R185 PolarHBondContact O-N 2.81Å; R185-F187 HydrophobicContact CB-CE2 3.63Å; R185-F187 HydrophobicContact CB-CZ 3.69Å; R185-F187 WeakPolarHBondContact O-CE2 3.34Å
186	N	85.7	Confident	86.9	Confident	91 Å²	91	81.8 Å²	81.8	49%	0.487	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	143.4	178	-64.6	-15.1	0	0	0	111.3	N177 L178 S179	N177-N186 HydrophobicContact CB-CB 4.12Å; N177-N186 PolarHBondContact ND2-ND2 2.95Å; N177-N186 WeakPolarHBondContact OD1-CB 3.39Å; N177-N186 PolarHBondContact OD1-ND2 2.91Å; L178-N186 CarbonylContact O-C 3.57Å; S179-N186 WeakPolarHBondContact CA-OD1 3.29Å; S179-N186 WeakPolarHBondContact CB-OD1 3.26Å
187	F	85.9	Confident	87.4	Confident	29 Å²	29	78.8 Å²	78.8	13%	0.127	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	148.6	-175.1	-59.9	-84.4	0	0	0	111.6	L178 C180 R185 Q192 L193 H196	L178-F187 PolarHBondContact N-O 3.22Å; L178-F187 PolarHBondContact O-N 3.24Å; C180-F187 HydrophobicContact CB-CE2 4.38Å; R185-F187 HydrophobicContact CB-CE2 3.63Å; R185-F187 HydrophobicContact CB-CZ 3.69Å; R185-F187 WeakPolarHBondContact O-CE2 3.34Å; F187-Q192 HydrophobicContact CB-CB 4.08Å; F187-Q192 HydrophobicContact CD1-CB 3.84Å; F187-Q192 HydrophobicContact CG-CB 4.3Å; F187-L193 HydrophobicContact CB-CB 4.02Å; F187-L193 HydrophobicContact CD2-CB 3.88Å; F187-L193 HydrophobicContact CD2-CD1 3.53Å; F187-L193 HydrophobicContact CD2-CG 4.3Å; F187-L193 HydrophobicContact CE2-CD1 3.81Å; F187-L193 HydrophobicContact CG-CB 4.04Å; F187-H196 HydrophobicContact CD1-CB 4.48Å; F187-H196 HydrophobicContact CE1-CB 3.58Å; F187-H196 AromaticContact CE1-CG 3.98Å; F187-H196 HydrophobicContact CE2-CB 3.82Å; F187-H196 AromaticContact CE2-CD2 3.28Å; F187-H196 WeakPolarHBondContact CE2-CD2 3.35Å; F187-H196 AromaticContact CE2-CG 3.6Å; F187-H196 HydrophobicContact CZ-CB 3.2Å; F187-H196 AromaticContact CZ-CD2 3.31Å; F187-H196 WeakPolarHBondContact CZ-CD2 3.49Å; F187-H196 AromaticContact CZ-CG 3.1Å; F187-H196 AromaticContact CZ-ND1 3.77Å
188	T	83.1	Confident	87.7	Confident	57 Å²	57	81.3 Å²	81.3	35%	0.35	41%	0.409	S	S	.	.	S	Bend	trans	-81	-23.1	-179.7	56.1	0	0	0	0	113	V171 Q192	V171-T188 HydrophobicContact CB-CG2 4.29Å; V171-T188 HydrophobicContact CG1-CG2 3.85Å; V171-T188 HydrophobicContact CG2-CG2 3.89Å; T188-Q192 VanDerWaalsContact OG1-CD 3.23Å; T188-Q192 PolarHBondContact OG1-NE2 3.43Å; T188-Q192 PolarHBondContact OG1-OE1 3.21Å
189	T	84.7	Confident	88	Confident	39 Å²	39	79 Å²	79	24%	0.239	40%	0.399	C	S	.	.	S	Bend	trans	-142.5	150	-174.7	59.3	0	0	0	0	111.2	L178 S191 Q192 L193	L178-T189 VanDerWaalsContact CD1-C 3.49Å; T189-S191 PolarHBondContact O-N 3.45Å; T189-Q192 WeakPolarHBondContact O-CB 3.43Å; T189-Q192 PolarHBondContact O-N 3.01Å; T189-Q192 WeakPolarHBondContact OG1-CG 3.46Å; T189-Q192 PolarHBondContact OG1-NE2 2.95Å; T189-Q192 VanDerWaalsContact OG1-NE2 3.12Å; T189-L193 PolarHBondContact O-N 2.81Å; T189-L193 VanDerWaalsContact O-N 3.13Å
190	K	88	Confident	88.2	Confident	149 Å²	149	78.7 Å²	78.7	65%	0.648	40%	0.4	S	S	*	.	H	α-helix	trans	-58.3	-36.4	-179.8	-171.2	171.7	-176.5	172.3	0	112.3	L178 Q192 L193 N194	L178-K190 VanDerWaalsContact CD1-CA 3.49Å; L178-K190 HydrophobicContact CD1-CB 3.97Å; K190-Q192 VanDerWaalsContact C-N 3.32Å; K190-Q192 PolarHBondContact O-N 2.76Å; K190-L193 PolarHBondContact O-N 3.48Å; K190-N194 WeakPolarHBondContact O-CB 3.46Å; K190-N194 VanDerWaalsContact O-CG 3.24Å; K190-N194 PolarHBondContact O-N 3.37Å
191	S	89.9	Confident	88.3	Confident	96 Å²	96	81.3 Å²	81.3	67%	0.671	41%	0.411	S	S	*	.	H	α-helix	trans	-63.7	-35.6	175.9	-52.7	0	0	0	0	112.9	T189 R195	T189-S191 PolarHBondContact O-N 3.45Å; S191-R195 VanDerWaalsContact O-CB 3.26Å; S191-R195 WeakPolarHBondContact O-CB 3.41Å; S191-R195 PolarHBondContact O-N 3.24Å
192	Q	90.4	Very high	88.4	Confident	62 Å²	62	78.6 Å²	78.6	29%	0.29	39%	0.393	S	S	.	.	H	α-helix	trans	-71.1	-44	176.6	-70.7	168.3	27.5	0	0	111.4	F187 T188 T189 K190 R195 H196	F187-Q192 HydrophobicContact CB-CB 4.08Å; F187-Q192 HydrophobicContact CD1-CB 3.84Å; F187-Q192 HydrophobicContact CG-CB 4.3Å; T188-Q192 VanDerWaalsContact OG1-CD 3.23Å; T188-Q192 PolarHBondContact OG1-NE2 3.43Å; T188-Q192 PolarHBondContact OG1-OE1 3.21Å; T189-Q192 WeakPolarHBondContact O-CB 3.43Å; T189-Q192 PolarHBondContact O-N 3.01Å; T189-Q192 WeakPolarHBondContact OG1-CG 3.46Å; T189-Q192 PolarHBondContact OG1-NE2 2.95Å; T189-Q192 VanDerWaalsContact OG1-NE2 3.12Å; K190-Q192 VanDerWaalsContact C-N 3.32Å; K190-Q192 PolarHBondContact O-N 2.76Å; Q192-R195 PolarHBondContact O-N 3.19Å; Q192-H196 WeakPolarHBondContact O-CB 3.48Å; Q192-H196 PolarHBondContact O-N 3.33Å
193	L	90.7	Very high	88.6	Confident	23 Å²	23	74.1 Å²	74.1	12%	0.12	39%	0.388	C	S	.	.	H	α-helix	trans	-59.7	-51.2	174.2	174	60.9	0	0	0	110.8	L178 C180 F187 T189 K190 R195 H196 I197	L178-L193 HydrophobicContact CB-CB 4.45Å; L178-L193 HydrophobicContact CB-CD2 3.91Å; C180-L193 HydrophobicContact CB-CD1 3.79Å; F187-L193 HydrophobicContact CB-CB 4.02Å; F187-L193 HydrophobicContact CD2-CB 3.88Å; F187-L193 HydrophobicContact CD2-CD1 3.53Å; F187-L193 HydrophobicContact CD2-CG 4.3Å; F187-L193 HydrophobicContact CE2-CD1 3.81Å; F187-L193 HydrophobicContact CG-CB 4.04Å; T189-L193 PolarHBondContact O-N 2.81Å; T189-L193 VanDerWaalsContact O-N 3.13Å; K190-L193 PolarHBondContact O-N 3.48Å; L193-R195 VanDerWaalsContact C-N 3.31Å; L193-R195 PolarHBondContact O-N 3.1Å; L193-H196 CarbonylContact O-C 3.5Å; L193-H196 WeakPolarHBondContact O-CA 3.4Å; L193-H196 VanDerWaalsContact O-CB 3.32Å; L193-H196 WeakPolarHBondContact O-CB 3.47Å; L193-H196 PolarHBondContact O-N 3.11Å; L193-I197 HydrophobicContact CD1-CD1 3.85Å; L193-I197 HydrophobicContact CD1-CG1 4.03Å; L193-I197 HydrophobicContact CD2-CD1 4.46Å; L193-I197 HydrophobicContact CG-CD1 3.82Å; L193-I197 HydrophobicContact CG-CG1 4.4Å; L193-I197 WeakPolarHBondContact O-CG1 3.46Å; L193-I197 PolarHBondContact O-N 3.29Å
194	N	92.9	Very high	88.7	Confident	71 Å²	71	76.1 Å²	76.1	38%	0.38	40%	0.395	S	S	.	.	H	α-helix	trans	-59.8	-41	179.3	-73.3	-5.3	0	0	0	112.3	K190 H196 I197 K198	K190-N194 WeakPolarHBondContact O-CB 3.46Å; K190-N194 VanDerWaalsContact O-CG 3.24Å; K190-N194 PolarHBondContact O-N 3.37Å; N194-H196 VanDerWaalsContact C-N 3.31Å; N194-H196 PolarHBondContact O-N 3.02Å; N194-I197 PolarHBondContact O-N 3.2Å; N194-K198 WeakPolarHBondContact O-CB 3.28Å; N194-K198 VanDerWaalsContact O-CG 3.31Å; N194-K198 WeakPolarHBondContact O-CG 3.35Å; N194-K198 PolarHBondContact O-N 2.95Å
195	R	92.5	Very high	89.2	Confident	124 Å²	124	73.2 Å²	73.2	47%	0.468	38%	0.375	S	S	.	.	H	α-helix	trans	-62.5	-40.6	174.1	174.9	-179.3	59	-172.3	6.2	111.4	S191 Q192 L193 S199 T217	S191-R195 VanDerWaalsContact O-CB 3.26Å; S191-R195 WeakPolarHBondContact O-CB 3.41Å; S191-R195 PolarHBondContact O-N 3.24Å; Q192-R195 PolarHBondContact O-N 3.19Å; L193-R195 VanDerWaalsContact C-N 3.31Å; L193-R195 PolarHBondContact O-N 3.1Å; R195-S199 WeakPolarHBondContact O-CB 3.4Å; R195-S199 PolarHBondContact O-N 2.95Å; R195-S199 PolarHBondContact O-OG 3.35Å; R195-T217 HydrophobicContact CG-CG2 4.22Å
196	H	91.2	Very high	89.7	Confident	12 Å²	12	69.6 Å²	69.6	6%	0.056	36%	0.362	C	S	.	.	H	α-helix	trans	-63.1	-49.9	175.6	162.3	65.4	0	0	0	111.2	C183 F187 Q192 L193 N194 K198 S199 A200 H201	C183-H196 VanDerWaalsContact SG-CE1 3.57Å; C183-H196 PolarHBondContact SG-NE2 3.38Å; F187-H196 HydrophobicContact CD1-CB 4.48Å; F187-H196 HydrophobicContact CE1-CB 3.58Å; F187-H196 AromaticContact CE1-CG 3.98Å; F187-H196 HydrophobicContact CE2-CB 3.82Å; F187-H196 AromaticContact CE2-CD2 3.28Å; F187-H196 WeakPolarHBondContact CE2-CD2 3.35Å; F187-H196 AromaticContact CE2-CG 3.6Å; F187-H196 HydrophobicContact CZ-CB 3.2Å; F187-H196 AromaticContact CZ-CD2 3.31Å; F187-H196 WeakPolarHBondContact CZ-CD2 3.49Å; F187-H196 AromaticContact CZ-CG 3.1Å; F187-H196 AromaticContact CZ-ND1 3.77Å; Q192-H196 WeakPolarHBondContact O-CB 3.48Å; Q192-H196 PolarHBondContact O-N 3.33Å; L193-H196 CarbonylContact O-C 3.5Å; L193-H196 WeakPolarHBondContact O-CA 3.4Å; L193-H196 VanDerWaalsContact O-CB 3.32Å; L193-H196 WeakPolarHBondContact O-CB 3.47Å; L193-H196 PolarHBondContact O-N 3.11Å; N194-H196 VanDerWaalsContact C-N 3.31Å; N194-H196 PolarHBondContact O-N 3.02Å; H196-K198 PolarHBondContact O-N 3.35Å; H196-S199 PolarHBondContact O-N 3.43Å; H196-S199 VanDerWaalsContact O-N 3.15Å; H196-S199 PolarHBondContact O-OG 3.47Å; H196-A200 VanDerWaalsContact CE1-CB 3.41Å; H196-A200 WeakPolarHBondContact CE1-CB 3.41Å; H196-A200 WeakPolarHBondContact ND1-CB 3.3Å; H196-A200 WeakPolarHBondContact O-CB 3.3Å; H196-A200 PolarHBondContact O-N 3.18Å; H196-H201 AromaticContact CE1-NE2 3.76Å; H196-H201 AromaticContact NE2-CD2 3.89Å; H196-H201 AromaticContact NE2-NE2 3.33Å; H196-H201 PolarHBondContact NE2-NE2 2.83Å
197	I	91.5	Very high	90	Very high	39 Å²	39	69 Å²	69	20%	0.2	36%	0.363	C	S	.	.	H	α-helix	trans	-55	-51.8	178.7	-66.6	168.6	0	0	0	110.8	L193 N194 S199 H201 E202	L193-I197 HydrophobicContact CD1-CD1 3.85Å; L193-I197 HydrophobicContact CD1-CG1 4.03Å; L193-I197 HydrophobicContact CD2-CD1 4.46Å; L193-I197 HydrophobicContact CG-CD1 3.82Å; L193-I197 HydrophobicContact CG-CG1 4.4Å; L193-I197 WeakPolarHBondContact O-CG1 3.46Å; L193-I197 PolarHBondContact O-N 3.29Å; N194-I197 PolarHBondContact O-N 3.2Å; I197-S199 VanDerWaalsContact C-N 3.33Å; I197-S199 PolarHBondContact O-N 2.97Å; I197-H201 PolarHBondContact O-N 2.87Å; I197-E202 HydrophobicContact CG2-CG 4.43Å; I197-E202 PolarHBondContact O-N 3.48Å; I197-E202 VanDerWaalsContact O-N 3.09Å
198	K	92.5	Very high	90.3	Very high	111 Å²	111	68.2 Å²	68.2	48%	0.483	36%	0.361	S	S	.	.	H	α-helix	trans	-54.8	-47.4	177.4	-74.1	-174.8	177.1	-167.2	0	112.4	N194 H196 E202 G203 I204	N194-K198 WeakPolarHBondContact O-CB 3.28Å; N194-K198 VanDerWaalsContact O-CG 3.31Å; N194-K198 WeakPolarHBondContact O-CG 3.35Å; N194-K198 PolarHBondContact O-N 2.95Å; H196-K198 PolarHBondContact O-N 3.35Å; K198-E202 WeakPolarHBondContact CG-OE2 3.35Å; K198-E202 CarbonylContact O-C 3.4Å; K198-G203 PolarHBondContact O-N 3.47Å; K198-I204 HydrophobicContact CB-CB 4.23Å; K198-I204 HydrophobicContact CB-CD1 4.47Å; K198-I204 HydrophobicContact CG-CD1 4.31Å; K198-I204 WeakPolarHBondContact O-CA 3.42Å; K198-I204 WeakPolarHBondContact O-CB 3.38Å; K198-I204 PolarHBondContact O-N 2.99Å
199	S	92.4	Very high	90.7	Very high	21 Å²	21	71.4 Å²	71.4	15%	0.147	38%	0.376	C	S	.	.	H	α-helix	trans	-84.4	-29.1	-172.9	61	0	0	0	0	115.2	R195 H196 I197 I204 K205	R195-S199 WeakPolarHBondContact O-CB 3.4Å; R195-S199 PolarHBondContact O-N 2.95Å; R195-S199 PolarHBondContact O-OG 3.35Å; H196-S199 PolarHBondContact O-N 3.43Å; H196-S199 VanDerWaalsContact O-N 3.15Å; H196-S199 PolarHBondContact O-OG 3.47Å; I197-S199 VanDerWaalsContact C-N 3.33Å; I197-S199 PolarHBondContact O-N 2.97Å; S199-I204 WeakPolarHBondContact CA-O 3.46Å; S199-K205 WeakPolarHBondContact O-CE 3.48Å
200	A	88.2	Confident	91.1	Very high	55 Å²	55	75.3 Å²	75.3	46%	0.455	39%	0.391	S	S	.	.	H	α-helix	trans	-99.5	-36.2	-174.3	0	0	0	0	0	113.2	H196	H196-A200 VanDerWaalsContact CE1-CB 3.41Å; H196-A200 WeakPolarHBondContact CE1-CB 3.41Å; H196-A200 WeakPolarHBondContact ND1-CB 3.3Å; H196-A200 WeakPolarHBondContact O-CB 3.3Å; H196-A200 PolarHBondContact O-N 3.18Å
201	H	89.9	Confident	91.2	Very high	64 Å²	64	70.2 Å²	70.2	30%	0.296	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-36.3	-174.1	-59.9	-60.4	0	0	0	113.2	C180 K182 H196 I197	C180-H201 PolarHBondContact SG-NE2 3.18Å; K182-H201 VanDerWaalsContact CB-CE1 3.4Å; K182-H201 WeakPolarHBondContact CB-CE1 3.49Å; K182-H201 HydrophobicContact CD-CB 3.79Å; H196-H201 AromaticContact CE1-NE2 3.76Å; H196-H201 AromaticContact NE2-CD2 3.89Å; H196-H201 AromaticContact NE2-NE2 3.33Å; H196-H201 PolarHBondContact NE2-NE2 2.83Å; I197-H201 PolarHBondContact O-N 2.87Å
202	E	90.8	Very high	91.1	Very high	104 Å²	104	73.7 Å²	73.7	49%	0.486	39%	0.385	S	S	.	.	S	Bend	trans	-92.3	-7	177.4	-60.1	170.1	-173.6	0	0	112.6	I197 K198 I204	I197-E202 HydrophobicContact CG2-CG 4.43Å; I197-E202 PolarHBondContact O-N 3.48Å; I197-E202 VanDerWaalsContact O-N 3.09Å; K198-E202 WeakPolarHBondContact CG-OE2 3.35Å; K198-E202 CarbonylContact O-C 3.4Å; E202-I204 HydrophobicContact CB-CD1 4.08Å; E202-I204 HydrophobicContact CB-CG1 3.91Å; E202-I204 PolarHBondContact O-N 3.38Å; E202-I204 VanDerWaalsContact O-N 3.13Å; E202-I204 WeakPolarHBondContact OE2-CD1 3.39Å
203	G	86.8	Confident	91.1	Very high	50 Å²	50	76.5 Å²	76.5	52%	0.515	40%	0.396	S	S	.	.			trans	68.1	8	-179.8	0	0	0	0	0	115	K198 K205	K198-G203 PolarHBondContact O-N 3.47Å; G203-K205 PolarHBondContact O-N 3.11Å
204	I	89.5	Confident	91.2	Very high	81 Å²	81	82.2 Å²	82.2	42%	0.415	42%	0.42	S	S	.	.			trans	-68.6	105.5	179.7	-56	178.4	0	0	0	109.1	K198 S199 E202	K198-I204 HydrophobicContact CB-CB 4.23Å; K198-I204 HydrophobicContact CB-CD1 4.47Å; K198-I204 HydrophobicContact CG-CD1 4.31Å; K198-I204 WeakPolarHBondContact O-CA 3.42Å; K198-I204 WeakPolarHBondContact O-CB 3.38Å; K198-I204 PolarHBondContact O-N 2.99Å; S199-I204 WeakPolarHBondContact CA-O 3.46Å; E202-I204 HydrophobicContact CB-CD1 4.08Å; E202-I204 HydrophobicContact CB-CG1 3.91Å; E202-I204 PolarHBondContact O-N 3.38Å; E202-I204 VanDerWaalsContact O-N 3.13Å; E202-I204 WeakPolarHBondContact OE2-CD1 3.39Å
205	K	92.5	Very high	91.1	Very high	104 Å²	104	80.1 Å²	80.1	45%	0.452	41%	0.409	S	S	.	.			trans	-129.2	156.6	176.9	-65.5	177.7	-176.4	171.2	0	109.3	S199 G203 P207 K214 L215	S199-K205 WeakPolarHBondContact O-CE 3.48Å; G203-K205 PolarHBondContact O-N 3.11Å; K205-P207 VanDerWaalsContact O-CD 3.28Å; K205-P207 WeakPolarHBondContact O-CD 3.43Å; K205-K214 HydrophobicContact CB-CB 3.82Å; K205-K214 HydrophobicContact CD-CB 4.05Å; K205-L215 CarbonylContact C-O 3.59Å; K205-L215 VanDerWaalsContact CA-O 3.31Å; K205-L215 WeakPolarHBondContact CA-O 3.33Å; K205-L215 WeakPolarHBondContact CB-O 3.4Å
206	Y	93.8	Very high	91	Very high	79 Å²	79	76.6 Å²	76.6	31%	0.31	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	105.8	178	-60.7	-85.3	0	0	0	109	L215 S216 K218	Y206-L215 PolarHBondContact N-O 3.39Å; Y206-L215 PolarHBondContact O-N 3.39Å; Y206-S216 WeakPolarHBondContact CE2-O 3.4Å; Y206-K218 HydrophobicContact CD1-CG 3.67Å; Y206-K218 HydrophobicContact CE1-CD 4.02Å; Y206-K218 HydrophobicContact CE1-CG 3.27Å; Y206-K218 HydrophobicContact CE2-CG 4.2Å; Y206-K218 HydrophobicContact CG-CG 4.28Å
207	P	92.2	Very high	91	Very high	80 Å²	80	77 Å²	77	52%	0.519	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	144.1	-179.4	30.9	-34.6	0	0	0	111.4	K205 K214	K205-P207 VanDerWaalsContact O-CD 3.28Å; K205-P207 WeakPolarHBondContact O-CD 3.43Å; P207-K214 HydrophobicContact CB-CG 4.26Å
208	C	93.1	Very high	91	Very high	11 Å²	11	82.2 Å²	82.2	7%	0.074	43%	0.428	C	S	.	.			trans	-79.4	139.1	162.7	-169.3	0	0	0	0	109.7	Q210 K213 L221 H224 H229	C208-Q210 PolarHBondContact SG-N 2.73Å; C208-K213 PolarHBondContact N-O 3.39Å; C208-L221 HydrophobicContact CB-CD1 3.87Å; C208-H224 PolarHBondContact SG-NE2 3.34Å; C208-H229 PolarHBondContact SG-NE2 3.47Å
209	N	92.4	Very high	90.9	Very high	125 Å²	125	84.5 Å²	84.5	67%	0.668	43%	0.434	S	S	*	.	S	Bend	trans	-87.3	-5.4	176.1	63	-39.1	0	0	0	113.2	K225	N209-K225 WeakPolarHBondContact OD1-CE 3.28Å; N209-K225 PolarHBondContact OD1-NZ 2.87Å
210	Q	91.3	Very high	90.9	Very high	120 Å²	120	86.5 Å²	86.5	56%	0.561	44%	0.443	S	S	*	.	S	Bend	trans	-113.1	-4.6	-179.8	-67.8	169.6	-15.5	0	0	112.6	C208 H229	C208-Q210 PolarHBondContact SG-N 2.73Å; Q210-H229 WeakPolarHBondContact CB-CE1 3.49Å; Q210-H229 PolarHBondContact O-CE1 2.95Å; Q210-H229 PolarHBondContact OE1-CD2 2.97Å; Q210-H229 PolarHBondContact OE1-ND1 3.21Å
211	C	90	Very high	91.2	Very high	42 Å²	42	85 Å²	85	28%	0.284	43%	0.428	S	S	.	.	S	Bend	trans	-160.7	169.2	170.4	70.6	0	0	0	0	111.5	K213 H224 H229	C211-K213 PolarHBondContact O-N 3.49Å; C211-K213 VanDerWaalsContact SG-CB 3.56Å; C211-H224 PolarHBondContact SG-CE1 2.93Å; C211-H224 PolarHBondContact SG-NE2 3.4Å; C211-H229 PolarHBondContact SG-NE2 3.18Å
212	N	88.6	Confident	91.3	Very high	170 Å²	170	88.5 Å²	88.5	91%	0.909	44%	0.439	S	S	*	.	S	Bend	trans	-73.3	12.1	-177.7	-66.4	-15.2	0	0	0	115.1
213	K	90.7	Very high	91.3	Very high	120 Å²	120	84.9 Å²	84.9	52%	0.522	43%	0.425	S	S	.	.			trans	-77.9	127.9	-178.3	-161.4	83.9	179.7	-173.9	0	110.4	C208 C211 L215	C208-K213 PolarHBondContact N-O 3.39Å; C211-K213 PolarHBondContact O-N 3.49Å; C211-K213 VanDerWaalsContact SG-CB 3.56Å; K213-L215 HydrophobicContact CB-CD2 4.09Å; K213-L215 HydrophobicContact CG-CD1 3.95Å; K213-L215 HydrophobicContact CG-CD2 3.6Å; K213-L215 HydrophobicContact CG-CG 4.45Å
214	K	92	Very high	91.5	Very high	144 Å²	144	83.7 Å²	83.7	63%	0.626	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.4	171.7	-57.2	-176.1	-177.8	179.7	0	110	K205 P207	K205-K214 HydrophobicContact CB-CB 3.82Å; K205-K214 HydrophobicContact CD-CB 4.05Å; P207-K214 HydrophobicContact CB-CG 4.26Å
215	L	92	Very high	91.7	Very high	26 Å²	26	82.8 Å²	82.8	14%	0.136	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	154	-172.3	-65.6	-53.9	0	0	0	111.3	K205 Y206 K213 D220 L221 H224	K205-L215 CarbonylContact C-O 3.59Å; K205-L215 VanDerWaalsContact CA-O 3.31Å; K205-L215 WeakPolarHBondContact CA-O 3.33Å; K205-L215 WeakPolarHBondContact CB-O 3.4Å; Y206-L215 PolarHBondContact N-O 3.39Å; Y206-L215 PolarHBondContact O-N 3.39Å; K213-L215 HydrophobicContact CB-CD2 4.09Å; K213-L215 HydrophobicContact CG-CD1 3.95Å; K213-L215 HydrophobicContact CG-CD2 3.6Å; K213-L215 HydrophobicContact CG-CG 4.45Å; L215-D220 HydrophobicContact CB-CB 3.93Å; L215-D220 HydrophobicContact CD1-CB 4.47Å; L215-D220 HydrophobicContact CG-CB 4.19Å; L215-L221 HydrophobicContact CB-CB 4.38Å; L215-L221 HydrophobicContact CD2-CD1 3.91Å; L215-H224 HydrophobicContact CD2-CB 4.38Å; L215-H224 HydrophobicContact CG-CB 4.49Å
216	S	90.1	Very high	91.7	Very high	50 Å²	50	80.7 Å²	80.7	35%	0.35	39%	0.389	S	S	.	.	S	Bend	trans	-80.7	-18.4	-176.9	52.9	0	0	0	0	114	Y206	Y206-S216 WeakPolarHBondContact CE2-O 3.4Å
217	T	91.4	Very high	91.7	Very high	21 Å²	21	78.1 Å²	78.1	13%	0.129	38%	0.382	C	S	.	.	S	Bend	trans	-133.6	156.7	176.2	75.9	0	0	0	0	113.2	R195 Y219 D220 L221	R195-T217 HydrophobicContact CG-CG2 4.22Å; T217-Y219 VanDerWaalsContact C-N 3.25Å; T217-Y219 PolarHBondContact O-N 3.2Å; T217-Y219 PolarHBondContact OG1-N 3.35Å; T217-D220 WeakPolarHBondContact CB-OD2 3.33Å; T217-D220 WeakPolarHBondContact CG2-OD2 3.31Å; T217-D220 PolarHBondContact N-OD2 3.33Å; T217-D220 PolarHBondContact O-N 3.27Å; T217-D220 WeakPolarHBondContact OG1-CB 3.39Å; T217-D220 PolarHBondContact OG1-N 3.25Å; T217-D220 PolarHBondContact OG1-OD2 3.41Å; T217-L221 PolarHBondContact O-N 2.99Å; T217-L221 VanDerWaalsContact O-N 3.08Å
218	K	91.7	Very high	91.7	Very high	148 Å²	148	79.3 Å²	79.3	64%	0.643	38%	0.383	S	S	*	.	H	α-helix	trans	-58.7	-37.8	171.6	-66.4	-173.4	178.4	-176.8	0	112	Y206 L221 Y222	Y206-K218 HydrophobicContact CD1-CG 3.67Å; Y206-K218 HydrophobicContact CE1-CD 4.02Å; Y206-K218 HydrophobicContact CE1-CG 3.27Å; Y206-K218 HydrophobicContact CE2-CG 4.2Å; Y206-K218 HydrophobicContact CG-CG 4.28Å; K218-L221 PolarHBondContact O-N 3.43Å; K218-Y222 WeakPolarHBondContact O-CB 3.01Å; K218-Y222 PolarHBondContact O-N 3.09Å
219	Y	90.5	Very high	91.6	Very high	159 Å²	159	81.7 Å²	81.7	62%	0.624	39%	0.393	S	S	*	.	H	α-helix	trans	-66.2	-43.3	178.1	179.3	-101.9	0	0	0	111.7	T217 L221 Y222 V223	T217-Y219 VanDerWaalsContact C-N 3.25Å; T217-Y219 PolarHBondContact O-N 3.2Å; T217-Y219 PolarHBondContact OG1-N 3.35Å; Y219-L221 VanDerWaalsContact C-N 3.29Å; Y219-L221 PolarHBondContact O-N 3.12Å; Y219-Y222 WeakPolarHBondContact O-CB 3.48Å; Y219-Y222 PolarHBondContact O-N 3.41Å; Y219-Y222 VanDerWaalsContact O-N 3.17Å; Y219-V223 HydrophobicContact CD1-CG2 4.22Å; Y219-V223 HydrophobicContact CD2-CG2 4.45Å; Y219-V223 HydrophobicContact CE1-CG2 3.72Å; Y219-V223 HydrophobicContact CE2-CG2 3.98Å; Y219-V223 WeakPolarHBondContact O-CG2 3.33Å; Y219-V223 PolarHBondContact O-N 3.29Å
220	D	92	Very high	91.6	Very high	63 Å²	63	80.5 Å²	80.5	34%	0.337	38%	0.383	S	S	.	.	H	α-helix	trans	-62.6	-39	176.4	-61.5	-41.1	0	0	0	111.3	L215 T217 H224	L215-D220 HydrophobicContact CB-CB 3.93Å; L215-D220 HydrophobicContact CD1-CB 4.47Å; L215-D220 HydrophobicContact CG-CB 4.19Å; T217-D220 WeakPolarHBondContact CB-OD2 3.33Å; T217-D220 WeakPolarHBondContact CG2-OD2 3.31Å; T217-D220 PolarHBondContact N-OD2 3.33Å; T217-D220 PolarHBondContact O-N 3.27Å; T217-D220 WeakPolarHBondContact OG1-CB 3.39Å; T217-D220 PolarHBondContact OG1-N 3.25Å; T217-D220 PolarHBondContact OG1-OD2 3.41Å; D220-H224 WeakPolarHBondContact O-CB 3.43Å; D220-H224 PolarHBondContact O-N 3.43Å
221	L	93.1	Very high	91.5	Very high	25 Å²	25	77.1 Å²	77.1	13%	0.131	38%	0.381	C	S	.	.	H	α-helix	trans	-63.9	-43.6	173.5	179.1	66.1	0	0	0	111.7	C208 L215 T217 K218 Y219 H224 K225	C208-L221 HydrophobicContact CB-CD1 3.87Å; L215-L221 HydrophobicContact CB-CB 4.38Å; L215-L221 HydrophobicContact CD2-CD1 3.91Å; T217-L221 PolarHBondContact O-N 2.99Å; T217-L221 VanDerWaalsContact O-N 3.08Å; K218-L221 PolarHBondContact O-N 3.43Å; Y219-L221 VanDerWaalsContact C-N 3.29Å; Y219-L221 PolarHBondContact O-N 3.12Å; L221-H224 WeakPolarHBondContact O-CB 3.23Å; L221-H224 PolarHBondContact O-N 3.21Å; L221-K225 HydrophobicContact CD1-CG 4.43Å; L221-K225 WeakPolarHBondContact O-CG 3.44Å; L221-K225 PolarHBondContact O-N 2.93Å
222	Y	93.1	Very high	91.5	Very high	136 Å²	136	78.9 Å²	78.9	53%	0.533	39%	0.386	S	S	.	.	H	α-helix	trans	-59.9	-50.5	177	168.2	-98.2	0	0	0	111.9	K218 Y219 H224 K225 K226	K218-Y222 WeakPolarHBondContact O-CB 3.01Å; K218-Y222 PolarHBondContact O-N 3.09Å; Y219-Y222 WeakPolarHBondContact O-CB 3.48Å; Y219-Y222 PolarHBondContact O-N 3.41Å; Y219-Y222 VanDerWaalsContact O-N 3.17Å; Y222-H224 VanDerWaalsContact C-N 3.3Å; Y222-H224 PolarHBondContact O-N 3.27Å; Y222-K225 PolarHBondContact O-N 3.43Å; Y222-K226 HydrophobicContact CD2-CG 4.5Å; Y222-K226 HydrophobicContact CE1-CG 4.15Å; Y222-K226 HydrophobicContact CE2-CG 4.04Å; Y222-K226 PolarHBondContact O-N 2.83Å; Y222-K226 WeakPolarHBondContact OH-CE 3.45Å
223	V	90.4	Very high	91.7	Very high	29 Å²	29	75.9 Å²	75.9	18%	0.176	37%	0.365	C	S	.	.	H	α-helix	trans	-61.4	-41.6	176.9	173.5	0	0	0	0	110.5	Y219 K225 K226 V227 T245	Y219-V223 HydrophobicContact CD1-CG2 4.22Å; Y219-V223 HydrophobicContact CD2-CG2 4.45Å; Y219-V223 HydrophobicContact CE1-CG2 3.72Å; Y219-V223 HydrophobicContact CE2-CG2 3.98Å; Y219-V223 WeakPolarHBondContact O-CG2 3.33Å; Y219-V223 PolarHBondContact O-N 3.29Å; V223-K225 PolarHBondContact O-N 3.29Å; V223-K226 PolarHBondContact O-N 3.49Å; V223-V227 HydrophobicContact CG1-CG2 4.15Å; V223-V227 WeakPolarHBondContact O-CB 3.39Å; V223-V227 VanDerWaalsContact O-CG2 3.23Å; V223-V227 WeakPolarHBondContact O-CG2 3.35Å; V223-V227 PolarHBondContact O-N 3.49Å; V223-T245 HydrophobicContact CG1-CG2 3.95Å
224	H	92.3	Very high	91.8	Very high	24 Å²	24	73.7 Å²	73.7	11%	0.111	36%	0.356	C	S	.	.	H	α-helix	trans	-57.6	-48.1	175.2	164.7	69.8	0	0	0	112.1	C208 C211 L215 D220 L221 Y222 V227 I228 H229	C208-H224 PolarHBondContact SG-NE2 3.34Å; C211-H224 PolarHBondContact SG-CE1 2.93Å; C211-H224 PolarHBondContact SG-NE2 3.4Å; L215-H224 HydrophobicContact CD2-CB 4.38Å; L215-H224 HydrophobicContact CG-CB 4.49Å; D220-H224 WeakPolarHBondContact O-CB 3.43Å; D220-H224 PolarHBondContact O-N 3.43Å; L221-H224 WeakPolarHBondContact O-CB 3.23Å; L221-H224 PolarHBondContact O-N 3.21Å; Y222-H224 VanDerWaalsContact C-N 3.3Å; Y222-H224 PolarHBondContact O-N 3.27Å; H224-V227 PolarHBondContact O-N 2.96Å; H224-I228 WeakPolarHBondContact ND1-CG1 3.37Å; H224-I228 VanDerWaalsContact O-CB 3.28Å; H224-I228 WeakPolarHBondContact O-CB 3.46Å; H224-I228 WeakPolarHBondContact O-CG1 3.43Å; H224-I228 PolarHBondContact O-N 2.91Å; H224-H229 AromaticContact CE1-NE2 3.93Å; H224-H229 AromaticContact NE2-CD2 3.9Å; H224-H229 AromaticContact NE2-NE2 3.39Å; H224-H229 PolarHBondContact NE2-NE2 2.74Å
225	K	93.4	Very high	91.8	Very high	63 Å²	63	70.6 Å²	70.6	27%	0.274	35%	0.351	S	S	.	.	I	π-helix	trans	-60.9	-48	178	-73.6	-173.9	175.7	-163.8	0	112	N209 L221 Y222 V223 V227 H229 E230	N209-K225 WeakPolarHBondContact OD1-CE 3.28Å; N209-K225 PolarHBondContact OD1-NZ 2.87Å; L221-K225 HydrophobicContact CD1-CG 4.43Å; L221-K225 WeakPolarHBondContact O-CG 3.44Å; L221-K225 PolarHBondContact O-N 2.93Å; Y222-K225 PolarHBondContact O-N 3.43Å; V223-K225 PolarHBondContact O-N 3.29Å; K225-V227 VanDerWaalsContact C-N 3.35Å; K225-V227 PolarHBondContact O-N 2.92Å; K225-H229 WeakPolarHBondContact O-CB 3.47Å; K225-H229 PolarHBondContact O-N 3.29Å; K225-E230 PolarHBondContact O-N 3.14Å
226	K	92.6	Very high	91.9	Very high	59 Å²	59	69.9 Å²	69.9	26%	0.257	35%	0.348	S	S	.	.	I	π-helix	trans	-55.3	-47.6	176.7	-77.9	-75.2	173.4	-163.3	0	112.4	Y222 V223 E230 G231 I232	Y222-K226 HydrophobicContact CD2-CG 4.5Å; Y222-K226 HydrophobicContact CE1-CG 4.15Å; Y222-K226 HydrophobicContact CE2-CG 4.04Å; Y222-K226 PolarHBondContact O-N 2.83Å; Y222-K226 WeakPolarHBondContact OH-CE 3.45Å; V223-K226 PolarHBondContact O-N 3.49Å; K226-E230 VanDerWaalsContact CD-OE2 3.31Å; K226-E230 WeakPolarHBondContact CD-OE2 3.33Å; K226-E230 WeakPolarHBondContact CE-OE2 3.46Å; K226-E230 IonicContact NZ-OE1 2.71Å; K226-E230 IonicContact NZ-OE2 2.72Å; K226-E230 PolarHBondContact NZ-OE2 3.11Å; K226-E230 CarbonylContact O-C 3.53Å; K226-E230 WeakPolarHBondContact O-CB 3.13Å; K226-G231 PolarHBondContact O-N 3.04Å; K226-I232 HydrophobicContact CD-CB 4.44Å; K226-I232 HydrophobicContact CD-CD1 3.69Å; K226-I232 WeakPolarHBondContact O-CB 3.31Å; K226-I232 PolarHBondContact O-N 2.87Å
227	V	93.2	Very high	92	Very high	25 Å²	25	74.1 Å²	74.1	15%	0.152	37%	0.367	C	S	.	.	I	π-helix	trans	-81.6	-41.8	-172	177.8	0	0	0	0	113	V223 H224 K225 G244	V223-V227 HydrophobicContact CG1-CG2 4.15Å; V223-V227 WeakPolarHBondContact O-CB 3.39Å; V223-V227 VanDerWaalsContact O-CG2 3.23Å; V223-V227 WeakPolarHBondContact O-CG2 3.35Å; V223-V227 PolarHBondContact O-N 3.49Å; H224-V227 PolarHBondContact O-N 2.96Å; K225-V227 VanDerWaalsContact C-N 3.35Å; K225-V227 PolarHBondContact O-N 2.92Å; V227-G244 WeakPolarHBondContact CG2-O 3.38Å
228	I	91.2	Very high	92	Very high	106 Å²	106	78.4 Å²	78.4	54%	0.544	39%	0.385	S	S	.	.	I	π-helix	trans	-90.2	-40.4	-170.2	-58.7	-58.3	0	0	0	111.8	H224	H224-I228 WeakPolarHBondContact ND1-CG1 3.37Å; H224-I228 VanDerWaalsContact O-CB 3.28Å; H224-I228 WeakPolarHBondContact O-CB 3.46Å; H224-I228 WeakPolarHBondContact O-CG1 3.43Å; H224-I228 PolarHBondContact O-N 2.91Å
229	H	91.3	Very high	92.1	Very high	60 Å²	60	73.3 Å²	73.3	28%	0.278	37%	0.368	S	S	.	.	I	π-helix	trans	-101.7	-41.4	-172.2	-62.1	-61.7	0	0	0	112.9	C208 Q210 C211 H224 K225 G231	C208-H229 PolarHBondContact SG-NE2 3.47Å; Q210-H229 WeakPolarHBondContact CB-CE1 3.49Å; Q210-H229 PolarHBondContact O-CE1 2.95Å; Q210-H229 PolarHBondContact OE1-CD2 2.97Å; Q210-H229 PolarHBondContact OE1-ND1 3.21Å; C211-H229 PolarHBondContact SG-NE2 3.18Å; H224-H229 AromaticContact CE1-NE2 3.93Å; H224-H229 AromaticContact NE2-CD2 3.9Å; H224-H229 AromaticContact NE2-NE2 3.39Å; H224-H229 PolarHBondContact NE2-NE2 2.74Å; K225-H229 WeakPolarHBondContact O-CB 3.47Å; K225-H229 PolarHBondContact O-N 3.29Å; H229-G231 VanDerWaalsContact C-N 3.32Å
230	E	92	Very high	92.2	Very high	101 Å²	101	73.5 Å²	73.5	47%	0.472	38%	0.38	S	S	.	.	S	Bend	trans	-85.1	-9.1	174.7	-60	172	-137.2	0	0	112.2	K225 K226 I232	K225-E230 PolarHBondContact O-N 3.14Å; K226-E230 VanDerWaalsContact CD-OE2 3.31Å; K226-E230 WeakPolarHBondContact CD-OE2 3.33Å; K226-E230 WeakPolarHBondContact CE-OE2 3.46Å; K226-E230 IonicContact NZ-OE1 2.71Å; K226-E230 IonicContact NZ-OE2 2.72Å; K226-E230 PolarHBondContact NZ-OE2 3.11Å; K226-E230 CarbonylContact O-C 3.53Å; K226-E230 WeakPolarHBondContact O-CB 3.13Å; E230-I232 HydrophobicContact CB-CD1 3.93Å; E230-I232 HydrophobicContact CB-CG1 3.94Å; E230-I232 PolarHBondContact O-N 3.19Å; E230-I232 VanDerWaalsContact O-N 3.11Å; E230-I232 VanDerWaalsContact OE2-CD1 3.26Å; E230-I232 WeakPolarHBondContact OE2-CD1 3.42Å
231	G	89.9	Confident	92.2	Very high	49 Å²	49	78.2 Å²	78.2	51%	0.505	39%	0.393	S	S	.	.			trans	66.2	10.4	-179.5	0	0	0	0	0	114.6	K226 H229 K233	K226-G231 PolarHBondContact O-N 3.04Å; H229-G231 VanDerWaalsContact C-N 3.32Å; G231-K233 PolarHBondContact O-N 3.42Å; G231-K233 VanDerWaalsContact O-N 3.15Å
232	I	90.5	Very high	92.2	Very high	78 Å²	78	83.7 Å²	83.7	40%	0.4	42%	0.416	S	S	.	.			trans	-73.2	109.3	-177.2	-62.7	174.1	0	0	0	108.7	K226 E230	K226-I232 HydrophobicContact CD-CB 4.44Å; K226-I232 HydrophobicContact CD-CD1 3.69Å; K226-I232 WeakPolarHBondContact O-CB 3.31Å; K226-I232 PolarHBondContact O-N 2.87Å; E230-I232 HydrophobicContact CB-CD1 3.93Å; E230-I232 HydrophobicContact CB-CG1 3.94Å; E230-I232 PolarHBondContact O-N 3.19Å; E230-I232 VanDerWaalsContact O-N 3.11Å; E230-I232 VanDerWaalsContact OE2-CD1 3.26Å; E230-I232 WeakPolarHBondContact OE2-CD1 3.42Å
233	K	92.3	Very high	92.1	Very high	107 Å²	107	79.2 Å²	79.2	47%	0.465	40%	0.399	S	S	.	.			trans	-118.9	155.5	175	-64.6	178.4	-177.3	175.3	0	109.2	G231 P235 K242 F243	G231-K233 PolarHBondContact O-N 3.42Å; G231-K233 VanDerWaalsContact O-N 3.15Å; K233-P235 VanDerWaalsContact O-CD 3.26Å; K233-P235 WeakPolarHBondContact O-CD 3.36Å; K233-K242 HydrophobicContact CB-CB 3.76Å; K233-K242 HydrophobicContact CD-CB 3.97Å; K233-F243 CarbonylContact C-O 3.54Å; K233-F243 WeakPolarHBondContact CA-O 3.39Å
234	H	92.9	Very high	92	Very high	74 Å²	74	79.1 Å²	79.1	34%	0.343	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	108.5	174.5	-57.3	-80.3	0	0	0	109.4	K242 F243 K246 L249	H234-K242 WeakPolarHBondContact O-CA 3.49Å; H234-F243 PolarHBondContact N-O 2.84Å; H234-F243 PolarHBondContact O-N 3.33Å; H234-K246 PolarHBondContact CD2-N 3.49Å; H234-K246 VanDerWaalsContact CD2-N 3.29Å; H234-K246 PolarHBondContact NE2-N 3.36Å; H234-L249 HydrophobicContact CB-CB 4.26Å; H234-L249 HydrophobicContact CB-CD2 3.75Å
235	P	92.9	Very high	91.9	Very high	80 Å²	80	80.4 Å²	80.4	52%	0.519	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	146.9	177.7	31.8	-34.5	0	0	0	111	K233 K242 L249	K233-P235 VanDerWaalsContact O-CD 3.26Å; K233-P235 WeakPolarHBondContact O-CD 3.36Å; P235-K242 HydrophobicContact CB-CG 4.24Å; P235-L249 WeakPolarHBondContact O-CD2 3.38Å
236	C	93.3	Very high	91.7	Very high	10 Å²	10	84 Å²	84	7%	0.068	43%	0.429	C	S	.	.			trans	-75.5	141.9	161.4	-175.2	0	0	0	0	109.3	Q238 C239 R241 L249 H257	C236-Q238 VanDerWaalsContact C-N 3.34Å; C236-Q238 PolarHBondContact SG-N 3.15Å; C236-C239 WeakPolarHBondContact CB-O 3.4Å; C236-R241 PolarHBondContact N-O 3Å; C236-L249 HydrophobicContact CB-CD1 3.81Å; C236-H257 VanDerWaalsContact SG-CD2 3.56Å; C236-H257 PolarHBondContact SG-NE2 2.72Å
237	N	92.5	Very high	91.4	Very high	139 Å²	139	84.6 Å²	84.6	74%	0.743	44%	0.441	S	S	*	.	S	Bend	trans	-86.4	-6.9	175.4	62.8	-28.8	0	0	0	113.2
238	Q	92	Very high	91.1	Very high	111 Å²	111	88.8 Å²	88.8	52%	0.519	46%	0.457	S	S	.	.	S	Bend	trans	-115.7	-3.5	-177.8	-62.8	179.5	48.3	0	0	112.9	C236 H257	C236-Q238 VanDerWaalsContact C-N 3.34Å; C236-Q238 PolarHBondContact SG-N 3.15Å; Q238-H257 WeakPolarHBondContact CB-CE1 3.3Å; Q238-H257 WeakPolarHBondContact CB-ND1 3.41Å; Q238-H257 PolarHBondContact O-CE1 2.83Å; Q238-H257 VanDerWaalsContact OE1-CG 3.23Å; Q238-H257 PolarHBondContact OE1-ND1 2.84Å
239	C	92.5	Very high	91.1	Very high	42 Å²	42	84.6 Å²	84.6	28%	0.284	44%	0.436	S	S	.	.	S	Bend	trans	-160.6	169.6	171.1	72.2	0	0	0	0	111.7	C236 R241 H252	C236-C239 WeakPolarHBondContact CB-O 3.4Å; C239-R241 PolarHBondContact O-N 3.49Å; C239-H252 PolarHBondContact SG-NE2 3.11Å
240	D	92.8	Very high	91	Very high	162 Å²	162	85.1 Å²	85.1	87%	0.866	44%	0.441	S	S	*	.	S	Bend	trans	-73.4	2.6	-176.1	-59	-44.6	0	0	0	115.2
241	R	93	Very high	90.6	Very high	163 Å²	163	82.8 Å²	82.8	62%	0.615	43%	0.431	S	S	*	.			trans	-74.9	137	-175.8	-64	-172.9	-178.6	-160.7	3.5	111.2	C236 C239 F243	C236-R241 PolarHBondContact N-O 3Å; C239-R241 PolarHBondContact O-N 3.49Å; R241-F243 HydrophobicContact CB-CE2 3.6Å; R241-F243 HydrophobicContact CB-CZ 3.77Å
242	K	93.2	Very high	90.5	Very high	140 Å²	140	81.3 Å²	81.3	61%	0.609	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	136	178.1	-54	-176.6	-177.5	179.1	0	110.7	K233 H234 P235	K233-K242 HydrophobicContact CB-CB 3.76Å; K233-K242 HydrophobicContact CD-CB 3.97Å; H234-K242 WeakPolarHBondContact O-CA 3.49Å; P235-K242 HydrophobicContact CB-CG 4.24Å
243	F	89.8	Confident	90.4	Very high	42 Å²	42	79 Å²	79	18%	0.184	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	145.1	-172.1	-60.4	-93.4	0	0	0	112.1	K233 H234 R241 T245 K248 L249 H252	K233-F243 CarbonylContact C-O 3.54Å; K233-F243 WeakPolarHBondContact CA-O 3.39Å; H234-F243 PolarHBondContact N-O 2.84Å; H234-F243 PolarHBondContact O-N 3.33Å; R241-F243 HydrophobicContact CB-CE2 3.6Å; R241-F243 HydrophobicContact CB-CZ 3.77Å; F243-T245 VanDerWaalsContact C-N 3.28Å; F243-T245 PolarHBondContact O-N 3.24Å; F243-K248 HydrophobicContact CB-CB 4.26Å; F243-K248 HydrophobicContact CD1-CB 4.13Å; F243-L249 HydrophobicContact CB-CB 4.08Å; F243-L249 HydrophobicContact CD2-CB 3.97Å; F243-L249 HydrophobicContact CD2-CD1 3.59Å; F243-L249 HydrophobicContact CD2-CG 4.39Å; F243-L249 HydrophobicContact CE2-CD1 3.89Å; F243-L249 HydrophobicContact CG-CB 4.16Å; F243-H252 HydrophobicContact CD1-CB 4.48Å; F243-H252 HydrophobicContact CE1-CB 3.65Å; F243-H252 AromaticContact CE1-CG 3.99Å; F243-H252 HydrophobicContact CE2-CB 3.87Å; F243-H252 AromaticContact CE2-CD2 3.24Å; F243-H252 WeakPolarHBondContact CE2-CD2 3.45Å; F243-H252 AromaticContact CE2-CG 3.57Å; F243-H252 AromaticContact CE2-NE2 3.9Å; F243-H252 HydrophobicContact CZ-CB 3.3Å; F243-H252 AromaticContact CZ-CD2 3.34Å; F243-H252 WeakPolarHBondContact CZ-CD2 3.41Å; F243-H252 AromaticContact CZ-CG 3.13Å; F243-H252 AromaticContact CZ-ND1 3.74Å; F243-H252 AromaticContact CZ-NE2 3.96Å
244	G	89.5	Confident	90.1	Very high	27 Å²	27	78.6 Å²	78.6	28%	0.278	40%	0.397	S	S	.	.	S	Bend	trans	-70.4	-19.8	179.4	0	0	0	0	0	114.4	V227	V227-G244 WeakPolarHBondContact CG2-O 3.38Å
245	T	89.4	Confident	89.7	Confident	50 Å²	50	76.8 Å²	76.8	31%	0.307	39%	0.392	S	S	.	.	S	Bend	trans	-138.7	149.6	177.6	67.7	0	0	0	0	111.3	V223 F243 S247 K248 L249	V223-T245 HydrophobicContact CG1-CG2 3.95Å; F243-T245 VanDerWaalsContact C-N 3.28Å; F243-T245 PolarHBondContact O-N 3.24Å; T245-S247 PolarHBondContact O-N 3.03Å; T245-K248 PolarHBondContact O-N 3.06Å; T245-K248 VanDerWaalsContact O-N 3.08Å; T245-K248 WeakPolarHBondContact OG1-CG 3.45Å; T245-K248 PolarHBondContact OG1-N 3.22Å; T245-L249 PolarHBondContact O-N 2.99Å; T245-L249 VanDerWaalsContact O-N 3.07Å
246	K	89.6	Confident	89.3	Confident	139 Å²	139	75.7 Å²	75.7	60%	0.604	39%	0.389	S	S	*	.	H	α-helix	trans	-58	-36.4	175.9	-171.7	171.3	-176.6	171.4	0	112.7	H234 K248 L249 N250	H234-K246 PolarHBondContact CD2-N 3.49Å; H234-K246 VanDerWaalsContact CD2-N 3.29Å; H234-K246 PolarHBondContact NE2-N 3.36Å; K246-K248 VanDerWaalsContact C-N 3.32Å; K246-K248 PolarHBondContact O-N 3.44Å; K246-L249 PolarHBondContact O-N 3.26Å; K246-N250 VanDerWaalsContact O-CG 3.3Å; K246-N250 PolarHBondContact O-N 2.83Å; K246-N250 PolarHBondContact O-OD1 2.88Å
247	S	85.8	Confident	89.1	Confident	72 Å²	72	77.9 Å²	77.9	50%	0.503	40%	0.399	S	S	.	.	H	α-helix	trans	-60.8	-41.1	175.1	-178.9	0	0	0	0	112	T245 N250 D251	T245-S247 PolarHBondContact O-N 3.03Å; S247-N250 PolarHBondContact O-N 3.01Å; S247-D251 VanDerWaalsContact O-CG 3.25Å; S247-D251 PolarHBondContact O-N 2.78Å
248	K	87.7	Confident	88.9	Confident	112 Å²	112	76.9 Å²	76.9	49%	0.487	39%	0.389	S	S	.	.	H	α-helix	trans	-73.6	-33.4	179.5	-67.7	-65.6	167.5	-154	0	113	F243 T245 K246 D251 H252	F243-K248 HydrophobicContact CB-CB 4.26Å; F243-K248 HydrophobicContact CD1-CB 4.13Å; T245-K248 PolarHBondContact O-N 3.06Å; T245-K248 VanDerWaalsContact O-N 3.08Å; T245-K248 WeakPolarHBondContact OG1-CG 3.45Å; T245-K248 PolarHBondContact OG1-N 3.22Å; K246-K248 VanDerWaalsContact C-N 3.32Å; K246-K248 PolarHBondContact O-N 3.44Å; K248-D251 IonicContact NZ-OD2 2.67Å; K248-D251 PolarHBondContact NZ-OD2 3.21Å; K248-H252 WeakPolarHBondContact O-CB 3.48Å; K248-H252 PolarHBondContact O-N 3.39Å
249	L	90.2	Very high	88.4	Confident	19 Å²	19	74 Å²	74	10%	0.099	39%	0.39	C	S	.	.	H	α-helix	trans	-61.1	-46.4	168.1	173.7	61.9	0	0	0	110.9	H234 P235 C236 F243 T245 K246 H252 I253	H234-L249 HydrophobicContact CB-CB 4.26Å; H234-L249 HydrophobicContact CB-CD2 3.75Å; P235-L249 WeakPolarHBondContact O-CD2 3.38Å; C236-L249 HydrophobicContact CB-CD1 3.81Å; F243-L249 HydrophobicContact CB-CB 4.08Å; F243-L249 HydrophobicContact CD2-CB 3.97Å; F243-L249 HydrophobicContact CD2-CD1 3.59Å; F243-L249 HydrophobicContact CD2-CG 4.39Å; F243-L249 HydrophobicContact CE2-CD1 3.89Å; F243-L249 HydrophobicContact CG-CB 4.16Å; T245-L249 PolarHBondContact O-N 2.99Å; T245-L249 VanDerWaalsContact O-N 3.07Å; K246-L249 PolarHBondContact O-N 3.26Å; L249-H252 CarbonylContact O-C 3.59Å; L249-H252 WeakPolarHBondContact O-CA 3.34Å; L249-H252 WeakPolarHBondContact O-CB 3.32Å; L249-H252 PolarHBondContact O-N 3.35Å; L249-H252 VanDerWaalsContact O-N 3.15Å; L249-I253 HydrophobicContact CD1-CD1 3.9Å; L249-I253 HydrophobicContact CD1-CG1 4.05Å; L249-I253 HydrophobicContact CD2-CD1 4.42Å; L249-I253 HydrophobicContact CG-CD1 3.81Å; L249-I253 HydrophobicContact CG-CG1 4.38Å; L249-I253 WeakPolarHBondContact O-CG1 3.45Å; L249-I253 PolarHBondContact O-N 3.4Å
250	N	88.8	Confident	87.9	Confident	71 Å²	71	75.1 Å²	75.1	38%	0.38	40%	0.395	S	S	.	.	H	α-helix	trans	-63.8	-43	178.8	-71.9	2.9	0	0	0	112.5	K246 S247 H252 I253 K254	K246-N250 VanDerWaalsContact O-CG 3.3Å; K246-N250 PolarHBondContact O-N 2.83Å; K246-N250 PolarHBondContact O-OD1 2.88Å; S247-N250 PolarHBondContact O-N 3.01Å; N250-H252 PolarHBondContact O-N 3.02Å; N250-I253 PolarHBondContact O-N 3.31Å; N250-K254 WeakPolarHBondContact O-CB 3.36Å; N250-K254 WeakPolarHBondContact O-CG 3.36Å; N250-K254 PolarHBondContact O-N 2.88Å
251	D	84.6	Confident	87.6	Confident	51 Å²	51	70.1 Å²	70.1	27%	0.273	37%	0.37	S	S	.	.	H	α-helix	trans	-56.8	-41.1	173.4	-67.9	-15.3	0	0	0	110.4	S247 K248 V255	S247-D251 VanDerWaalsContact O-CG 3.25Å; S247-D251 PolarHBondContact O-N 2.78Å; K248-D251 IonicContact NZ-OD2 2.67Å; K248-D251 PolarHBondContact NZ-OD2 3.21Å; D251-V255 VanDerWaalsContact O-CG2 3.3Å; D251-V255 WeakPolarHBondContact O-CG2 3.5Å; D251-V255 PolarHBondContact O-N 3.44Å
252	H	87.4	Confident	87.1	Confident	18 Å²	18	65 Å²	65	8%	0.083	35%	0.353	C	S	.	.	H	α-helix	trans	-67.1	-46.3	176.5	161.4	65.3	0	0	0	113	C239 F243 K248 L249 N250 K254 V255 A256 H257	C239-H252 PolarHBondContact SG-NE2 3.11Å; F243-H252 HydrophobicContact CD1-CB 4.48Å; F243-H252 HydrophobicContact CE1-CB 3.65Å; F243-H252 AromaticContact CE1-CG 3.99Å; F243-H252 HydrophobicContact CE2-CB 3.87Å; F243-H252 AromaticContact CE2-CD2 3.24Å; F243-H252 WeakPolarHBondContact CE2-CD2 3.45Å; F243-H252 AromaticContact CE2-CG 3.57Å; F243-H252 AromaticContact CE2-NE2 3.9Å; F243-H252 HydrophobicContact CZ-CB 3.3Å; F243-H252 AromaticContact CZ-CD2 3.34Å; F243-H252 WeakPolarHBondContact CZ-CD2 3.41Å; F243-H252 AromaticContact CZ-CG 3.13Å; F243-H252 AromaticContact CZ-ND1 3.74Å; F243-H252 AromaticContact CZ-NE2 3.96Å; K248-H252 WeakPolarHBondContact O-CB 3.48Å; K248-H252 PolarHBondContact O-N 3.39Å; L249-H252 CarbonylContact O-C 3.59Å; L249-H252 WeakPolarHBondContact O-CA 3.34Å; L249-H252 WeakPolarHBondContact O-CB 3.32Å; L249-H252 PolarHBondContact O-N 3.35Å; L249-H252 VanDerWaalsContact O-N 3.15Å; N250-H252 PolarHBondContact O-N 3.02Å; H252-K254 VanDerWaalsContact C-N 3.31Å; H252-K254 PolarHBondContact O-N 2.96Å; H252-V255 PolarHBondContact O-N 3.48Å; H252-A256 WeakPolarHBondContact CE1-CB 3.46Å; H252-A256 WeakPolarHBondContact ND1-CB 3.5Å; H252-A256 VanDerWaalsContact O-CB 3.24Å; H252-A256 WeakPolarHBondContact O-CB 3.48Å; H252-A256 PolarHBondContact O-N 2.96Å; H252-H257 AromaticContact CE1-NE2 3.83Å; H252-H257 AromaticContact NE2-CD2 3.84Å; H252-H257 AromaticContact NE2-NE2 3.45Å; H252-H257 PolarHBondContact NE2-NE2 3.09Å
253	I	88.2	Confident	86.7	Confident	30 Å²	30	61 Å²	61	15%	0.154	34%	0.341	C	S	.	.	H	α-helix	trans	-58.6	-47.7	179.2	-69.8	167.8	0	0	0	110	L249 N250 V255 H257 E258	L249-I253 HydrophobicContact CD1-CD1 3.9Å; L249-I253 HydrophobicContact CD1-CG1 4.05Å; L249-I253 HydrophobicContact CD2-CD1 4.42Å; L249-I253 HydrophobicContact CG-CD1 3.81Å; L249-I253 HydrophobicContact CG-CG1 4.38Å; L249-I253 WeakPolarHBondContact O-CG1 3.45Å; L249-I253 PolarHBondContact O-N 3.4Å; N250-I253 PolarHBondContact O-N 3.31Å; I253-V255 VanDerWaalsContact C-N 3.3Å; I253-V255 PolarHBondContact O-N 3.46Å; I253-H257 HydrophobicContact CG2-CB 4.37Å; I253-H257 WeakPolarHBondContact O-CA 3.38Å; I253-H257 WeakPolarHBondContact O-CB 3.45Å; I253-H257 PolarHBondContact O-N 3.37Å; I253-E258 HydrophobicContact CG2-CG 4.16Å; I253-E258 PolarHBondContact O-N 2.79Å
254	K	85.9	Confident	86.6	Confident	98 Å²	98	59 Å²	59	43%	0.426	33%	0.332	S	S	.	.	H	α-helix	trans	-51	-50.1	176.2	-78.5	179.9	176.8	-165.9	0	112.1	N250 H252 E258 G259 V260	N250-K254 WeakPolarHBondContact O-CB 3.36Å; N250-K254 WeakPolarHBondContact O-CG 3.36Å; N250-K254 PolarHBondContact O-N 2.88Å; H252-K254 VanDerWaalsContact C-N 3.31Å; H252-K254 PolarHBondContact O-N 2.96Å; K254-E258 WeakPolarHBondContact CG-OE2 3.43Å; K254-E258 CarbonylContact O-C 3.56Å; K254-E258 WeakPolarHBondContact O-CB 3.48Å; K254-E258 PolarHBondContact O-N 2.83Å; K254-G259 PolarHBondContact O-N 3.47Å; K254-G259 VanDerWaalsContact O-N 3.14Å; K254-V260 HydrophobicContact CB-CB 4.06Å; K254-V260 WeakPolarHBondContact O-CA 3.37Å; K254-V260 WeakPolarHBondContact O-CB 3.43Å; K254-V260 PolarHBondContact O-N 2.94Å
255	V	84.9	Confident	86.6	Confident	37 Å²	37	65.2 Å²	65.2	22%	0.224	36%	0.359	C	S	.	.	H	α-helix	trans	-80.1	-44.9	-174.1	177.7	0	0	0	0	113	D251 H252 I253 V260 F262 S272	D251-V255 VanDerWaalsContact O-CG2 3.3Å; D251-V255 WeakPolarHBondContact O-CG2 3.5Å; D251-V255 PolarHBondContact O-N 3.44Å; H252-V255 PolarHBondContact O-N 3.48Å; I253-V255 VanDerWaalsContact C-N 3.3Å; I253-V255 PolarHBondContact O-N 3.46Å; V255-V260 WeakPolarHBondContact CA-O 3.41Å; V255-V260 WeakPolarHBondContact CG2-O 3.45Å; V255-F262 HydrophobicContact CG2-CE2 4.48Å; V255-S272 VanDerWaalsContact CG2-O 3.28Å; V255-S272 WeakPolarHBondContact CG2-O 3.39Å
256	A	85.2	Confident	86.5	Confident	57 Å²	57	69.3 Å²	69.3	47%	0.471	38%	0.375	S	S	.	.	H	α-helix	trans	-88.4	-24.7	-169.1	0	0	0	0	0	113.5	H252	H252-A256 WeakPolarHBondContact CE1-CB 3.46Å; H252-A256 WeakPolarHBondContact ND1-CB 3.5Å; H252-A256 VanDerWaalsContact O-CB 3.24Å; H252-A256 WeakPolarHBondContact O-CB 3.48Å; H252-A256 PolarHBondContact O-N 2.96Å
257	H	88.2	Confident	86.6	Confident	56 Å²	56	65.4 Å²	65.4	26%	0.259	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.1	-38.6	-172.2	-65.2	-58.4	0	0	0	112.6	C236 Q238 H252 I253	C236-H257 VanDerWaalsContact SG-CD2 3.56Å; C236-H257 PolarHBondContact SG-NE2 2.72Å; Q238-H257 WeakPolarHBondContact CB-CE1 3.3Å; Q238-H257 WeakPolarHBondContact CB-ND1 3.41Å; Q238-H257 PolarHBondContact O-CE1 2.83Å; Q238-H257 VanDerWaalsContact OE1-CG 3.23Å; Q238-H257 PolarHBondContact OE1-ND1 2.84Å; H252-H257 AromaticContact CE1-NE2 3.83Å; H252-H257 AromaticContact NE2-CD2 3.84Å; H252-H257 AromaticContact NE2-NE2 3.45Å; H252-H257 PolarHBondContact NE2-NE2 3.09Å; I253-H257 HydrophobicContact CG2-CB 4.37Å; I253-H257 WeakPolarHBondContact O-CA 3.38Å; I253-H257 WeakPolarHBondContact O-CB 3.45Å; I253-H257 PolarHBondContact O-N 3.37Å
258	E	87.7	Confident	86.7	Confident	118 Å²	118	64.5 Å²	64.5	55%	0.551	37%	0.366	S	S	*	.	S	Bend	trans	-91.9	-3.4	177.3	-56.5	172.8	174.8	0	0	112.7	I253 K254 V260	I253-E258 HydrophobicContact CG2-CG 4.16Å; I253-E258 PolarHBondContact O-N 2.79Å; K254-E258 WeakPolarHBondContact CG-OE2 3.43Å; K254-E258 CarbonylContact O-C 3.56Å; K254-E258 WeakPolarHBondContact O-CB 3.48Å; K254-E258 PolarHBondContact O-N 2.83Å; E258-V260 HydrophobicContact CB-CG2 3.98Å; E258-V260 PolarHBondContact O-N 3.19Å
259	G	82.4	Confident	86.7	Confident	51 Å²	51	64.7 Å²	64.7	53%	0.526	37%	0.367	S	S	.	.			trans	63.9	11.5	-178.7	0	0	0	0	0	114.4	K254 T261	K254-G259 PolarHBondContact O-N 3.47Å; K254-G259 VanDerWaalsContact O-N 3.14Å; G259-T261 PolarHBondContact O-N 3.01Å
260	V	82.5	Confident	86.5	Confident	64 Å²	64	69.3 Å²	69.3	39%	0.388	39%	0.391	S	S	.	.			trans	-70.5	99.6	175.8	-179.6	0	0	0	0	108	K254 V255 E258	K254-V260 HydrophobicContact CB-CB 4.06Å; K254-V260 WeakPolarHBondContact O-CA 3.37Å; K254-V260 WeakPolarHBondContact O-CB 3.43Å; K254-V260 PolarHBondContact O-N 2.94Å; V255-V260 WeakPolarHBondContact CA-O 3.41Å; V255-V260 WeakPolarHBondContact CG2-O 3.45Å; E258-V260 HydrophobicContact CB-CG2 3.98Å; E258-V260 PolarHBondContact O-N 3.19Å
261	T	85.3	Confident	86.3	Confident	58 Å²	58	67.9 Å²	67.9	36%	0.356	38%	0.381	S	S	.	.			trans	-106.4	162.9	178.4	65.8	0	0	0	0	111.2	G259 P263 I270	G259-T261 PolarHBondContact O-N 3.01Å; T261-P263 VanDerWaalsContact C-CD 3.45Å; T261-P263 VanDerWaalsContact O-CD 3.27Å; T261-P263 WeakPolarHBondContact O-CD 3.36Å; T261-I270 HydrophobicContact CG2-CG2 3.56Å
262	F	83.3	Confident	86.2	Confident	55 Å²	55	69.1 Å²	69.1	24%	0.241	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	80.4	174.9	-60.1	-87.3	0	0	0	107.6	V255 F271 S273 N274 L277	V255-F262 HydrophobicContact CG2-CE2 4.48Å; F262-F271 HydrophobicContact CB-CB 4.19Å; F262-F271 WeakPolarHBondContact CD2-O 3.24Å; F262-F271 PolarHBondContact N-O 3.21Å; F262-F271 WeakPolarHBondContact O-CD2 3.42Å; F262-F271 PolarHBondContact O-N 3.45Å; F262-S273 VanDerWaalsContact CD2-C 3.48Å; F262-S273 VanDerWaalsContact CD2-CA 3.45Å; F262-N274 HydrophobicContact CD1-CB 3.89Å; F262-N274 HydrophobicContact CE1-CB 3.73Å; F262-N274 HydrophobicContact CZ-CB 4.32Å; F262-L277 HydrophobicContact CB-CB 4.06Å; F262-L277 HydrophobicContact CB-CD2 3.92Å
263	P	85	Confident	85.8	Confident	55 Å²	55	69.8 Å²	69.8	36%	0.357	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	149.6	176.7	30.4	-34.5	0	0	0	110.4	T261 K269 L277	T261-P263 VanDerWaalsContact C-CD 3.45Å; T261-P263 VanDerWaalsContact O-CD 3.27Å; T261-P263 WeakPolarHBondContact O-CD 3.36Å; P263-K269 CarbonylContact C-O 3.56Å; P263-K269 WeakPolarHBondContact CA-O 3.25Å; P263-L277 WeakPolarHBondContact O-CD2 3.46Å
264	C	87.8	Confident	85.4	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.007	42%	0.42	C	S	.	.			trans	-92.6	115.3	165.2	172.1	0	0	0	0	108.3	E266 C267 G268 K269 F271 L277 H280 L281 H285	C264-E266 PolarHBondContact O-N 3.24Å; C264-C267 PolarHBondContact O-N 3.47Å; C264-G268 VanDerWaalsContact O-CA 3.3Å; C264-G268 WeakPolarHBondContact O-CA 3.33Å; C264-G268 PolarHBondContact O-N 3.19Å; C264-K269 PolarHBondContact N-O 2.92Å; C264-F271 HydrophobicContact CB-CE2 4.19Å; C264-L277 HydrophobicContact CB-CD1 3.64Å; C264-H280 PolarHBondContact SG-NE2 3.17Å; C264-L281 VanDerWaalsContact SG-CD2 3.6Å; C264-H285 PolarHBondContact SG-NE2 3.48Å
265	D	89	Confident	85.1	Confident	157 Å²	157	71 Å²	71	84%	0.84	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-26.4	-176.3	-55.9	-36.5	0	0	0	112.6
266	E	87.3	Confident	85.1	Confident	136 Å²	136	70 Å²	70	64%	0.636	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-24	179.4	-67.3	-176.8	-127.4	0	0	114.7	C264 H285	C264-E266 PolarHBondContact O-N 3.24Å; E266-H285 WeakPolarHBondContact CB-CE1 3.43Å; E266-H285 WeakPolarHBondContact CB-ND1 3.29Å; E266-H285 VanDerWaalsContact CD-ND1 3.35Å; E266-H285 IonicContact OE1-CG 2.9Å; E266-H285 IonicContact OE1-ND1 3.21Å; E266-H285 WeakPolarHBondContact OE2-CB 3.42Å; E266-H285 IonicContact OE2-CE1 3.94Å; E266-H285 IonicContact OE2-CG 3.99Å; E266-H285 IonicContact OE2-ND1 3.22Å; E266-H285 PolarHBondContact OE2-ND1 2.96Å
267	C	91.3	Very high	85	Confident	58 Å²	58	68.3 Å²	68.3	39%	0.392	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.9	2.8	-178.3	70.4	0	0	0	0	115.8	C264 K269 H280 H285	C264-C267 PolarHBondContact O-N 3.47Å; C267-K269 PolarHBondContact O-N 3.29Å; C267-K269 VanDerWaalsContact O-N 3.1Å; C267-H280 VanDerWaalsContact SG-CE1 3.56Å; C267-H280 PolarHBondContact SG-NE2 2.9Å; C267-H285 PolarHBondContact SG-NE2 2.73Å
268	G	87.9	Confident	84.8	Confident	53 Å²	53	68.3 Å²	68.3	55%	0.546	41%	0.408	S	S	.	.			trans	69.2	0.9	-179.1	0	0	0	0	0	115.4	C264 I270	C264-G268 VanDerWaalsContact O-CA 3.3Å; C264-G268 WeakPolarHBondContact O-CA 3.33Å; C264-G268 PolarHBondContact O-N 3.19Å; G268-I270 PolarHBondContact O-N 3.23Å
269	K	88.5	Confident	84.5	Confident	115 Å²	115	68.9 Å²	68.9	50%	0.5	41%	0.405	S	S	.	.			trans	-66.4	133.3	179.1	-77.7	-177.2	-176	169	0	111.2	P263 C264 C267 F271	P263-K269 CarbonylContact C-O 3.56Å; P263-K269 WeakPolarHBondContact CA-O 3.25Å; C264-K269 PolarHBondContact N-O 2.92Å; C267-K269 PolarHBondContact O-N 3.29Å; C267-K269 VanDerWaalsContact O-N 3.1Å; K269-F271 HydrophobicContact CB-CE2 3.7Å; K269-F271 HydrophobicContact CB-CZ 3.89Å; K269-F271 HydrophobicContact CD-CZ 4.41Å; K269-F271 WeakPolarHBondContact O-CD2 3.45Å; K269-F271 WeakPolarHBondContact O-CE2 3.34Å
270	I	86.4	Confident	84.6	Confident	116 Å²	116	67.1 Å²	67.1	60%	0.595	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	128.7	-175.8	-57.5	-179.1	0	0	0	110.8	T261 G268	T261-I270 HydrophobicContact CG2-CG2 3.56Å; G268-I270 PolarHBondContact O-N 3.23Å
271	F	82.6	Confident	84.7	Confident	42 Å²	42	66.3 Å²	66.3	18%	0.184	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	151.7	180	-61.7	-86.7	0	0	0	112.6	F262 C264 K269 S273 A276 L277 H280	F262-F271 HydrophobicContact CB-CB 4.19Å; F262-F271 WeakPolarHBondContact CD2-O 3.24Å; F262-F271 PolarHBondContact N-O 3.21Å; F262-F271 WeakPolarHBondContact O-CD2 3.42Å; F262-F271 PolarHBondContact O-N 3.45Å; C264-F271 HydrophobicContact CB-CE2 4.19Å; K269-F271 HydrophobicContact CB-CE2 3.7Å; K269-F271 HydrophobicContact CB-CZ 3.89Å; K269-F271 HydrophobicContact CD-CZ 4.41Å; K269-F271 WeakPolarHBondContact O-CD2 3.45Å; K269-F271 WeakPolarHBondContact O-CE2 3.34Å; F271-S273 VanDerWaalsContact C-N 3.32Å; F271-A276 HydrophobicContact CB-CB 4.19Å; F271-A276 HydrophobicContact CD1-CB 4Å; F271-A276 HydrophobicContact CG-CB 4.43Å; F271-L277 HydrophobicContact CB-CB 4.13Å; F271-L277 HydrophobicContact CD2-CB 3.95Å; F271-L277 HydrophobicContact CD2-CD1 3.66Å; F271-L277 HydrophobicContact CD2-CG 4.41Å; F271-L277 HydrophobicContact CE2-CD1 3.92Å; F271-L277 HydrophobicContact CG-CB 4.15Å; F271-H280 HydrophobicContact CE1-CB 3.71Å; F271-H280 HydrophobicContact CE2-CB 3.79Å; F271-H280 AromaticContact CE2-CD2 3.61Å; F271-H280 AromaticContact CE2-CG 3.51Å; F271-H280 HydrophobicContact CZ-CB 3.29Å; F271-H280 AromaticContact CZ-CD2 3.74Å; F271-H280 AromaticContact CZ-CG 3.13Å; F271-H280 AromaticContact CZ-ND1 3.4Å; F271-H280 WeakPolarHBondContact CZ-ND1 3.26Å
272	S	82.5	Confident	84.6	Confident	76 Å²	76	66.5 Å²	66.5	53%	0.531	37%	0.374	S	S	.	.	S	Bend	trans	-87.4	3.3	179.1	72.1	0	0	0	0	114	V255	V255-S272 VanDerWaalsContact CG2-O 3.28Å; V255-S272 WeakPolarHBondContact CG2-O 3.39Å
273	S	80.1	Confident	84.8	Confident	33 Å²	33	65 Å²	65	23%	0.231	37%	0.37	C	S	.	.	S	Bend	trans	-163.6	148.4	176.1	62.7	0	0	0	0	110.5	F262 F271 G275 A276 L277	F262-S273 VanDerWaalsContact CD2-C 3.48Å; F262-S273 VanDerWaalsContact CD2-CA 3.45Å; F271-S273 VanDerWaalsContact C-N 3.32Å; S273-G275 PolarHBondContact O-N 3.21Å; S273-A276 WeakPolarHBondContact O-CB 3.41Å; S273-A276 PolarHBondContact O-N 3.34Å; S273-A276 WeakPolarHBondContact OG-CB 3.39Å; S273-A276 PolarHBondContact OG-N 3.31Å; S273-L277 PolarHBondContact O-N 2.89Å; S273-L277 VanDerWaalsContact O-N 3.11Å
274	N	80.2	Confident	84.9	Confident	103 Å²	103	66.3 Å²	66.3	55%	0.551	38%	0.376	S	S	*	.	H	α-helix	trans	-56.7	-36.6	175.6	-166.6	51	0	0	0	113	F262 A276 L277 C278	F262-N274 HydrophobicContact CD1-CB 3.89Å; F262-N274 HydrophobicContact CE1-CB 3.73Å; F262-N274 HydrophobicContact CZ-CB 4.32Å; N274-A276 VanDerWaalsContact C-N 3.3Å; N274-A276 PolarHBondContact O-N 2.89Å; N274-L277 PolarHBondContact O-N 3.36Å; N274-C278 VanDerWaalsContact O-CB 3.31Å; N274-C278 WeakPolarHBondContact O-CB 3.48Å; N274-C278 PolarHBondContact O-N 2.77Å
275	G	80	Confident	84.8	Confident	49 Å²	49	68.7 Å²	68.7	51%	0.505	39%	0.388	S	S	.	.	H	α-helix	trans	-69	-25.7	177.1	0	0	0	0	0	114	S273 R279	S273-G275 PolarHBondContact O-N 3.21Å; G275-R279 PolarHBondContact O-N 3.39Å
276	A	83.7	Confident	84.6	Confident	18 Å²	18	67.1 Å²	67.1	15%	0.149	38%	0.375	C	S	.	.	H	α-helix	trans	-77.4	-42.8	172.9	0	0	0	0	0	111.2	F271 S273 N274 R279 H280	F271-A276 HydrophobicContact CB-CB 4.19Å; F271-A276 HydrophobicContact CD1-CB 4Å; F271-A276 HydrophobicContact CG-CB 4.43Å; S273-A276 WeakPolarHBondContact O-CB 3.41Å; S273-A276 PolarHBondContact O-N 3.34Å; S273-A276 WeakPolarHBondContact OG-CB 3.39Å; S273-A276 PolarHBondContact OG-N 3.31Å; N274-A276 VanDerWaalsContact C-N 3.3Å; N274-A276 PolarHBondContact O-N 2.89Å; A276-R279 PolarHBondContact O-N 2.98Å; A276-H280 PolarHBondContact O-N 3.34Å
277	L	83.5	Confident	84.5	Confident	20 Å²	20	62.8 Å²	62.8	11%	0.105	37%	0.367	C	S	.	.	H	α-helix	trans	-58.9	-48.8	172.5	173.7	61.4	0	0	0	111.3	F262 P263 C264 F271 S273 N274 R279 H280 L281	F262-L277 HydrophobicContact CB-CB 4.06Å; F262-L277 HydrophobicContact CB-CD2 3.92Å; P263-L277 WeakPolarHBondContact O-CD2 3.46Å; C264-L277 HydrophobicContact CB-CD1 3.64Å; F271-L277 HydrophobicContact CB-CB 4.13Å; F271-L277 HydrophobicContact CD2-CB 3.95Å; F271-L277 HydrophobicContact CD2-CD1 3.66Å; F271-L277 HydrophobicContact CD2-CG 4.41Å; F271-L277 HydrophobicContact CE2-CD1 3.92Å; F271-L277 HydrophobicContact CG-CB 4.15Å; S273-L277 PolarHBondContact O-N 2.89Å; S273-L277 VanDerWaalsContact O-N 3.11Å; N274-L277 PolarHBondContact O-N 3.36Å; L277-R279 VanDerWaalsContact C-N 3.32Å; L277-R279 PolarHBondContact O-N 2.78Å; L277-H280 CarbonylContact O-C 3.57Å; L277-H280 WeakPolarHBondContact O-CA 3.23Å; L277-H280 WeakPolarHBondContact O-CB 3Å; L277-H280 PolarHBondContact O-N 2.72Å; L277-L281 HydrophobicContact CD1-CD1 4.2Å; L277-L281 HydrophobicContact CD1-CD2 4.37Å; L277-L281 HydrophobicContact CD1-CG 4.01Å; L277-L281 HydrophobicContact CG-CD1 4.08Å; L277-L281 HydrophobicContact CG-CG 4.33Å; L277-L281 WeakPolarHBondContact O-CG 3.41Å; L277-L281 PolarHBondContact O-N 2.9Å
278	C	84.7	Confident	84.1	Confident	56 Å²	56	63.4 Å²	63.4	38%	0.378	37%	0.366	S	S	.	.	H	α-helix	trans	-57.1	-44.1	179.4	179.5	0	0	0	0	112.3	N274 H280 L281 Q282	N274-C278 VanDerWaalsContact O-CB 3.31Å; N274-C278 WeakPolarHBondContact O-CB 3.48Å; N274-C278 PolarHBondContact O-N 2.77Å; C278-H280 VanDerWaalsContact C-N 3.34Å; C278-H280 PolarHBondContact O-N 3.38Å; C278-L281 PolarHBondContact O-N 3.39Å; C278-Q282 VanDerWaalsContact O-CG 3.27Å; C278-Q282 WeakPolarHBondContact O-CG 3.26Å; C278-Q282 PolarHBondContact O-N 3.5Å
279	R	81.1	Confident	84	Confident	130 Å²	130	66.1 Å²	66.1	49%	0.491	36%	0.362	S	S	.	.	H	α-helix	trans	-66.5	-35.3	175.1	-177.4	176.2	10.7	128.5	6.4	112.5	G275 A276 L277 S283	G275-R279 PolarHBondContact O-N 3.39Å; A276-R279 PolarHBondContact O-N 2.98Å; L277-R279 VanDerWaalsContact C-N 3.32Å; L277-R279 PolarHBondContact O-N 2.78Å; R279-S283 WeakPolarHBondContact O-CB 3.45Å; R279-S283 PolarHBondContact O-N 3.18Å; R279-S283 PolarHBondContact O-OG 3.47Å
280	H	84.7	Confident	83.9	Confident	14 Å²	14	64.1 Å²	64.1	7%	0.065	35%	0.352	C	S	.	.	H	α-helix	trans	-63	-50.2	173.2	163.2	82.7	0	0	0	111.1	C264 C267 F271 A276 L277 C278 Q282 S283 V284 H285	C264-H280 PolarHBondContact SG-NE2 3.17Å; C267-H280 VanDerWaalsContact SG-CE1 3.56Å; C267-H280 PolarHBondContact SG-NE2 2.9Å; F271-H280 HydrophobicContact CE1-CB 3.71Å; F271-H280 HydrophobicContact CE2-CB 3.79Å; F271-H280 AromaticContact CE2-CD2 3.61Å; F271-H280 AromaticContact CE2-CG 3.51Å; F271-H280 HydrophobicContact CZ-CB 3.29Å; F271-H280 AromaticContact CZ-CD2 3.74Å; F271-H280 AromaticContact CZ-CG 3.13Å; F271-H280 AromaticContact CZ-ND1 3.4Å; F271-H280 WeakPolarHBondContact CZ-ND1 3.26Å; A276-H280 PolarHBondContact O-N 3.34Å; L277-H280 CarbonylContact O-C 3.57Å; L277-H280 WeakPolarHBondContact O-CA 3.23Å; L277-H280 WeakPolarHBondContact O-CB 3Å; L277-H280 PolarHBondContact O-N 2.72Å; C278-H280 VanDerWaalsContact C-N 3.34Å; C278-H280 PolarHBondContact O-N 3.38Å; H280-Q282 VanDerWaalsContact C-N 3.32Å; H280-Q282 PolarHBondContact O-N 3.47Å; H280-S283 PolarHBondContact O-N 2.71Å; H280-S283 PolarHBondContact O-OG 3Å; H280-V284 WeakPolarHBondContact ND1-CG2 3.46Å; H280-V284 WeakPolarHBondContact O-CB 3.47Å; H280-V284 PolarHBondContact O-N 2.9Å; H280-H285 AromaticContact CD2-CD2 3.83Å; H280-H285 AromaticContact CD2-NE2 3.94Å; H280-H285 AromaticContact CE1-CD2 3.95Å; H280-H285 AromaticContact CE1-NE2 3.58Å; H280-H285 AromaticContact NE2-CD2 3.23Å; H280-H285 PolarHBondContact NE2-CD2 3.23Å; H280-H285 AromaticContact NE2-NE2 2.93Å; H280-H285 PolarHBondContact NE2-NE2 2.98Å
281	L	83.5	Confident	84	Confident	48 Å²	48	62.7 Å²	62.7	25%	0.251	35%	0.351	S	S	.	.	I	π-helix	trans	-56.1	-47.7	177	-67.7	173.2	0	0	0	111.2	C264 L277 C278 S283 H285 Q286	C264-L281 VanDerWaalsContact SG-CD2 3.6Å; L277-L281 HydrophobicContact CD1-CD1 4.2Å; L277-L281 HydrophobicContact CD1-CD2 4.37Å; L277-L281 HydrophobicContact CD1-CG 4.01Å; L277-L281 HydrophobicContact CG-CD1 4.08Å; L277-L281 HydrophobicContact CG-CG 4.33Å; L277-L281 WeakPolarHBondContact O-CG 3.41Å; L277-L281 PolarHBondContact O-N 2.9Å; C278-L281 PolarHBondContact O-N 3.39Å; L281-S283 PolarHBondContact O-N 3.21Å; L281-H285 WeakPolarHBondContact O-CB 3.28Å; L281-H285 PolarHBondContact O-N 3.46Å; L281-H285 VanDerWaalsContact O-N 3.08Å; L281-Q286 PolarHBondContact O-N 3.14Å
282	Q	83	Confident	84.3	Confident	62 Å²	62	61.3 Å²	61.3	29%	0.29	35%	0.346	S	S	.	.	I	π-helix	trans	-58.9	-47	177.4	-72.4	174.5	-4.2	0	0	112.1	C278 H280 Q286 G287 I288	C278-Q282 VanDerWaalsContact O-CG 3.27Å; C278-Q282 WeakPolarHBondContact O-CG 3.26Å; C278-Q282 PolarHBondContact O-N 3.5Å; H280-Q282 VanDerWaalsContact C-N 3.32Å; H280-Q282 PolarHBondContact O-N 3.47Å; Q282-Q286 CarbonylContact O-C 3.57Å; Q282-G287 PolarHBondContact O-N 3.04Å; Q282-I288 HydrophobicContact CB-CB 4.29Å; Q282-I288 HydrophobicContact CB-CD1 4.23Å; Q282-I288 HydrophobicContact CG-CD1 4.13Å; Q282-I288 WeakPolarHBondContact O-CA 3.48Å; Q282-I288 WeakPolarHBondContact O-CB 3.03Å; Q282-I288 PolarHBondContact O-N 3.14Å
283	S	87.8	Confident	84.7	Confident	24 Å²	24	64.3 Å²	64.3	17%	0.168	36%	0.356	C	S	.	.	I	π-helix	trans	-85.4	-30.1	-171.4	57.4	0	0	0	0	115.2	R279 H280 L281	R279-S283 WeakPolarHBondContact O-CB 3.45Å; R279-S283 PolarHBondContact O-N 3.18Å; R279-S283 PolarHBondContact O-OG 3.47Å; H280-S283 PolarHBondContact O-N 2.71Å; H280-S283 PolarHBondContact O-OG 3Å; L281-S283 PolarHBondContact O-N 3.21Å
284	V	87.3	Confident	85.1	Confident	81 Å²	81	68.3 Å²	68.3	49%	0.491	37%	0.371	S	S	.	.	I	π-helix	trans	-99.8	-43.8	-174.4	178.6	0	0	0	0	111.6	H280	H280-V284 WeakPolarHBondContact ND1-CG2 3.46Å; H280-V284 WeakPolarHBondContact O-CB 3.47Å; H280-V284 PolarHBondContact O-N 2.9Å
285	H	86.4	Confident	85.7	Confident	52 Å²	52	65.1 Å²	65.1	24%	0.241	36%	0.357	C	S	.	.	I	π-helix	trans	-97.3	-44.6	-171.7	-64.9	-79.2	0	0	0	112	C264 E266 C267 H280 L281 G287	C264-H285 PolarHBondContact SG-NE2 3.48Å; E266-H285 WeakPolarHBondContact CB-CE1 3.43Å; E266-H285 WeakPolarHBondContact CB-ND1 3.29Å; E266-H285 VanDerWaalsContact CD-ND1 3.35Å; E266-H285 IonicContact OE1-CG 2.9Å; E266-H285 IonicContact OE1-ND1 3.21Å; E266-H285 WeakPolarHBondContact OE2-CB 3.42Å; E266-H285 IonicContact OE2-CE1 3.94Å; E266-H285 IonicContact OE2-CG 3.99Å; E266-H285 IonicContact OE2-ND1 3.22Å; E266-H285 PolarHBondContact OE2-ND1 2.96Å; C267-H285 PolarHBondContact SG-NE2 2.73Å; H280-H285 AromaticContact CD2-CD2 3.83Å; H280-H285 AromaticContact CD2-NE2 3.94Å; H280-H285 AromaticContact CE1-CD2 3.95Å; H280-H285 AromaticContact CE1-NE2 3.58Å; H280-H285 AromaticContact NE2-CD2 3.23Å; H280-H285 PolarHBondContact NE2-CD2 3.23Å; H280-H285 AromaticContact NE2-NE2 2.93Å; H280-H285 PolarHBondContact NE2-NE2 2.98Å; L281-H285 WeakPolarHBondContact O-CB 3.28Å; L281-H285 PolarHBondContact O-N 3.46Å; L281-H285 VanDerWaalsContact O-N 3.08Å; H285-G287 VanDerWaalsContact C-N 3.33Å
286	Q	83.6	Confident	86.2	Confident	124 Å²	124	70.8 Å²	70.8	58%	0.579	38%	0.375	S	S	*	.	S	Bend	trans	-85.5	-8.1	177.1	-58.9	174.6	-6.4	0	0	113	L281 Q282 I288	L281-Q286 PolarHBondContact O-N 3.14Å; Q282-Q286 CarbonylContact O-C 3.57Å; Q286-I288 HydrophobicContact CB-CD1 4.02Å; Q286-I288 HydrophobicContact CB-CG1 3.88Å; Q286-I288 PolarHBondContact O-N 3.46Å; Q286-I288 VanDerWaalsContact O-N 3.09Å
287	G	84.9	Confident	86.6	Confident	45 Å²	45	77.2 Å²	77.2	46%	0.464	40%	0.396	S	S	.	.			trans	63.2	14.6	-179.8	0	0	0	0	0	114.9	Q282 H285 K289	Q282-G287 PolarHBondContact O-N 3.04Å; H285-G287 VanDerWaalsContact C-N 3.33Å; G287-K289 PolarHBondContact O-N 3.47Å; G287-K289 VanDerWaalsContact O-N 3.1Å
288	I	83	Confident	86.9	Confident	71 Å²	71	81.1 Å²	81.1	36%	0.364	42%	0.416	S	S	.	.			trans	-66	112.8	-179.6	-59.8	175.2	0	0	0	108.8	Q282 Q286	Q282-I288 HydrophobicContact CB-CB 4.29Å; Q282-I288 HydrophobicContact CB-CD1 4.23Å; Q282-I288 HydrophobicContact CG-CD1 4.13Å; Q282-I288 WeakPolarHBondContact O-CA 3.48Å; Q282-I288 WeakPolarHBondContact O-CB 3.03Å; Q282-I288 PolarHBondContact O-N 3.14Å; Q286-I288 HydrophobicContact CB-CD1 4.02Å; Q286-I288 HydrophobicContact CB-CG1 3.88Å; Q286-I288 PolarHBondContact O-N 3.46Å; Q286-I288 VanDerWaalsContact O-N 3.09Å
289	K	86.6	Confident	86.9	Confident	109 Å²	109	80.3 Å²	80.3	47%	0.474	41%	0.405	S	S	.	.			trans	-118.8	153.7	173.6	-62.8	179.3	-173.2	174	0	109.7	G287 P291 L298 Y299	G287-K289 PolarHBondContact O-N 3.47Å; G287-K289 VanDerWaalsContact O-N 3.1Å; K289-P291 WeakPolarHBondContact O-CD 3.48Å; K289-L298 HydrophobicContact CB-CB 3.96Å; K289-L298 HydrophobicContact CD-CB 3.72Å; K289-L298 HydrophobicContact CD-CD1 3.92Å; K289-L298 HydrophobicContact CD-CG 4.46Å; K289-L298 HydrophobicContact CG-CB 4.43Å; K289-Y299 CarbonylContact C-O 3.58Å; K289-Y299 WeakPolarHBondContact CA-O 3.31Å
290	Y	85.7	Confident	87.1	Confident	73 Å²	73	77.7 Å²	77.7	29%	0.286	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	109.4	178.1	-60.3	-88.3	0	0	0	108.6	Y299 S301 R302	Y290-Y299 WeakPolarHBondContact CD2-O 3.44Å; Y290-Y299 PolarHBondContact N-O 2.84Å; Y290-Y299 PolarHBondContact O-N 3.45Å; Y290-S301 VanDerWaalsContact CD2-C 3.42Å; Y290-R302 HydrophobicContact CD1-CB 4.4Å; Y290-R302 HydrophobicContact CE1-CB 4.36Å
291	P	88.7	Confident	86.9	Confident	87 Å²	87	77.5 Å²	77.5	57%	0.565	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	146.1	179.4	29.4	-34	0	0	0	111.8	K289 L298 L305	K289-P291 WeakPolarHBondContact O-CD 3.48Å; P291-L298 HydrophobicContact CB-CD2 3.72Å; P291-L305 WeakPolarHBondContact O-CD2 3.33Å
292	C	90.2	Very high	87	Confident	12 Å²	12	81.5 Å²	81.5	8%	0.081	42%	0.416	C	S	.	.			trans	-79.8	136.9	160.7	-178.3	0	0	0	0	109	Q294 C295 R297 L305 H308 H313	C292-Q294 VanDerWaalsContact C-N 3.28Å; C292-Q294 PolarHBondContact SG-N 2.96Å; C292-Q294 VanDerWaalsContact SG-N 3.4Å; C292-C295 WeakPolarHBondContact CB-O 3.48Å; C292-R297 PolarHBondContact N-O 3.24Å; C292-L305 HydrophobicContact CB-CD1 3.83Å; C292-H308 PolarHBondContact SG-NE2 3.42Å; C292-H308 VanDerWaalsContact SG-NE2 3.41Å; C292-H313 PolarHBondContact SG-NE2 2.93Å
293	N	89.5	Confident	87	Confident	140 Å²	140	84.2 Å²	84.2	75%	0.749	43%	0.427	S	S	*	.	S	Bend	trans	-85.9	1.4	177.2	63.6	-30.8	0	0	0	113.5
294	Q	89.5	Confident	87	Confident	116 Å²	116	87.1 Å²	87.1	54%	0.542	44%	0.437	S	S	.	.	S	Bend	trans	-123.6	-0.5	-178	-61.9	-176.6	33.2	0	0	112.8	C292 H313	C292-Q294 VanDerWaalsContact C-N 3.28Å; C292-Q294 PolarHBondContact SG-N 2.96Å; C292-Q294 VanDerWaalsContact SG-N 3.4Å; Q294-H313 WeakPolarHBondContact CB-CE1 3.4Å; Q294-H313 VanDerWaalsContact CB-ND1 3.34Å; Q294-H313 WeakPolarHBondContact CB-ND1 3.37Å; Q294-H313 PolarHBondContact O-CE1 3.29Å; Q294-H313 PolarHBondContact OE1-ND1 3.32Å
295	C	92.1	Very high	87	Confident	37 Å²	37	83.3 Å²	83.3	25%	0.25	41%	0.414	C	S	.	.	S	Bend	trans	-164	166.3	170.8	67.3	0	0	0	0	110.2	C292 R297 H308	C292-C295 WeakPolarHBondContact CB-O 3.48Å; C295-R297 PolarHBondContact O-N 2.79Å; C295-H308 VanDerWaalsContact SG-CE1 3.55Å; C295-H308 PolarHBondContact SG-NE2 3.48Å
296	D	91.1	Very high	87.1	Confident	167 Å²	167	83.4 Å²	83.4	89%	0.893	42%	0.416	S	S	*	.	S	Bend	trans	-76.6	15.6	-174.1	-50.6	-48.5	0	0	0	114.8
297	R	91.2	Very high	87.4	Confident	154 Å²	154	80.5 Å²	80.5	58%	0.581	40%	0.403	S	S	*	.			trans	-81.8	130.7	-176.2	-66.5	-175.5	-177.4	-121.9	0.6	111.7	C292 C295 Y299	C292-R297 PolarHBondContact N-O 3.24Å; C295-R297 PolarHBondContact O-N 2.79Å; R297-Y299 HydrophobicContact CB-CE2 3.69Å; R297-Y299 WeakPolarHBondContact CD-OH 3.35Å
298	L	89.5	Confident	87.6	Confident	101 Å²	101	78.8 Å²	78.8	53%	0.529	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	135.4	176.6	-59.8	178.7	0	0	0	111	K289 P291	K289-L298 HydrophobicContact CB-CB 3.96Å; K289-L298 HydrophobicContact CD-CB 3.72Å; K289-L298 HydrophobicContact CD-CD1 3.92Å; K289-L298 HydrophobicContact CD-CG 4.46Å; K289-L298 HydrophobicContact CG-CB 4.43Å; P291-L298 HydrophobicContact CB-CD2 3.72Å
299	Y	86.2	Confident	87.9	Confident	40 Å²	40	76.4 Å²	76.4	16%	0.157	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	144.9	-177.7	-67.2	-85.2	0	0	0	112.4	K289 Y290 R297 S301 H304 L305 H308	K289-Y299 CarbonylContact C-O 3.58Å; K289-Y299 WeakPolarHBondContact CA-O 3.31Å; Y290-Y299 WeakPolarHBondContact CD2-O 3.44Å; Y290-Y299 PolarHBondContact N-O 2.84Å; Y290-Y299 PolarHBondContact O-N 3.45Å; R297-Y299 HydrophobicContact CB-CE2 3.69Å; R297-Y299 WeakPolarHBondContact CD-OH 3.35Å; Y299-S301 PolarHBondContact O-N 3.28Å; Y299-H304 HydrophobicContact CD1-CB 3.81Å; Y299-H304 HydrophobicContact CG-CB 4.48Å; Y299-L305 HydrophobicContact CD2-CB 3.87Å; Y299-L305 HydrophobicContact CD2-CD1 3.62Å; Y299-L305 HydrophobicContact CD2-CG 4.31Å; Y299-L305 HydrophobicContact CE2-CD1 3.94Å; Y299-L305 HydrophobicContact CG-CB 3.98Å; Y299-H308 HydrophobicContact CE1-CB 3.91Å; Y299-H308 HydrophobicContact CE2-CB 3.77Å; Y299-H308 AromaticContact CE2-CD2 3.74Å; Y299-H308 AromaticContact CE2-CG 3.61Å; Y299-H308 AromaticContact CZ-CG 3.39Å; Y299-H308 AromaticContact CZ-ND1 3.73Å; Y299-H308 VanDerWaalsContact OH-CB 3.22Å; Y299-H308 WeakPolarHBondContact OH-CB 3.38Å; Y299-H308 PolarHBondContact OH-ND1 3.33Å
300	T	85.1	Confident	88.1	Confident	74 Å²	74	76.7 Å²	76.7	45%	0.454	37%	0.369	S	S	.	.	S	Bend	trans	-77.5	-6	178.5	54.3	0	0	0	0	114
301	S	80.9	Confident	88.2	Confident	10 Å²	10	73.8 Å²	73.8	7%	0.07	36%	0.36	C	S	.	.	S	Bend	trans	-155	149.8	176.8	75.8	0	0	0	0	111.1	Y290 Y299 F303 H304 L305	Y290-S301 VanDerWaalsContact CD2-C 3.42Å; Y299-S301 PolarHBondContact O-N 3.28Å; S301-F303 PolarHBondContact O-N 3.05Å; S301-H304 PolarHBondContact O-N 3.06Å; S301-H304 PolarHBondContact OG-N 3.07Å; S301-H304 PolarHBondContact OG-ND1 3.08Å; S301-L305 PolarHBondContact O-N 2.91Å
302	R	84	Confident	88.2	Confident	133 Å²	133	73.8 Å²	73.8	50%	0.502	36%	0.356	S	S	.	.	H	α-helix	trans	-57.2	-31	173.4	-169.6	61.5	173.6	165.7	3.9	113.6	Y290 N306	Y290-R302 HydrophobicContact CD1-CB 4.4Å; Y290-R302 HydrophobicContact CE1-CB 4.36Å; R302-N306 WeakPolarHBondContact O-CB 3.42Å; R302-N306 PolarHBondContact O-N 3.34Å; R302-N306 PolarHBondContact O-ND2 3.13Å; R302-N306 PolarHBondContact O-OD1 3.15Å
303	F	83.3	Confident	88.1	Confident	119 Å²	119	75.9 Å²	75.9	52%	0.522	36%	0.364	S	S	.	.	H	α-helix	trans	-61	-55.1	176.9	176.3	-96.3	0	0	0	111.7	S301 L305 N306 E307	S301-F303 PolarHBondContact O-N 3.05Å; F303-L305 VanDerWaalsContact C-N 3.32Å; F303-L305 PolarHBondContact O-N 3.31Å; F303-N306 PolarHBondContact O-N 3.36Å; F303-N306 VanDerWaalsContact O-N 3.11Å; F303-E307 HydrophobicContact CD1-CG 4.48Å; F303-E307 HydrophobicContact CE1-CG 4Å; F303-E307 WeakPolarHBondContact CE1-OE2 3.24Å; F303-E307 HydrophobicContact CE2-CG 4.45Å; F303-E307 VanDerWaalsContact CZ-CD 3.44Å; F303-E307 HydrophobicContact CZ-CG 3.96Å; F303-E307 WeakPolarHBondContact CZ-OE1 3.34Å; F303-E307 PolarHBondContact O-N 3.21Å
304	H	87.8	Confident	88.1	Confident	84 Å²	84	75 Å²	75	39%	0.389	36%	0.355	S	S	.	.	H	α-helix	trans	-63	-36.8	178.9	-63.8	111.9	0	0	0	112.6	Y299 S301 E307 H308	Y299-H304 HydrophobicContact CD1-CB 3.81Å; Y299-H304 HydrophobicContact CG-CB 4.48Å; S301-H304 PolarHBondContact O-N 3.06Å; S301-H304 PolarHBondContact OG-N 3.07Å; S301-H304 PolarHBondContact OG-ND1 3.08Å; H304-E307 PolarHBondContact O-N 3.36Å; H304-H308 PolarHBondContact O-N 3.37Å
305	L	87.5	Confident	88	Confident	2 Å²	2	71.7 Å²	71.7	1%	0.01	35%	0.353	C	S	.	.	H	α-helix	trans	-60.3	-45.4	171.9	173.2	58.6	0	0	0	111.4	P291 C292 Y299 S301 F303 E307 H308 L309	P291-L305 WeakPolarHBondContact O-CD2 3.33Å; C292-L305 HydrophobicContact CB-CD1 3.83Å; Y299-L305 HydrophobicContact CD2-CB 3.87Å; Y299-L305 HydrophobicContact CD2-CD1 3.62Å; Y299-L305 HydrophobicContact CD2-CG 4.31Å; Y299-L305 HydrophobicContact CE2-CD1 3.94Å; Y299-L305 HydrophobicContact CG-CB 3.98Å; S301-L305 PolarHBondContact O-N 2.91Å; F303-L305 VanDerWaalsContact C-N 3.32Å; F303-L305 PolarHBondContact O-N 3.31Å; L305-E307 VanDerWaalsContact C-N 3.29Å; L305-E307 PolarHBondContact O-N 2.84Å; L305-H308 WeakPolarHBondContact O-CB 3.37Å; L305-H308 PolarHBondContact O-N 3.12Å; L305-L309 HydrophobicContact CD1-CD1 4.28Å; L305-L309 HydrophobicContact CD1-CD2 4.49Å; L305-L309 HydrophobicContact CD1-CG 4.08Å; L305-L309 HydrophobicContact CG-CD1 4.19Å; L305-L309 HydrophobicContact CG-CG 4.43Å; L305-L309 WeakPolarHBondContact O-CG 3.17Å; L305-L309 PolarHBondContact O-N 3.17Å
306	N	88.7	Confident	87.8	Confident	53 Å²	53	72.8 Å²	72.8	28%	0.283	36%	0.358	S	S	.	.	H	α-helix	trans	-68.2	-27.4	178.4	-69.7	-10.6	0	0	0	113.2	R302 F303 R310	R302-N306 WeakPolarHBondContact O-CB 3.42Å; R302-N306 PolarHBondContact O-N 3.34Å; R302-N306 PolarHBondContact O-ND2 3.13Å; R302-N306 PolarHBondContact O-OD1 3.15Å; F303-N306 PolarHBondContact O-N 3.36Å; F303-N306 VanDerWaalsContact O-N 3.11Å; N306-R310 WeakPolarHBondContact O-CB 3.43Å; N306-R310 PolarHBondContact O-N 3.44Å; N306-R310 PolarHBondContact O-NE 3.29Å
307	E	89.1	Confident	87.7	Confident	64 Å²	64	70.2 Å²	70.2	30%	0.299	34%	0.339	S	S	.	.	H	α-helix	trans	-71.6	-40	170.6	-71.8	-161.9	125.5	0	0	111.4	F303 H304 L305 R310 A311 F329	F303-E307 HydrophobicContact CD1-CG 4.48Å; F303-E307 HydrophobicContact CE1-CG 4Å; F303-E307 WeakPolarHBondContact CE1-OE2 3.24Å; F303-E307 HydrophobicContact CE2-CG 4.45Å; F303-E307 VanDerWaalsContact CZ-CD 3.44Å; F303-E307 HydrophobicContact CZ-CG 3.96Å; F303-E307 WeakPolarHBondContact CZ-OE1 3.34Å; F303-E307 PolarHBondContact O-N 3.21Å; H304-E307 PolarHBondContact O-N 3.36Å; L305-E307 VanDerWaalsContact C-N 3.29Å; L305-E307 PolarHBondContact O-N 2.84Å; E307-R310 PolarHBondContact O-N 3.43Å; E307-A311 WeakPolarHBondContact O-CB 3.47Å; E307-A311 PolarHBondContact O-N 2.96Å; E307-F329 HydrophobicContact CB-CE1 4.2Å
308	H	89.3	Confident	87.7	Confident	8 Å²	8	66.5 Å²	66.5	4%	0.037	33%	0.327	C	S	.	.	H	α-helix	trans	-61.2	-48.6	172.8	163.8	80.2	0	0	0	112.6	C292 C295 Y299 H304 L305 R310 A311 N312 H313	C292-H308 PolarHBondContact SG-NE2 3.42Å; C292-H308 VanDerWaalsContact SG-NE2 3.41Å; C295-H308 VanDerWaalsContact SG-CE1 3.55Å; C295-H308 PolarHBondContact SG-NE2 3.48Å; Y299-H308 HydrophobicContact CE1-CB 3.91Å; Y299-H308 HydrophobicContact CE2-CB 3.77Å; Y299-H308 AromaticContact CE2-CD2 3.74Å; Y299-H308 AromaticContact CE2-CG 3.61Å; Y299-H308 AromaticContact CZ-CG 3.39Å; Y299-H308 AromaticContact CZ-ND1 3.73Å; Y299-H308 VanDerWaalsContact OH-CB 3.22Å; Y299-H308 WeakPolarHBondContact OH-CB 3.38Å; Y299-H308 PolarHBondContact OH-ND1 3.33Å; H304-H308 PolarHBondContact O-N 3.37Å; L305-H308 WeakPolarHBondContact O-CB 3.37Å; L305-H308 PolarHBondContact O-N 3.12Å; H308-R310 VanDerWaalsContact C-N 3.3Å; H308-R310 PolarHBondContact O-N 3.07Å; H308-A311 PolarHBondContact O-N 3.06Å; H308-N312 PolarHBondContact CE1-ND2 3.27Å; H308-N312 PolarHBondContact ND1-ND2 2.99Å; H308-N312 WeakPolarHBondContact O-CB 3.5Å; H308-N312 PolarHBondContact O-N 2.9Å; H308-H313 AromaticContact CD2-CD2 3.79Å; H308-H313 AromaticContact CD2-NE2 3.92Å; H308-H313 AromaticContact CE1-CD2 3.93Å; H308-H313 AromaticContact CE1-NE2 3.55Å; H308-H313 AromaticContact NE2-CD2 3.2Å; H308-H313 PolarHBondContact NE2-CD2 3.41Å; H308-H313 AromaticContact NE2-NE2 2.91Å; H308-H313 PolarHBondContact NE2-NE2 2.91Å
309	L	89.4	Confident	87.9	Confident	22 Å²	22	64.8 Å²	64.8	12%	0.115	32%	0.321	C	S	.	.	I	π-helix	trans	-56.5	-47.7	178.3	-71.2	173.1	0	0	0	110.7	L305 A311 H313 E314	L305-L309 HydrophobicContact CD1-CD1 4.28Å; L305-L309 HydrophobicContact CD1-CD2 4.49Å; L305-L309 HydrophobicContact CD1-CG 4.08Å; L305-L309 HydrophobicContact CG-CD1 4.19Å; L305-L309 HydrophobicContact CG-CG 4.43Å; L305-L309 WeakPolarHBondContact O-CG 3.17Å; L305-L309 PolarHBondContact O-N 3.17Å; L309-A311 PolarHBondContact O-N 2.94Å; L309-H313 CarbonylContact O-C 3.59Å; L309-H313 WeakPolarHBondContact O-CA 3.43Å; L309-H313 WeakPolarHBondContact O-CB 3.09Å; L309-H313 PolarHBondContact O-N 2.93Å; L309-E314 PolarHBondContact O-N 2.87Å
310	R	91.2	Very high	88.2	Confident	114 Å²	114	63 Å²	63	43%	0.43	31%	0.314	S	S	.	.	I	π-helix	trans	-58.6	-50.5	176.5	-86	-180	-80	-179.9	-1.2	112.9	N306 E307 H308 E314 G315 V316	N306-R310 WeakPolarHBondContact O-CB 3.43Å; N306-R310 PolarHBondContact O-N 3.44Å; N306-R310 PolarHBondContact O-NE 3.29Å; E307-R310 PolarHBondContact O-N 3.43Å; H308-R310 VanDerWaalsContact C-N 3.3Å; H308-R310 PolarHBondContact O-N 3.07Å; R310-E314 WeakPolarHBondContact CG-OE2 3.33Å; R310-G315 PolarHBondContact O-N 2.77Å; R310-V316 HydrophobicContact CB-CB 4.21Å; R310-V316 HydrophobicContact CB-CG2 4.49Å; R310-V316 HydrophobicContact CG-CG2 4.38Å; R310-V316 WeakPolarHBondContact O-CB 3.16Å; R310-V316 PolarHBondContact O-N 3.28Å
311	A	88.8	Confident	88.5	Confident	13 Å²	13	66.3 Å²	66.3	11%	0.107	33%	0.329	C	S	.	.	I	π-helix	trans	-72.7	-37.8	-173.9	0	0	0	0	0	113.7	E307 H308 L309 A328 F329	E307-A311 WeakPolarHBondContact O-CB 3.47Å; E307-A311 PolarHBondContact O-N 2.96Å; H308-A311 PolarHBondContact O-N 3.06Å; L309-A311 PolarHBondContact O-N 2.94Å; A311-A328 HydrophobicContact CB-CB 4.17Å; A311-F329 HydrophobicContact CB-CE1 4.22Å; A311-F329 HydrophobicContact CB-CZ 4.34Å
312	N	88	Confident	88.9	Confident	87 Å²	87	72 Å²	72	47%	0.465	36%	0.358	S	S	.	.	I	π-helix	trans	-108.6	-27	-167.8	-65.7	-47.7	0	0	0	114.3	H308	H308-N312 PolarHBondContact CE1-ND2 3.27Å; H308-N312 PolarHBondContact ND1-ND2 2.99Å; H308-N312 WeakPolarHBondContact O-CB 3.5Å; H308-N312 PolarHBondContact O-N 2.9Å
313	H	89	Confident	89.3	Confident	56 Å²	56	68 Å²	68	26%	0.259	35%	0.35	S	S	.	.	I	π-helix	trans	-111.8	-36.8	-174.9	-67.1	-66.1	0	0	0	112.7	C292 Q294 H308 L309	C292-H313 PolarHBondContact SG-NE2 2.93Å; Q294-H313 WeakPolarHBondContact CB-CE1 3.4Å; Q294-H313 VanDerWaalsContact CB-ND1 3.34Å; Q294-H313 WeakPolarHBondContact CB-ND1 3.37Å; Q294-H313 PolarHBondContact O-CE1 3.29Å; Q294-H313 PolarHBondContact OE1-ND1 3.32Å; H308-H313 AromaticContact CD2-CD2 3.79Å; H308-H313 AromaticContact CD2-NE2 3.92Å; H308-H313 AromaticContact CE1-CD2 3.93Å; H308-H313 AromaticContact CE1-NE2 3.55Å; H308-H313 AromaticContact NE2-CD2 3.2Å; H308-H313 PolarHBondContact NE2-CD2 3.41Å; H308-H313 AromaticContact NE2-NE2 2.91Å; H308-H313 PolarHBondContact NE2-NE2 2.91Å; L309-H313 CarbonylContact O-C 3.59Å; L309-H313 WeakPolarHBondContact O-CA 3.43Å; L309-H313 WeakPolarHBondContact O-CB 3.09Å; L309-H313 PolarHBondContact O-N 2.93Å
314	E	89.4	Confident	89.7	Confident	120 Å²	120	68.2 Å²	68.2	56%	0.561	36%	0.357	S	S	*	.	S	Bend	trans	-90.7	-5.7	176	-58.4	169.7	-163.9	0	0	112.3	L309 R310 V316	L309-E314 PolarHBondContact O-N 2.87Å; R310-E314 WeakPolarHBondContact CG-OE2 3.33Å; E314-V316 HydrophobicContact CB-CG2 3.83Å; E314-V316 PolarHBondContact O-N 3.22Å; E314-V316 VanDerWaalsContact O-N 3.12Å
315	G	85.7	Confident	89.8	Confident	48 Å²	48	69.8 Å²	69.8	50%	0.495	36%	0.362	S	S	.	.			trans	62.7	17.3	-179.8	0	0	0	0	0	114.3	R310 K317	R310-G315 PolarHBondContact O-N 2.77Å; G315-K317 PolarHBondContact O-N 2.93Å; G315-K317 VanDerWaalsContact O-N 3.13Å
316	V	88.1	Confident	90	Very high	60 Å²	60	75 Å²	75	36%	0.364	39%	0.386	S	S	.	.			trans	-70.1	112	-178.2	179.8	0	0	0	0	108.9	R310 E314	R310-V316 HydrophobicContact CB-CB 4.21Å; R310-V316 HydrophobicContact CB-CG2 4.49Å; R310-V316 HydrophobicContact CG-CG2 4.38Å; R310-V316 WeakPolarHBondContact O-CB 3.16Å; R310-V316 PolarHBondContact O-N 3.28Å; E314-V316 HydrophobicContact CB-CG2 3.83Å; E314-V316 PolarHBondContact O-N 3.22Å; E314-V316 VanDerWaalsContact O-N 3.12Å
317	K	90.8	Very high	90.1	Very high	113 Å²	113	74.7 Å²	74.7	49%	0.491	38%	0.383	S	S	.	.			trans	-117.8	160.4	175.5	-62.5	177.4	-169.9	176.7	0	110.8	G315 E326 F327	G315-K317 PolarHBondContact O-N 2.93Å; G315-K317 VanDerWaalsContact O-N 3.13Å; K317-E326 HydrophobicContact CB-CB 4.17Å; K317-E326 HydrophobicContact CD-CB 3.78Å; K317-E326 HydrophobicContact CD-CG 4.37Å; K317-E326 WeakPolarHBondContact CD-OE2 3.36Å; K317-E326 WeakPolarHBondContact CE-OE2 3.44Å; K317-E326 IonicContact NZ-OE2 3.62Å; K317-E326 PolarHBondContact NZ-OE2 2.77Å; K317-F327 CarbonylContact C-O 3.59Å; K317-F327 WeakPolarHBondContact CA-O 3.35Å
318	F	91.1	Very high	90.1	Very high	75 Å²	75	73.8 Å²	73.8	33%	0.329	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	113.6	174.8	-61.4	-87.7	0	0	0	108.4	E326 F327 F329 K330 L333	F318-E326 CarbonylContact O-C 3.57Å; F318-E326 WeakPolarHBondContact O-CA 3.45Å; F318-F327 PolarHBondContact N-O 3.36Å; F318-F327 PolarHBondContact O-N 3.34Å; F318-F329 VanDerWaalsContact CD2-C 3.45Å; F318-K330 HydrophobicContact CD1-CB 4.06Å; F318-K330 HydrophobicContact CD1-CG 4.47Å; F318-K330 HydrophobicContact CD2-CB 4.38Å; F318-K330 VanDerWaalsContact CD2-N 3.29Å; F318-K330 HydrophobicContact CE1-CB 3.9Å; F318-K330 HydrophobicContact CE1-CG 4.49Å; F318-K330 HydrophobicContact CE2-CB 4.24Å; F318-K330 HydrophobicContact CG-CB 4.29Å; F318-K330 HydrophobicContact CZ-CB 3.99Å; F318-L333 HydrophobicContact CB-CB 4.12Å; F318-L333 HydrophobicContact CB-CD2 3.78Å
319	T	91.9	Very high	90.1	Very high	66 Å²	66	78.1 Å²	78.1	41%	0.405	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	139.8	178.8	46.5	0	0	0	0	110.7	K325 E326 L333	T319-K325 CarbonylContact C-O 3.47Å; T319-K325 WeakPolarHBondContact CA-O 3.5Å; T319-E326 HydrophobicContact CG2-CG 3.97Å; T319-L333 WeakPolarHBondContact O-CD2 3.36Å
320	C	92.5	Very high	90	Very high	1 Å²	1	82.9 Å²	82.9	1%	0.007	43%	0.425	C	S	.	.			trans	-81.1	118.6	166.1	177.5	0	0	0	0	110	L322 C323 N324 K325 L333 N337 H341	C320-L322 PolarHBondContact O-N 3.26Å; C320-L322 VanDerWaalsContact O-N 3.11Å; C320-L322 PolarHBondContact SG-N 3.31Å; C320-C323 PolarHBondContact O-N 2.93Å; C320-C323 VanDerWaalsContact SG-SG 3.69Å; C320-N324 WeakPolarHBondContact O-CA 3.45Å; C320-N324 PolarHBondContact O-N 2.79Å; C320-K325 PolarHBondContact N-O 3.39Å; C320-L333 HydrophobicContact CB-CD1 3.57Å; C320-N337 PolarHBondContact SG-OD1 3.31Å; C320-H341 VanDerWaalsContact SG-CD2 3.53Å; C320-H341 PolarHBondContact SG-NE2 2.92Å
321	D	91.8	Very high	89.8	Confident	145 Å²	145	82.7 Å²	82.7	78%	0.775	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-16.9	-179.2	-53.3	-35.8	0	0	0	113.7
322	L	90	Very high	89.9	Confident	128 Å²	128	83.4 Å²	83.4	67%	0.67	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-25.1	-177.4	-63.5	175.6	0	0	0	113.9	C320 H341	C320-L322 PolarHBondContact O-N 3.26Å; C320-L322 VanDerWaalsContact O-N 3.11Å; C320-L322 PolarHBondContact SG-N 3.31Å; L322-H341 VanDerWaalsContact CB-CE1 3.42Å; L322-H341 WeakPolarHBondContact CB-CE1 3.39Å; L322-H341 HydrophobicContact CD1-CB 3.62Å; L322-H341 VanDerWaalsContact CD1-CG 3.45Å
323	C	92.2	Very high	90.1	Very high	49 Å²	49	80.1 Å²	80.1	33%	0.331	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.3	6.3	179.5	70.2	0	0	0	0	114.7	C320 K325 H336 H341	C320-C323 PolarHBondContact O-N 2.93Å; C320-C323 VanDerWaalsContact SG-SG 3.69Å; C323-K325 PolarHBondContact O-N 3.29Å; C323-H336 VanDerWaalsContact SG-CE1 3.53Å; C323-H336 PolarHBondContact SG-NE2 2.86Å; C323-H341 PolarHBondContact SG-NE2 3.49Å; C323-H341 VanDerWaalsContact SG-NE2 3.43Å
324	N	91	Very high	90.2	Very high	125 Å²	125	80.8 Å²	80.8	67%	0.668	43%	0.432	S	S	*	.			trans	56.7	12.9	-178.7	-60	-37.2	0	0	0	115.4	C320 E326	C320-N324 WeakPolarHBondContact O-CA 3.45Å; C320-N324 PolarHBondContact O-N 2.79Å; N324-E326 PolarHBondContact O-N 2.87Å
325	K	90.7	Very high	90.2	Very high	117 Å²	117	78.8 Å²	78.8	51%	0.509	42%	0.423	S	S	.	.			trans	-66.6	134.7	173.9	-74.7	-169.7	-178.9	-163.5	0	111	T319 C320 C323 F327	T319-K325 CarbonylContact C-O 3.47Å; T319-K325 WeakPolarHBondContact CA-O 3.5Å; C320-K325 PolarHBondContact N-O 3.39Å; C323-K325 PolarHBondContact O-N 3.29Å; K325-F327 HydrophobicContact CB-CE2 3.84Å; K325-F327 HydrophobicContact CB-CZ 4.12Å; K325-F327 WeakPolarHBondContact O-CE2 3.33Å
326	E	91.9	Very high	90.4	Very high	110 Å²	110	77.3 Å²	77.3	51%	0.514	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	140.9	-177.8	-52.2	-171	139.1	0	0	112.3	K317 F318 T319 N324	K317-E326 HydrophobicContact CB-CB 4.17Å; K317-E326 HydrophobicContact CD-CB 3.78Å; K317-E326 HydrophobicContact CD-CG 4.37Å; K317-E326 WeakPolarHBondContact CD-OE2 3.36Å; K317-E326 WeakPolarHBondContact CE-OE2 3.44Å; K317-E326 IonicContact NZ-OE2 3.62Å; K317-E326 PolarHBondContact NZ-OE2 2.77Å; F318-E326 CarbonylContact O-C 3.57Å; F318-E326 WeakPolarHBondContact O-CA 3.45Å; T319-E326 HydrophobicContact CG2-CG 3.97Å; N324-E326 PolarHBondContact O-N 2.87Å
327	F	90.5	Very high	90.6	Very high	48 Å²	48	76.3 Å²	76.3	21%	0.211	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	139.6	179.3	-60.9	-90.7	0	0	0	110.7	K317 F318 K325 F329 L333 H336	K317-F327 CarbonylContact C-O 3.59Å; K317-F327 WeakPolarHBondContact CA-O 3.35Å; F318-F327 PolarHBondContact N-O 3.36Å; F318-F327 PolarHBondContact O-N 3.34Å; K325-F327 HydrophobicContact CB-CE2 3.84Å; K325-F327 HydrophobicContact CB-CZ 4.12Å; K325-F327 WeakPolarHBondContact O-CE2 3.33Å; F327-F329 PolarHBondContact O-N 3.34Å; F327-L333 HydrophobicContact CB-CB 4.25Å; F327-L333 HydrophobicContact CD2-CB 3.85Å; F327-L333 HydrophobicContact CD2-CD1 3.79Å; F327-L333 HydrophobicContact CD2-CG 4.43Å; F327-L333 HydrophobicContact CE2-CD1 3.92Å; F327-L333 HydrophobicContact CG-CB 4.15Å; F327-H336 HydrophobicContact CE1-CB 3.77Å; F327-H336 HydrophobicContact CE2-CB 3.84Å; F327-H336 AromaticContact CE2-CD2 3.7Å; F327-H336 AromaticContact CE2-CG 3.64Å; F327-H336 HydrophobicContact CZ-CB 3.29Å; F327-H336 AromaticContact CZ-CD2 3.78Å; F327-H336 AromaticContact CZ-CG 3.22Å; F327-H336 AromaticContact CZ-ND1 3.56Å
328	A	89.2	Confident	90.7	Very high	45 Å²	45	75.1 Å²	75.1	37%	0.372	39%	0.391	S	S	.	.	S	Bend	trans	-65.1	-28	175.5	0	0	0	0	0	113.2	A311	A311-A328 HydrophobicContact CB-CB 4.17Å
329	F	88.7	Confident	90.7	Very high	98 Å²	98	73 Å²	73	43%	0.43	38%	0.383	S	S	.	.	S	Bend	trans	-132.9	143.5	-176.6	-53.8	-71.9	0	0	0	111.6	E307 A311 F318 F327 V331 G332 L333	E307-F329 HydrophobicContact CB-CE1 4.2Å; A311-F329 HydrophobicContact CB-CE1 4.22Å; A311-F329 HydrophobicContact CB-CZ 4.34Å; F318-F329 VanDerWaalsContact CD2-C 3.45Å; F327-F329 PolarHBondContact O-N 3.34Å; F329-V331 PolarHBondContact O-N 3.43Å; F329-G332 PolarHBondContact O-N 3.11Å; F329-L333 PolarHBondContact O-N 3.19Å
330	K	88.6	Confident	90.6	Very high	122 Å²	122	75.3 Å²	75.3	53%	0.53	39%	0.391	S	S	.	.	H	α-helix	trans	-56.5	-36	178.5	-174.8	171.4	-179	172	0	113.4	F318 G332 L333 D334	F318-K330 HydrophobicContact CD1-CB 4.06Å; F318-K330 HydrophobicContact CD1-CG 4.47Å; F318-K330 HydrophobicContact CD2-CB 4.38Å; F318-K330 VanDerWaalsContact CD2-N 3.29Å; F318-K330 HydrophobicContact CE1-CB 3.9Å; F318-K330 HydrophobicContact CE1-CG 4.49Å; F318-K330 HydrophobicContact CE2-CB 4.24Å; F318-K330 HydrophobicContact CG-CB 4.29Å; F318-K330 HydrophobicContact CZ-CB 3.99Å; K330-G332 VanDerWaalsContact C-N 3.26Å; K330-G332 PolarHBondContact O-N 2.97Å; K330-L333 PolarHBondContact O-N 3.4Å; K330-D334 PolarHBondContact O-N 3.29Å
331	V	86.7	Confident	90.5	Very high	111 Å²	111	78.4 Å²	78.4	67%	0.673	41%	0.406	S	S	*	.	H	α-helix	trans	-60.9	-38	177.8	179.2	0	0	0	0	111.3	F329 D334 E335	F329-V331 PolarHBondContact O-N 3.43Å; V331-D334 PolarHBondContact O-N 3.49Å; V331-E335 WeakPolarHBondContact O-CB 3.44Å; V331-E335 PolarHBondContact O-N 2.98Å
332	G	89.8	Confident	90.5	Very high	27 Å²	27	78.9 Å²	78.9	28%	0.278	40%	0.401	S	S	.	.	H	α-helix	trans	-66.2	-42.5	176	0	0	0	0	0	112.1	F329 K330 E335 H336	F329-G332 PolarHBondContact O-N 3.11Å; K330-G332 VanDerWaalsContact C-N 3.26Å; K330-G332 PolarHBondContact O-N 2.97Å; G332-E335 PolarHBondContact O-N 3.4Å; G332-H336 VanDerWaalsContact O-CB 3.28Å; G332-H336 WeakPolarHBondContact O-CB 3.35Å; G332-H336 PolarHBondContact O-N 2.88Å
333	L	92.2	Very high	90.5	Very high	19 Å²	19	75 Å²	75	10%	0.099	39%	0.392	C	S	.	.	H	α-helix	trans	-62.4	-44.3	173.8	174.3	61.8	0	0	0	111.8	F318 T319 C320 F327 F329 K330 E335 H336 N337	F318-L333 HydrophobicContact CB-CB 4.12Å; F318-L333 HydrophobicContact CB-CD2 3.78Å; T319-L333 WeakPolarHBondContact O-CD2 3.36Å; C320-L333 HydrophobicContact CB-CD1 3.57Å; F327-L333 HydrophobicContact CB-CB 4.25Å; F327-L333 HydrophobicContact CD2-CB 3.85Å; F327-L333 HydrophobicContact CD2-CD1 3.79Å; F327-L333 HydrophobicContact CD2-CG 4.43Å; F327-L333 HydrophobicContact CE2-CD1 3.92Å; F327-L333 HydrophobicContact CG-CB 4.15Å; F329-L333 PolarHBondContact O-N 3.19Å; K330-L333 PolarHBondContact O-N 3.4Å; L333-E335 PolarHBondContact O-N 3.48Å; L333-H336 WeakPolarHBondContact O-CB 3.46Å; L333-H336 PolarHBondContact O-N 2.94Å; L333-N337 WeakPolarHBondContact O-CB 3.4Å; L333-N337 PolarHBondContact O-N 2.87Å; L333-N337 PolarHBondContact O-ND2 3.02Å
334	D	91.4	Very high	90.4	Very high	69 Å²	69	76.1 Å²	76.1	37%	0.369	39%	0.394	S	S	.	.	H	α-helix	trans	-63.7	-41.4	179.2	-73.2	-21.4	0	0	0	111.6	K330 V331 K338	K330-D334 PolarHBondContact O-N 3.29Å; V331-D334 PolarHBondContact O-N 3.49Å; D334-K338 WeakPolarHBondContact O-CB 3.46Å; D334-K338 VanDerWaalsContact O-CG 3.23Å; D334-K338 WeakPolarHBondContact O-CG 3.3Å; D334-K338 PolarHBondContact O-N 3.27Å
335	E	88.6	Confident	90.4	Very high	79 Å²	79	76.2 Å²	76.2	37%	0.369	39%	0.389	S	S	.	.	H	α-helix	trans	-66.2	-41.4	174.7	-178.2	167.9	-152.2	0	0	111.7	V331 G332 L333 K338 N339 S357	V331-E335 WeakPolarHBondContact O-CB 3.44Å; V331-E335 PolarHBondContact O-N 2.98Å; G332-E335 PolarHBondContact O-N 3.4Å; L333-E335 PolarHBondContact O-N 3.48Å; E335-K338 PolarHBondContact O-N 3.41Å; E335-N339 VanDerWaalsContact CG-ND2 3.33Å; E335-N339 WeakPolarHBondContact CG-ND2 3.38Å; E335-N339 WeakPolarHBondContact O-CB 3.28Å; E335-N339 PolarHBondContact O-N 3.08Å; E335-N339 PolarHBondContact O-ND2 3.02Å; E335-N339 VanDerWaalsContact O-ND2 3.11Å; E335-S357 WeakPolarHBondContact OE1-CB 3.48Å
336	H	90.7	Very high	90.5	Very high	17 Å²	17	73.8 Å²	73.8	8%	0.079	38%	0.376	C	S	.	.	H	α-helix	trans	-58.8	-50.7	173.2	165	78.7	0	0	0	111.8	C323 F327 G332 L333 K338 N339 I340 H341	C323-H336 VanDerWaalsContact SG-CE1 3.53Å; C323-H336 PolarHBondContact SG-NE2 2.86Å; F327-H336 HydrophobicContact CE1-CB 3.77Å; F327-H336 HydrophobicContact CE2-CB 3.84Å; F327-H336 AromaticContact CE2-CD2 3.7Å; F327-H336 AromaticContact CE2-CG 3.64Å; F327-H336 HydrophobicContact CZ-CB 3.29Å; F327-H336 AromaticContact CZ-CD2 3.78Å; F327-H336 AromaticContact CZ-CG 3.22Å; F327-H336 AromaticContact CZ-ND1 3.56Å; G332-H336 VanDerWaalsContact O-CB 3.28Å; G332-H336 WeakPolarHBondContact O-CB 3.35Å; G332-H336 PolarHBondContact O-N 2.88Å; L333-H336 WeakPolarHBondContact O-CB 3.46Å; L333-H336 PolarHBondContact O-N 2.94Å; H336-K338 VanDerWaalsContact C-N 3.3Å; H336-K338 PolarHBondContact O-N 3.38Å; H336-N339 PolarHBondContact O-N 3.29Å; H336-N339 VanDerWaalsContact O-N 3.15Å; H336-I340 WeakPolarHBondContact ND1-CG1 3.22Å; H336-I340 WeakPolarHBondContact O-CB 3.48Å; H336-I340 WeakPolarHBondContact O-CG1 3.36Å; H336-I340 PolarHBondContact O-N 3.4Å; H336-H341 AromaticContact CE1-NE2 3.92Å; H336-H341 AromaticContact NE2-CD2 3.56Å; H336-H341 AromaticContact NE2-NE2 3.22Å; H336-H341 PolarHBondContact NE2-NE2 2.86Å
337	N	92.9	Very high	90.7	Very high	39 Å²	39	71.8 Å²	71.8	21%	0.209	37%	0.373	C	S	.	.	I	π-helix	trans	-60.1	-40.7	179	-76.8	-23	0	0	0	111.9	C320 L333 H341 K342	C320-N337 PolarHBondContact SG-OD1 3.31Å; L333-N337 WeakPolarHBondContact O-CB 3.4Å; L333-N337 PolarHBondContact O-N 2.87Å; L333-N337 PolarHBondContact O-ND2 3.02Å; N337-H341 PolarHBondContact O-N 3.48Å; N337-H341 PolarHBondContact OD1-CD2 2.75Å; N337-K342 PolarHBondContact O-N 2.75Å
338	K	91.9	Very high	90.9	Very high	88 Å²	88	70 Å²	70	38%	0.383	37%	0.367	S	S	.	.	I	π-helix	trans	-61.8	-47.7	174.9	-74.9	172	-176.3	177.3	0	111.4	D334 E335 H336 K342 G343 I344	D334-K338 WeakPolarHBondContact O-CB 3.46Å; D334-K338 VanDerWaalsContact O-CG 3.23Å; D334-K338 WeakPolarHBondContact O-CG 3.3Å; D334-K338 PolarHBondContact O-N 3.27Å; E335-K338 PolarHBondContact O-N 3.41Å; H336-K338 VanDerWaalsContact C-N 3.3Å; H336-K338 PolarHBondContact O-N 3.38Å; K338-K342 CarbonylContact O-C 3.55Å; K338-G343 PolarHBondContact O-N 3.1Å; K338-G343 VanDerWaalsContact O-N 3.12Å; K338-I344 HydrophobicContact CB-CB 4.25Å; K338-I344 HydrophobicContact CB-CD1 4.32Å; K338-I344 HydrophobicContact CG-CD1 4.1Å; K338-I344 WeakPolarHBondContact O-CB 3.47Å; K338-I344 PolarHBondContact O-N 3.27Å
339	N	91.4	Very high	91.2	Very high	31 Å²	31	75.4 Å²	75.4	17%	0.166	39%	0.389	C	S	.	.	I	π-helix	trans	-78.3	-43.7	-172.2	-75.8	-37.5	0	0	0	114.3	E335 H336 I344 S356	E335-N339 VanDerWaalsContact CG-ND2 3.33Å; E335-N339 WeakPolarHBondContact CG-ND2 3.38Å; E335-N339 WeakPolarHBondContact O-CB 3.28Å; E335-N339 PolarHBondContact O-N 3.08Å; E335-N339 PolarHBondContact O-ND2 3.02Å; E335-N339 VanDerWaalsContact O-ND2 3.11Å; H336-N339 PolarHBondContact O-N 3.29Å; H336-N339 VanDerWaalsContact O-N 3.15Å; N339-I344 PolarHBondContact OD1-O 3.01Å; N339-I344 VanDerWaalsContact OD1-O 3.1Å; N339-S356 VanDerWaalsContact CG-O 3.24Å; N339-S356 PolarHBondContact ND2-O 2.83Å; N339-S356 WeakPolarHBondContact OD1-CA 3.46Å; N339-S356 PolarHBondContact OD1-O 3.01Å
340	I	89.1	Confident	91.4	Very high	113 Å²	113	76.6 Å²	76.6	58%	0.579	40%	0.396	S	S	*	.	I	π-helix	trans	-90.8	-49.6	-170.9	-55.7	-53.1	0	0	0	110.6	H336	H336-I340 WeakPolarHBondContact ND1-CG1 3.22Å; H336-I340 WeakPolarHBondContact O-CB 3.48Å; H336-I340 WeakPolarHBondContact O-CG1 3.36Å; H336-I340 PolarHBondContact O-N 3.4Å
341	H	91.2	Very high	91.7	Very high	67 Å²	67	72.7 Å²	72.7	31%	0.31	38%	0.384	S	S	.	.	I	π-helix	trans	-91.1	-39.7	-172.5	-64.3	-61.4	0	0	0	113.4	C320 L322 C323 H336 N337	C320-H341 VanDerWaalsContact SG-CD2 3.53Å; C320-H341 PolarHBondContact SG-NE2 2.92Å; L322-H341 VanDerWaalsContact CB-CE1 3.42Å; L322-H341 WeakPolarHBondContact CB-CE1 3.39Å; L322-H341 HydrophobicContact CD1-CB 3.62Å; L322-H341 VanDerWaalsContact CD1-CG 3.45Å; C323-H341 PolarHBondContact SG-NE2 3.49Å; C323-H341 VanDerWaalsContact SG-NE2 3.43Å; H336-H341 AromaticContact CE1-NE2 3.92Å; H336-H341 AromaticContact NE2-CD2 3.56Å; H336-H341 AromaticContact NE2-NE2 3.22Å; H336-H341 PolarHBondContact NE2-NE2 2.86Å; N337-H341 PolarHBondContact O-N 3.48Å; N337-H341 PolarHBondContact OD1-CD2 2.75Å
342	K	91.1	Very high	92.1	Very high	155 Å²	155	73.4 Å²	73.4	67%	0.674	39%	0.393	S	S	*	.	S	Bend	trans	-91.2	-8.8	177.5	-59	-174.9	178.4	-172	0	113.4	N337 K338 I344	N337-K342 PolarHBondContact O-N 2.75Å; K338-K342 CarbonylContact O-C 3.55Å; K342-I344 HydrophobicContact CB-CD1 3.69Å; K342-I344 HydrophobicContact CB-CG1 3.74Å; K342-I344 HydrophobicContact CD-CD1 3.84Å; K342-I344 HydrophobicContact CG-CD1 4.41Å; K342-I344 PolarHBondContact O-N 2.99Å
343	G	89.8	Confident	92.3	Very high	47 Å²	47	78 Å²	78	49%	0.485	41%	0.406	S	S	.	.			trans	58.8	18.6	-177.3	0	0	0	0	0	114.5	K338 K345	K338-G343 PolarHBondContact O-N 3.1Å; K338-G343 VanDerWaalsContact O-N 3.12Å; G343-K345 PolarHBondContact O-N 2.81Å; G343-K345 VanDerWaalsContact O-N 3.16Å
344	I	91.1	Very high	92.4	Very high	72 Å²	72	84 Å²	84	37%	0.369	43%	0.431	S	S	.	.			trans	-69.3	113.9	-177.3	-64.1	167.5	0	0	0	108.1	K338 N339 K342	K338-I344 HydrophobicContact CB-CB 4.25Å; K338-I344 HydrophobicContact CB-CD1 4.32Å; K338-I344 HydrophobicContact CG-CD1 4.1Å; K338-I344 WeakPolarHBondContact O-CB 3.47Å; K338-I344 PolarHBondContact O-N 3.27Å; N339-I344 PolarHBondContact OD1-O 3.01Å; N339-I344 VanDerWaalsContact OD1-O 3.1Å; K342-I344 HydrophobicContact CB-CD1 3.69Å; K342-I344 HydrophobicContact CB-CG1 3.74Å; K342-I344 HydrophobicContact CD-CD1 3.84Å; K342-I344 HydrophobicContact CG-CD1 4.41Å; K342-I344 PolarHBondContact O-N 2.99Å
345	K	91.8	Very high	92.4	Very high	127 Å²	127	82.6 Å²	82.6	55%	0.552	42%	0.422	S	S	*	.			trans	-114.4	151.3	170.4	-59.9	-174.8	-179.7	179	0	109.4	G343 P347 K354 F355	G343-K345 PolarHBondContact O-N 2.81Å; G343-K345 VanDerWaalsContact O-N 3.16Å; K345-P347 VanDerWaalsContact O-CD 3.26Å; K345-P347 WeakPolarHBondContact O-CD 3.43Å; K345-K354 HydrophobicContact CB-CB 3.8Å; K345-K354 HydrophobicContact CD-CB 4.03Å; K345-F355 CarbonylContact C-O 3.58Å; K345-F355 VanDerWaalsContact CA-O 3.3Å; K345-F355 WeakPolarHBondContact CA-O 3.39Å; K345-F355 WeakPolarHBondContact CB-O 3.13Å
346	Y	92.8	Very high	92.4	Very high	65 Å²	65	81.9 Å²	81.9	26%	0.255	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	105	176.9	-58.4	-90.3	0	0	0	108.4	F355 K358	Y346-F355 PolarHBondContact N-O 3.23Å; Y346-F355 PolarHBondContact O-N 2.93Å; Y346-K358 HydrophobicContact CD1-CB 4.32Å; Y346-K358 HydrophobicContact CE1-CB 4.31Å
347	P	94.4	Very high	92.3	Very high	69 Å²	69	81.6 Å²	81.6	45%	0.448	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	151.1	177.8	31.2	-34.9	0	0	0	110.8	K345 K354 L361	K345-P347 VanDerWaalsContact O-CD 3.26Å; K345-P347 WeakPolarHBondContact O-CD 3.43Å; P347-K354 HydrophobicContact CB-CG 4.28Å; P347-L361 WeakPolarHBondContact O-CD2 3.39Å
348	C	95.7	Very high	92.2	Very high	10 Å²	10	87.2 Å²	87.2	7%	0.068	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	133.1	163.6	-175.8	0	0	0	0	109.3	Q350 K353 L361 H369	C348-Q350 PolarHBondContact O-N 3.32Å; C348-Q350 PolarHBondContact SG-N 3.22Å; C348-K353 PolarHBondContact N-O 3.46Å; C348-L361 HydrophobicContact CB-CD1 3.73Å; C348-H369 VanDerWaalsContact SG-CD2 3.53Å; C348-H369 PolarHBondContact SG-NE2 3.2Å
349	D	94.5	Very high	92	Very high	159 Å²	159	86.7 Å²	86.7	85%	0.85	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-10	179.9	-53	-35.2	0	0	0	112.7
350	Q	94.6	Very high	92	Very high	123 Å²	123	89.8 Å²	89.8	58%	0.575	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	-3.6	-176.6	-59.5	-177.6	28.5	0	0	113.3	C348 H369	C348-Q350 PolarHBondContact O-N 3.32Å; C348-Q350 PolarHBondContact SG-N 3.22Å; Q350-H369 WeakPolarHBondContact CB-CE1 3.32Å; Q350-H369 WeakPolarHBondContact CB-ND1 3.31Å; Q350-H369 PolarHBondContact O-CE1 3.29Å; Q350-H369 PolarHBondContact OE1-ND1 2.91Å
351	C	94.6	Very high	92.3	Very high	40 Å²	40	85.9 Å²	85.9	27%	0.27	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	165.1	171.6	73.3	0	0	0	0	111.7	K353 H364	C351-K353 PolarHBondContact O-N 3.23Å; C351-H364 PolarHBondContact SG-NE2 2.97Å
352	S	94.1	Very high	92.4	Very high	125 Å²	125	86.7 Å²	86.7	87%	0.874	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	4.4	-177	-40.9	0	0	0	0	115.2
353	K	94.3	Very high	92.5	Very high	125 Å²	125	81.6 Å²	81.6	54%	0.543	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	140	-177.8	-66.1	-169.8	178.7	-174	0	111.6	C348 C351 F355	C348-K353 PolarHBondContact N-O 3.46Å; C351-K353 PolarHBondContact O-N 3.23Å; K353-F355 HydrophobicContact CB-CE2 3.75Å; K353-F355 HydrophobicContact CB-CZ 3.88Å; K353-F355 HydrophobicContact CD-CZ 4.3Å
354	K	93.5	Very high	92.7	Very high	143 Å²	143	80.1 Å²	80.1	62%	0.622	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.9	138.1	177	-56	-175.8	-179.7	179.1	0	110	K345 P347	K345-K354 HydrophobicContact CB-CB 3.8Å; K345-K354 HydrophobicContact CD-CB 4.03Å; P347-K354 HydrophobicContact CB-CG 4.28Å
355	F	92	Very high	92.9	Very high	41 Å²	41	78.1 Å²	78.1	18%	0.18	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	152.5	-174.1	-61.2	-90.3	0	0	0	111.6	K345 Y346 K353 S357 M360 L361 H364	K345-F355 CarbonylContact C-O 3.58Å; K345-F355 VanDerWaalsContact CA-O 3.3Å; K345-F355 WeakPolarHBondContact CA-O 3.39Å; K345-F355 WeakPolarHBondContact CB-O 3.13Å; Y346-F355 PolarHBondContact N-O 3.23Å; Y346-F355 PolarHBondContact O-N 2.93Å; K353-F355 HydrophobicContact CB-CE2 3.75Å; K353-F355 HydrophobicContact CB-CZ 3.88Å; K353-F355 HydrophobicContact CD-CZ 4.3Å; F355-S357 VanDerWaalsContact C-N 3.29Å; F355-S357 PolarHBondContact O-N 3.32Å; F355-M360 HydrophobicContact CB-CB 4.22Å; F355-M360 HydrophobicContact CD1-CB 4.04Å; F355-M360 HydrophobicContact CG-CB 4.45Å; F355-L361 HydrophobicContact CB-CB 4.2Å; F355-L361 HydrophobicContact CD2-CB 3.98Å; F355-L361 HydrophobicContact CD2-CD1 3.66Å; F355-L361 HydrophobicContact CD2-CG 4.43Å; F355-L361 HydrophobicContact CE2-CD1 3.94Å; F355-L361 HydrophobicContact CG-CB 4.23Å; F355-H364 HydrophobicContact CE1-CB 3.72Å; F355-H364 HydrophobicContact CE2-CB 3.85Å; F355-H364 AromaticContact CE2-CD2 3.29Å; F355-H364 WeakPolarHBondContact CE2-CD2 3.36Å; F355-H364 AromaticContact CE2-CG 3.55Å; F355-H364 AromaticContact CE2-NE2 3.93Å; F355-H364 HydrophobicContact CZ-CB 3.33Å; F355-H364 AromaticContact CZ-CD2 3.39Å; F355-H364 WeakPolarHBondContact CZ-CD2 3.43Å; F355-H364 AromaticContact CZ-CG 3.13Å; F355-H364 AromaticContact CZ-ND1 3.63Å; F355-H364 AromaticContact CZ-NE2 3.96Å
356	S	89.3	Confident	93	Very high	63 Å²	63	75.3 Å²	75.3	44%	0.441	40%	0.395	S	S	.	.	S	Bend	trans	-76	-14.9	176.4	52.4	0	0	0	0	113.6	N339	N339-S356 VanDerWaalsContact CG-O 3.24Å; N339-S356 PolarHBondContact ND2-O 2.83Å; N339-S356 WeakPolarHBondContact OD1-CA 3.46Å; N339-S356 PolarHBondContact OD1-O 3.01Å
357	S	87.9	Confident	93.1	Very high	12 Å²	12	72.5 Å²	72.5	8%	0.084	39%	0.385	C	S	.	.	S	Bend	trans	-145	151.7	179.4	82	0	0	0	0	112.2	E335 F355 C359 M360 L361	E335-S357 WeakPolarHBondContact OE1-CB 3.48Å; F355-S357 VanDerWaalsContact C-N 3.29Å; F355-S357 PolarHBondContact O-N 3.32Å; S357-C359 PolarHBondContact O-N 3.19Å; S357-M360 PolarHBondContact O-N 3.38Å; S357-M360 WeakPolarHBondContact OG-CG 3.31Å; S357-M360 PolarHBondContact OG-N 2.83Å; S357-L361 PolarHBondContact O-N 2.74Å
358	K	90.3	Very high	93	Very high	157 Å²	157	74.1 Å²	74.1	68%	0.683	39%	0.389	S	S	*	.	H	α-helix	trans	-62.9	-31.3	175.8	-169.3	170.7	-174.9	172.1	0	112	Y346 N362	Y346-K358 HydrophobicContact CD1-CB 4.32Å; Y346-K358 HydrophobicContact CE1-CB 4.31Å; K358-N362 WeakPolarHBondContact O-CB 3.38Å; K358-N362 PolarHBondContact O-N 3.24Å
359	C	88.9	Confident	92.9	Very high	77 Å²	77	76.1 Å²	76.1	52%	0.52	40%	0.397	S	S	.	.	H	α-helix	trans	-63.8	-47.1	175.2	-175.4	0	0	0	0	111.1	S357 N362 I363	S357-C359 PolarHBondContact O-N 3.19Å; C359-N362 PolarHBondContact O-N 2.86Å; C359-I363 WeakPolarHBondContact O-CG1 3.28Å; C359-I363 PolarHBondContact O-N 3.38Å
360	M	91.9	Very high	92.9	Very high	96 Å²	96	75.3 Å²	75.3	47%	0.473	39%	0.386	S	S	.	.	H	α-helix	trans	-66.3	-39.5	178.4	-68	-60.9	151.9	0	0	112.1	F355 S357 N362 I363 H364	F355-M360 HydrophobicContact CB-CB 4.22Å; F355-M360 HydrophobicContact CD1-CB 4.04Å; F355-M360 HydrophobicContact CG-CB 4.45Å; S357-M360 PolarHBondContact O-N 3.38Å; S357-M360 WeakPolarHBondContact OG-CG 3.31Å; S357-M360 PolarHBondContact OG-N 2.83Å; M360-N362 VanDerWaalsContact C-N 3.34Å; M360-N362 PolarHBondContact O-N 3.4Å; M360-I363 HydrophobicContact CE-CD1 4.44Å; M360-I363 PolarHBondContact O-N 3.41Å; M360-I363 HydrophobicContact SD-CD1 4.21Å; M360-H364 WeakPolarHBondContact O-CB 3.3Å; M360-H364 PolarHBondContact O-N 3Å
361	L	94.2	Very high	92.7	Very high	30 Å²	30	71.9 Å²	71.9	16%	0.157	38%	0.384	C	S	.	.	H	α-helix	trans	-58.4	-45.8	171.4	174	62.6	0	0	0	111.4	P347 C348 F355 S357 I363 H364 V365	P347-L361 WeakPolarHBondContact O-CD2 3.39Å; C348-L361 HydrophobicContact CB-CD1 3.73Å; F355-L361 HydrophobicContact CB-CB 4.2Å; F355-L361 HydrophobicContact CD2-CB 3.98Å; F355-L361 HydrophobicContact CD2-CD1 3.66Å; F355-L361 HydrophobicContact CD2-CG 4.43Å; F355-L361 HydrophobicContact CE2-CD1 3.94Å; F355-L361 HydrophobicContact CG-CB 4.23Å; S357-L361 PolarHBondContact O-N 2.74Å; L361-I363 PolarHBondContact O-N 3.11Å; L361-H364 WeakPolarHBondContact O-CB 3.27Å; L361-H364 PolarHBondContact O-N 3.41Å; L361-V365 HydrophobicContact CD1-CG2 3.94Å; L361-V365 HydrophobicContact CG-CG2 4.36Å; L361-V365 WeakPolarHBondContact O-CG2 3.39Å; L361-V365 PolarHBondContact O-N 3.48Å
362	N	94.3	Very high	92.6	Very high	84 Å²	84	73.6 Å²	73.6	45%	0.449	39%	0.389	S	S	.	.	H	α-helix	trans	-64.1	-41.6	179.5	-171.9	21.4	0	0	0	112.3	K358 C359 M360 H364 V365 K366	K358-N362 WeakPolarHBondContact O-CB 3.38Å; K358-N362 PolarHBondContact O-N 3.24Å; C359-N362 PolarHBondContact O-N 2.86Å; M360-N362 VanDerWaalsContact C-N 3.34Å; M360-N362 PolarHBondContact O-N 3.4Å; N362-H364 VanDerWaalsContact C-N 3.3Å; N362-H364 PolarHBondContact O-N 3.37Å; N362-V365 PolarHBondContact O-N 3.33Å; N362-K366 WeakPolarHBondContact O-CB 3.47Å; N362-K366 WeakPolarHBondContact O-CG 3.36Å; N362-K366 PolarHBondContact O-N 2.78Å; N362-K366 WeakPolarHBondContact OD1-CE 3.41Å
363	I	92.9	Very high	92.5	Very high	49 Å²	49	72.9 Å²	72.9	25%	0.251	37%	0.371	S	S	.	.	H	α-helix	trans	-59.7	-45.3	173.7	-69.6	168.1	0	0	0	110	C359 M360 L361 K366 A367 C385	C359-I363 WeakPolarHBondContact O-CG1 3.28Å; C359-I363 PolarHBondContact O-N 3.38Å; M360-I363 HydrophobicContact CE-CD1 4.44Å; M360-I363 PolarHBondContact O-N 3.41Å; M360-I363 HydrophobicContact SD-CD1 4.21Å; L361-I363 PolarHBondContact O-N 3.11Å; I363-K366 PolarHBondContact O-N 2.99Å; I363-A367 VanDerWaalsContact O-CB 3.28Å; I363-A367 WeakPolarHBondContact O-CB 3.44Å; I363-A367 PolarHBondContact O-N 3.19Å; I363-C385 HydrophobicContact CD1-CB 4.13Å; I363-C385 HydrophobicContact CG1-CB 4.39Å; I363-C385 HydrophobicContact CG2-CB 4.13Å
364	H	93.9	Very high	92.5	Very high	16 Å²	16	70.3 Å²	70.3	7%	0.074	36%	0.358	C	S	.	.	H	α-helix	trans	-60.9	-49.6	177	164.1	68	0	0	0	112.4	C351 F355 M360 L361 N362 K366 A367 I368 H369	C351-H364 PolarHBondContact SG-NE2 2.97Å; F355-H364 HydrophobicContact CE1-CB 3.72Å; F355-H364 HydrophobicContact CE2-CB 3.85Å; F355-H364 AromaticContact CE2-CD2 3.29Å; F355-H364 WeakPolarHBondContact CE2-CD2 3.36Å; F355-H364 AromaticContact CE2-CG 3.55Å; F355-H364 AromaticContact CE2-NE2 3.93Å; F355-H364 HydrophobicContact CZ-CB 3.33Å; F355-H364 AromaticContact CZ-CD2 3.39Å; F355-H364 WeakPolarHBondContact CZ-CD2 3.43Å; F355-H364 AromaticContact CZ-CG 3.13Å; F355-H364 AromaticContact CZ-ND1 3.63Å; F355-H364 AromaticContact CZ-NE2 3.96Å; M360-H364 WeakPolarHBondContact O-CB 3.3Å; M360-H364 PolarHBondContact O-N 3Å; L361-H364 WeakPolarHBondContact O-CB 3.27Å; L361-H364 PolarHBondContact O-N 3.41Å; N362-H364 VanDerWaalsContact C-N 3.3Å; N362-H364 PolarHBondContact O-N 3.37Å; H364-K366 VanDerWaalsContact C-N 3.33Å; H364-K366 PolarHBondContact O-N 2.93Å; H364-A367 PolarHBondContact O-N 3.19Å; H364-I368 WeakPolarHBondContact ND1-CG1 3.42Å; H364-I368 WeakPolarHBondContact O-CB 3.32Å; H364-I368 PolarHBondContact O-N 3.41Å; H364-H369 AromaticContact CE1-NE2 3.8Å; H364-H369 AromaticContact NE2-CD2 3.66Å; H364-H369 AromaticContact NE2-NE2 3.31Å; H364-H369 PolarHBondContact NE2-NE2 3.28Å
365	V	95.1	Very high	92.4	Very high	29 Å²	29	68.4 Å²	68.4	18%	0.176	35%	0.354	C	S	.	.	I	π-helix	trans	-60.4	-44.4	179.1	171	0	0	0	0	110.9	L361 N362 H369 K370	L361-V365 HydrophobicContact CD1-CG2 3.94Å; L361-V365 HydrophobicContact CG-CG2 4.36Å; L361-V365 WeakPolarHBondContact O-CG2 3.39Å; L361-V365 PolarHBondContact O-N 3.48Å; N362-V365 PolarHBondContact O-N 3.33Å; V365-H369 HydrophobicContact CG1-CB 4.37Å; V365-H369 WeakPolarHBondContact O-CA 3.5Å; V365-H369 WeakPolarHBondContact O-CB 3.39Å; V365-H369 PolarHBondContact O-N 3.41Å; V365-K370 PolarHBondContact O-N 3.02Å
366	K	94.7	Very high	92.6	Very high	68 Å²	68	66.7 Å²	66.7	30%	0.296	35%	0.347	S	S	.	.	I	π-helix	trans	-60.1	-49.6	175.8	-75.2	-177.7	178.9	-171.7	0	111.8	N362 I363 H364 K370 G371 I372	N362-K366 WeakPolarHBondContact O-CB 3.47Å; N362-K366 WeakPolarHBondContact O-CG 3.36Å; N362-K366 PolarHBondContact O-N 2.78Å; N362-K366 WeakPolarHBondContact OD1-CE 3.41Å; I363-K366 PolarHBondContact O-N 2.99Å; H364-K366 VanDerWaalsContact C-N 3.33Å; H364-K366 PolarHBondContact O-N 2.93Å; K366-K370 CarbonylContact O-C 3.58Å; K366-G371 PolarHBondContact O-N 3.29Å; K366-G371 VanDerWaalsContact O-N 3.15Å; K366-I372 HydrophobicContact CB-CB 4.23Å; K366-I372 HydrophobicContact CG-CD1 4.34Å; K366-I372 PolarHBondContact O-N 3.47Å
367	A	93.8	Very high	92.7	Very high	7 Å²	7	73.6 Å²	73.6	6%	0.058	37%	0.369	C	S	.	.	I	π-helix	trans	-74.3	-39.7	-172.6	0	0	0	0	0	114.2	I363 H364 N384	I363-A367 VanDerWaalsContact O-CB 3.28Å; I363-A367 WeakPolarHBondContact O-CB 3.44Å; I363-A367 PolarHBondContact O-N 3.19Å; H364-A367 PolarHBondContact O-N 3.19Å; A367-N384 HydrophobicContact CB-CB 3.68Å
368	I	92.8	Very high	92.9	Very high	102 Å²	102	79 Å²	79	52%	0.523	39%	0.393	S	S	.	.	I	π-helix	trans	-96.5	-46.3	-171.9	-56.9	-54.9	0	0	0	111.3	H364	H364-I368 WeakPolarHBondContact ND1-CG1 3.42Å; H364-I368 WeakPolarHBondContact O-CB 3.32Å; H364-I368 PolarHBondContact O-N 3.41Å
369	H	93.8	Very high	93.1	Very high	53 Å²	53	73.4 Å²	73.4	25%	0.245	37%	0.373	C	S	.	.	I	π-helix	trans	-92.8	-34.1	-171.2	-68.3	-61.5	0	0	0	113.2	C348 Q350 H364 V365	C348-H369 VanDerWaalsContact SG-CD2 3.53Å; C348-H369 PolarHBondContact SG-NE2 3.2Å; Q350-H369 WeakPolarHBondContact CB-CE1 3.32Å; Q350-H369 WeakPolarHBondContact CB-ND1 3.31Å; Q350-H369 PolarHBondContact O-CE1 3.29Å; Q350-H369 PolarHBondContact OE1-ND1 2.91Å; H364-H369 AromaticContact CE1-NE2 3.8Å; H364-H369 AromaticContact NE2-CD2 3.66Å; H364-H369 AromaticContact NE2-NE2 3.31Å; H364-H369 PolarHBondContact NE2-NE2 3.28Å; V365-H369 HydrophobicContact CG1-CB 4.37Å; V365-H369 WeakPolarHBondContact O-CA 3.5Å; V365-H369 WeakPolarHBondContact O-CB 3.39Å; V365-H369 PolarHBondContact O-N 3.41Å
370	K	93.3	Very high	93.3	Very high	141 Å²	141	77.3 Å²	77.3	61%	0.613	39%	0.388	S	S	*	.	S	Bend	trans	-98.1	-5.1	175.7	-57.7	-171.2	174.1	-167.7	0	113.5	V365 K366 I372	V365-K370 PolarHBondContact O-N 3.02Å; K366-K370 CarbonylContact O-C 3.58Å; K370-I372 HydrophobicContact CB-CD1 3.76Å; K370-I372 HydrophobicContact CB-CG1 3.8Å; K370-I372 HydrophobicContact CD-CD1 4Å; K370-I372 PolarHBondContact O-N 3.4Å
371	G	91.9	Very high	93.4	Very high	51 Å²	51	80.3 Å²	80.3	53%	0.526	39%	0.394	S	S	.	.			trans	61.9	12.2	-176.3	0	0	0	0	0	115.1	K366 K373	K366-G371 PolarHBondContact O-N 3.29Å; K366-G371 VanDerWaalsContact O-N 3.15Å; G371-K373 PolarHBondContact O-N 3.42Å
372	I	92.1	Very high	93.4	Very high	76 Å²	76	85.1 Å²	85.1	39%	0.39	41%	0.414	S	S	.	.			trans	-74.4	113.1	-176.7	-59.8	170	0	0	0	108.9	K366 K370	K366-I372 HydrophobicContact CB-CB 4.23Å; K366-I372 HydrophobicContact CG-CD1 4.34Å; K366-I372 PolarHBondContact O-N 3.47Å; K370-I372 HydrophobicContact CB-CD1 3.76Å; K370-I372 HydrophobicContact CB-CG1 3.8Å; K370-I372 HydrophobicContact CD-CD1 4Å; K370-I372 PolarHBondContact O-N 3.4Å
373	K	91.9	Very high	93.3	Very high	110 Å²	110	82.8 Å²	82.8	48%	0.478	40%	0.4	S	S	.	.			trans	-120.1	148.2	174.1	-62.3	-179.8	-178	175.4	0	110.1	G371 K382 F383	G371-K373 PolarHBondContact O-N 3.42Å; K373-K382 HydrophobicContact CB-CB 4.13Å; K373-K382 HydrophobicContact CD-CB 4Å; K373-K382 HydrophobicContact CD-CD 4.44Å; K373-F383 CarbonylContact C-O 3.41Å; K373-F383 WeakPolarHBondContact CA-O 3.46Å
374	Y	93.2	Very high	93.2	Very high	72 Å²	72	83.9 Å²	83.9	28%	0.282	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	117.2	172.7	-63.7	-87.7	0	0	0	108.6	K382 F383 C385 K386	Y374-K382 CarbonylContact O-C 3.59Å; Y374-K382 WeakPolarHBondContact O-CA 3.36Å; Y374-F383 PolarHBondContact N-O 3.46Å; Y374-F383 PolarHBondContact O-N 2.79Å; Y374-C385 VanDerWaalsContact CD2-CA 3.49Å; Y374-K386 HydrophobicContact CD1-CB 4.13Å; Y374-K386 HydrophobicContact CE1-CB 3.91Å; Y374-K386 HydrophobicContact CE1-CG 4.47Å
375	I	93.3	Very high	93.1	Very high	103 Å²	103	84 Å²	84	53%	0.528	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	134.7	-174	-55.1	172.8	0	0	0	108.8	K382	I375-K382 HydrophobicContact CG1-CG 4.25Å
376	C	94.6	Very high	92.9	Very high	5 Å²	5	89.9 Å²	89.9	3%	0.034	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-71.1	133.2	167.7	-179	0	0	0	0	109.7	Q378 C379 R381 L389 H392 M393 H397	C376-Q378 VanDerWaalsContact C-N 3.29Å; C376-Q378 PolarHBondContact SG-N 2.9Å; C376-Q378 VanDerWaalsContact SG-N 3.39Å; C376-C379 WeakPolarHBondContact CB-O 3.43Å; C376-C379 VanDerWaalsContact SG-SG 3.64Å; C376-R381 PolarHBondContact N-O 2.96Å; C376-L389 HydrophobicContact CB-CD1 3.87Å; C376-H392 PolarHBondContact SG-NE2 3.28Å; C376-H392 VanDerWaalsContact SG-NE2 3.39Å; C376-M393 HydrophobicContact CB-SD 4.45Å; C376-M393 PolarHBondContact SG-SD 2.71Å; C376-H397 PolarHBondContact SG-NE2 3.49Å
377	K	92.4	Very high	92.6	Very high	207 Å²	207	91.1 Å²	91.1	90%	0.9	45%	0.45	S	S	*	.	S	Bend	trans	-79.7	-12.6	179.2	-66	-173.3	177.2	-174.6	0	113.6
378	Q	92.4	Very high	92.5	Very high	127 Å²	127	95.4 Å²	95.4	59%	0.593	47%	0.471	S	S	*	.	S	Bend	trans	-113	-3.1	-175	-63.5	-176.1	16	0	0	113.1	C376 M393 H397	C376-Q378 VanDerWaalsContact C-N 3.29Å; C376-Q378 PolarHBondContact SG-N 2.9Å; C376-Q378 VanDerWaalsContact SG-N 3.39Å; Q378-M393 HydrophobicContact CG-CE 4.46Å; Q378-H397 WeakPolarHBondContact CB-CE1 3.46Å; Q378-H397 WeakPolarHBondContact CB-ND1 3.34Å; Q378-H397 VanDerWaalsContact OE1-CB 3.24Å; Q378-H397 PolarHBondContact OE1-ND1 3.25Å
379	C	94	Very high	92.5	Very high	39 Å²	39	91.9 Å²	91.9	26%	0.264	45%	0.453	S	S	.	.	S	Bend	trans	-159.1	169	170.3	71.1	0	0	0	0	110.9	C376 R381 H392 H397	C376-C379 WeakPolarHBondContact CB-O 3.43Å; C376-C379 VanDerWaalsContact SG-SG 3.64Å; C379-R381 PolarHBondContact O-N 3.4Å; C379-H392 VanDerWaalsContact SG-CE1 3.56Å; C379-H392 PolarHBondContact SG-NE2 2.94Å; C379-H397 PolarHBondContact SG-NE2 3.47Å
380	D	92.9	Very high	92.4	Very high	158 Å²	158	93.3 Å²	93.3	85%	0.845	46%	0.463	S	S	*	.	S	Bend	trans	-75.6	8.6	-175	-59.6	-49.7	0	0	0	115.2
381	R	93.8	Very high	92.2	Very high	159 Å²	159	88.3 Å²	88.3	60%	0.6	45%	0.452	S	S	*	.			trans	-73.3	135	-177.9	-68.7	-167.6	178.5	-140.9	1.6	111.9	C376 C379 F383	C376-R381 PolarHBondContact N-O 2.96Å; C379-R381 PolarHBondContact O-N 3.4Å; R381-F383 HydrophobicContact CB-CE2 3.68Å; R381-F383 HydrophobicContact CB-CZ 3.82Å
382	K	93.4	Very high	92.2	Very high	131 Å²	131	86.4 Å²	86.4	57%	0.57	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	137.6	179.2	-55	-177.2	-176.3	174.3	0	110.3	K373 Y374 I375	K373-K382 HydrophobicContact CB-CB 4.13Å; K373-K382 HydrophobicContact CD-CB 4Å; K373-K382 HydrophobicContact CD-CD 4.44Å; Y374-K382 CarbonylContact O-C 3.59Å; Y374-K382 WeakPolarHBondContact O-CA 3.36Å; I375-K382 HydrophobicContact CG1-CG 4.25Å
383	F	92.8	Very high	92.2	Very high	35 Å²	35	84.5 Å²	84.5	15%	0.154	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	150.2	-174.6	-59	-89.7	0	0	0	111.9	K373 Y374 R381 N388 L389 H392	K373-F383 CarbonylContact C-O 3.41Å; K373-F383 WeakPolarHBondContact CA-O 3.46Å; Y374-F383 PolarHBondContact N-O 3.46Å; Y374-F383 PolarHBondContact O-N 2.79Å; R381-F383 HydrophobicContact CB-CE2 3.68Å; R381-F383 HydrophobicContact CB-CZ 3.82Å; F383-N388 HydrophobicContact CB-CB 4.25Å; F383-N388 HydrophobicContact CD1-CB 3.86Å; F383-N388 HydrophobicContact CG-CB 4.38Å; F383-L389 HydrophobicContact CB-CB 4.2Å; F383-L389 HydrophobicContact CD2-CB 3.87Å; F383-L389 HydrophobicContact CD2-CD1 3.67Å; F383-L389 HydrophobicContact CD2-CG 4.38Å; F383-L389 HydrophobicContact CE2-CD1 3.82Å; F383-L389 HydrophobicContact CG-CB 4.14Å; F383-H392 HydrophobicContact CE1-CB 3.78Å; F383-H392 HydrophobicContact CE2-CB 3.91Å; F383-H392 AromaticContact CE2-CD2 3.39Å; F383-H392 WeakPolarHBondContact CE2-CD2 3.47Å; F383-H392 AromaticContact CE2-CG 3.69Å; F383-H392 HydrophobicContact CZ-CB 3.29Å; F383-H392 AromaticContact CZ-CD2 3.46Å; F383-H392 VanDerWaalsContact CZ-CD2 3.46Å; F383-H392 WeakPolarHBondContact CZ-CD2 3.42Å; F383-H392 AromaticContact CZ-CG 3.23Å; F383-H392 AromaticContact CZ-ND1 3.88Å
384	N	92	Very high	92.2	Very high	73 Å²	73	83.6 Å²	83.6	39%	0.39	42%	0.415	S	S	.	.	S	Bend	trans	-84	-13.3	-178.5	-64.9	-13.2	0	0	0	113.3	A367	A367-N384 HydrophobicContact CB-CB 3.68Å
385	C	90.6	Very high	92.1	Very high	19 Å²	19	81.4 Å²	81.4	13%	0.128	41%	0.41	C	S	.	.	S	Bend	trans	-145	153.2	176.4	69.4	0	0	0	0	111.7	I363 Y374 S387 N388 L389	I363-C385 HydrophobicContact CD1-CB 4.13Å; I363-C385 HydrophobicContact CG1-CB 4.39Å; I363-C385 HydrophobicContact CG2-CB 4.13Å; Y374-C385 VanDerWaalsContact CD2-CA 3.49Å; C385-S387 VanDerWaalsContact C-N 3.28Å; C385-S387 PolarHBondContact O-N 3.48Å; C385-N388 PolarHBondContact O-N 2.6Å; C385-N388 PolarHBondContact SG-OD1 2.79Å; C385-N388 VanDerWaalsContact SG-OD1 3.41Å; C385-L389 PolarHBondContact O-N 3.15Å
386	K	90.7	Very high	91.9	Very high	151 Å²	151	80.6 Å²	80.6	66%	0.657	41%	0.41	S	S	*	.	H	α-helix	trans	-61.4	-35.1	-179.5	-169.4	173.7	-178.2	177.4	0	112.5	Y374 N388 L389 N390	Y374-K386 HydrophobicContact CD1-CB 4.13Å; Y374-K386 HydrophobicContact CE1-CB 3.91Å; Y374-K386 HydrophobicContact CE1-CG 4.47Å; K386-N388 VanDerWaalsContact C-N 3.34Å; K386-N388 PolarHBondContact O-N 3.08Å; K386-L389 PolarHBondContact O-N 3.18Å; K386-N390 WeakPolarHBondContact O-CB 3.25Å; K386-N390 PolarHBondContact O-N 3.04Å
387	S	88.7	Confident	91.7	Very high	95 Å²	95	82.9 Å²	82.9	66%	0.664	42%	0.42	S	S	*	.	H	α-helix	trans	-63.1	-39.7	178.8	-50.6	0	0	0	0	112.4	C385 N390 G391	C385-S387 VanDerWaalsContact C-N 3.28Å; C385-S387 PolarHBondContact O-N 3.48Å; S387-N390 PolarHBondContact O-N 2.99Å; S387-G391 PolarHBondContact O-N 3.25Å
388	N	91	Very high	91.6	Very high	96 Å²	96	78.2 Å²	78.2	51%	0.513	40%	0.401	S	S	.	.	H	α-helix	trans	-70.6	-39.5	177.2	-71.3	6.9	0	0	0	111.5	F383 C385 K386 N390 G391 H392	F383-N388 HydrophobicContact CB-CB 4.25Å; F383-N388 HydrophobicContact CD1-CB 3.86Å; F383-N388 HydrophobicContact CG-CB 4.38Å; C385-N388 PolarHBondContact O-N 2.6Å; C385-N388 PolarHBondContact SG-OD1 2.79Å; C385-N388 VanDerWaalsContact SG-OD1 3.41Å; K386-N388 VanDerWaalsContact C-N 3.34Å; K386-N388 PolarHBondContact O-N 3.08Å; N388-N390 VanDerWaalsContact C-N 3.33Å; N388-G391 PolarHBondContact O-N 2.8Å; N388-H392 WeakPolarHBondContact O-CB 3.12Å; N388-H392 PolarHBondContact O-N 3.13Å
389	L	93	Very high	91.4	Very high	28 Å²	28	74.5 Å²	74.5	15%	0.147	40%	0.397	C	S	.	.	H	α-helix	trans	-58.7	-46.5	171.4	172.9	62.9	0	0	0	110.6	C376 F383 C385 K386 G391 H392 M393	C376-L389 HydrophobicContact CB-CD1 3.87Å; F383-L389 HydrophobicContact CB-CB 4.2Å; F383-L389 HydrophobicContact CD2-CB 3.87Å; F383-L389 HydrophobicContact CD2-CD1 3.67Å; F383-L389 HydrophobicContact CD2-CG 4.38Å; F383-L389 HydrophobicContact CE2-CD1 3.82Å; F383-L389 HydrophobicContact CG-CB 4.14Å; C385-L389 PolarHBondContact O-N 3.15Å; K386-L389 PolarHBondContact O-N 3.18Å; L389-G391 PolarHBondContact O-N 2.79Å; L389-H392 CarbonylContact O-C 3.46Å; L389-H392 WeakPolarHBondContact O-CA 3.25Å; L389-H392 WeakPolarHBondContact O-CB 3.32Å; L389-H392 PolarHBondContact O-N 3.06Å; L389-H392 VanDerWaalsContact O-N 3.12Å; L389-M393 HydrophobicContact CD1-CG 4.16Å; L389-M393 HydrophobicContact CD1-SD 4.19Å; L389-M393 HydrophobicContact CG-CG 4.33Å; L389-M393 WeakPolarHBondContact O-CG 3.48Å; L389-M393 PolarHBondContact O-N 3.08Å
390	N	91.9	Very high	91.2	Very high	83 Å²	83	76.5 Å²	76.5	44%	0.444	40%	0.404	S	S	.	.	H	α-helix	trans	-62.6	-41.8	179.9	-166.3	53.9	0	0	0	112.5	K386 S387 N388 H392 M393 K394	K386-N390 WeakPolarHBondContact O-CB 3.25Å; K386-N390 PolarHBondContact O-N 3.04Å; S387-N390 PolarHBondContact O-N 2.99Å; N388-N390 VanDerWaalsContact C-N 3.33Å; N390-H392 VanDerWaalsContact C-N 3.28Å; N390-H392 PolarHBondContact O-N 3.04Å; N390-M393 PolarHBondContact O-N 2.92Å; N390-K394 WeakPolarHBondContact O-CG 3.34Å; N390-K394 PolarHBondContact O-N 2.99Å
391	G	89.7	Confident	91.1	Very high	37 Å²	37	71.4 Å²	71.4	38%	0.381	38%	0.379	S	S	.	.	H	α-helix	trans	-62.2	-36.1	173.7	0	0	0	0	0	112.7	S387 N388 L389 S395	S387-G391 PolarHBondContact O-N 3.25Å; N388-G391 PolarHBondContact O-N 2.8Å; L389-G391 PolarHBondContact O-N 2.79Å; G391-S395 WeakPolarHBondContact O-CB 3.15Å; G391-S395 PolarHBondContact O-N 3.21Å; G391-S395 VanDerWaalsContact O-N 3.09Å; G391-S395 PolarHBondContact O-OG 3.1Å
392	H	91.3	Very high	91	Very high	11 Å²	11	67.8 Å²	67.8	5%	0.051	37%	0.368	C	S	.	.	H	α-helix	trans	-68.2	-46.5	172.8	163.2	67.1	0	0	0	112.9	C376 C379 F383 N388 L389 N390 K394 S395 V396 H397	C376-H392 PolarHBondContact SG-NE2 3.28Å; C376-H392 VanDerWaalsContact SG-NE2 3.39Å; C379-H392 VanDerWaalsContact SG-CE1 3.56Å; C379-H392 PolarHBondContact SG-NE2 2.94Å; F383-H392 HydrophobicContact CE1-CB 3.78Å; F383-H392 HydrophobicContact CE2-CB 3.91Å; F383-H392 AromaticContact CE2-CD2 3.39Å; F383-H392 WeakPolarHBondContact CE2-CD2 3.47Å; F383-H392 AromaticContact CE2-CG 3.69Å; F383-H392 HydrophobicContact CZ-CB 3.29Å; F383-H392 AromaticContact CZ-CD2 3.46Å; F383-H392 VanDerWaalsContact CZ-CD2 3.46Å; F383-H392 WeakPolarHBondContact CZ-CD2 3.42Å; F383-H392 AromaticContact CZ-CG 3.23Å; F383-H392 AromaticContact CZ-ND1 3.88Å; N388-H392 WeakPolarHBondContact O-CB 3.12Å; N388-H392 PolarHBondContact O-N 3.13Å; L389-H392 CarbonylContact O-C 3.46Å; L389-H392 WeakPolarHBondContact O-CA 3.25Å; L389-H392 WeakPolarHBondContact O-CB 3.32Å; L389-H392 PolarHBondContact O-N 3.06Å; L389-H392 VanDerWaalsContact O-N 3.12Å; N390-H392 VanDerWaalsContact C-N 3.28Å; N390-H392 PolarHBondContact O-N 3.04Å; H392-K394 VanDerWaalsContact C-N 3.3Å; H392-K394 PolarHBondContact O-N 3.39Å; H392-S395 PolarHBondContact O-N 2.94Å; H392-S395 PolarHBondContact O-OG 2.67Å; H392-V396 WeakPolarHBondContact ND1-CG2 3.41Å; H392-V396 WeakPolarHBondContact O-CB 3.48Å; H392-V396 PolarHBondContact O-N 3.39Å; H392-H397 AromaticContact CE1-CD2 3.94Å; H392-H397 AromaticContact CE1-NE2 3.58Å; H392-H397 AromaticContact NE2-CD2 3.6Å; H392-H397 AromaticContact NE2-NE2 3.26Å; H392-H397 PolarHBondContact NE2-NE2 3.13Å
393	M	93.1	Very high	90.9	Very high	35 Å²	35	65.7 Å²	65.7	17%	0.172	36%	0.36	C	S	.	.	I	π-helix	trans	-54.8	-49.4	176	-67.7	-53.7	-59	0	0	110.7	C376 Q378 L389 N390 S395 H397 E398	C376-M393 HydrophobicContact CB-SD 4.45Å; C376-M393 PolarHBondContact SG-SD 2.71Å; Q378-M393 HydrophobicContact CG-CE 4.46Å; L389-M393 HydrophobicContact CD1-CG 4.16Å; L389-M393 HydrophobicContact CD1-SD 4.19Å; L389-M393 HydrophobicContact CG-CG 4.33Å; L389-M393 WeakPolarHBondContact O-CG 3.48Å; L389-M393 PolarHBondContact O-N 3.08Å; N390-M393 PolarHBondContact O-N 2.92Å; M393-S395 PolarHBondContact O-N 3.43Å; M393-H397 HydrophobicContact CE-CB 4.07Å; M393-H397 WeakPolarHBondContact O-CA 3.43Å; M393-H397 WeakPolarHBondContact O-CB 3.48Å; M393-H397 PolarHBondContact O-N 3.01Å; M393-E398 PolarHBondContact O-N 3.02Å
394	K	91.9	Very high	91	Very high	92 Å²	92	64.2 Å²	64.2	40%	0.4	35%	0.354	S	S	.	.	I	π-helix	trans	-59.5	-49.3	178.7	-72.7	-171.3	172.8	-158.1	0	113	N390 H392 E398 G399 I400	N390-K394 WeakPolarHBondContact O-CG 3.34Å; N390-K394 PolarHBondContact O-N 2.99Å; H392-K394 VanDerWaalsContact C-N 3.3Å; H392-K394 PolarHBondContact O-N 3.39Å; K394-E398 CarbonylContact O-C 3.5Å; K394-G399 PolarHBondContact O-N 2.77Å; K394-I400 HydrophobicContact CB-CB 4.29Å; K394-I400 HydrophobicContact CG-CD1 4.37Å; K394-I400 WeakPolarHBondContact O-CA 3.42Å; K394-I400 WeakPolarHBondContact O-CB 3.39Å; K394-I400 PolarHBondContact O-N 3.09Å
395	S	90.7	Very high	91.1	Very high	25 Å²	25	68.5 Å²	68.5	18%	0.175	38%	0.377	C	S	.	.	I	π-helix	trans	-79.1	-34.3	-172.8	52.8	0	0	0	0	114.5	G391 H392 M393	G391-S395 WeakPolarHBondContact O-CB 3.15Å; G391-S395 PolarHBondContact O-N 3.21Å; G391-S395 VanDerWaalsContact O-N 3.09Å; G391-S395 PolarHBondContact O-OG 3.1Å; H392-S395 PolarHBondContact O-N 2.94Å; H392-S395 PolarHBondContact O-OG 2.67Å; M393-S395 PolarHBondContact O-N 3.43Å
396	V	88.8	Confident	91.2	Very high	86 Å²	86	74 Å²	74	52%	0.521	40%	0.401	S	S	.	.	I	π-helix	trans	-99.8	-39.7	-172.3	178.9	0	0	0	0	112.2	H392	H392-V396 WeakPolarHBondContact ND1-CG2 3.41Å; H392-V396 WeakPolarHBondContact O-CB 3.48Å; H392-V396 PolarHBondContact O-N 3.39Å
397	H	91.1	Very high	91.4	Very high	54 Å²	54	68.6 Å²	68.6	25%	0.25	38%	0.382	C	S	.	.	I	π-helix	trans	-102.2	-37.9	-171.2	-66.9	-64.3	0	0	0	112.7	C376 Q378 C379 H392 M393	C376-H397 PolarHBondContact SG-NE2 3.49Å; Q378-H397 WeakPolarHBondContact CB-CE1 3.46Å; Q378-H397 WeakPolarHBondContact CB-ND1 3.34Å; Q378-H397 VanDerWaalsContact OE1-CB 3.24Å; Q378-H397 PolarHBondContact OE1-ND1 3.25Å; C379-H397 PolarHBondContact SG-NE2 3.47Å; H392-H397 AromaticContact CE1-CD2 3.94Å; H392-H397 AromaticContact CE1-NE2 3.58Å; H392-H397 AromaticContact NE2-CD2 3.6Å; H392-H397 AromaticContact NE2-NE2 3.26Å; H392-H397 PolarHBondContact NE2-NE2 3.13Å; M393-H397 HydrophobicContact CE-CB 4.07Å; M393-H397 WeakPolarHBondContact O-CA 3.43Å; M393-H397 WeakPolarHBondContact O-CB 3.48Å; M393-H397 PolarHBondContact O-N 3.01Å
398	E	91	Very high	91.6	Very high	108 Å²	108	70.8 Å²	70.8	51%	0.505	39%	0.386	S	S	.	.	S	Bend	trans	-90.6	-7.7	175.9	-59.7	167.9	-159.1	0	0	112.4	M393 K394 I400	M393-E398 PolarHBondContact O-N 3.02Å; K394-E398 CarbonylContact O-C 3.5Å; E398-I400 HydrophobicContact CB-CD1 4.02Å; E398-I400 HydrophobicContact CB-CG1 3.86Å; E398-I400 PolarHBondContact O-N 3.41Å; E398-I400 VanDerWaalsContact O-N 3.14Å; E398-I400 WeakPolarHBondContact OE2-CD1 3.25Å
399	G	87.5	Confident	91.8	Very high	49 Å²	49	71.4 Å²	71.4	51%	0.505	39%	0.385	S	S	.	.			trans	64.5	14.4	-178.7	0	0	0	0	0	114.5	K394 T401	K394-G399 PolarHBondContact O-N 2.77Å; G399-T401 PolarHBondContact O-N 3.41Å
400	I	89.2	Confident	91.7	Very high	81 Å²	81	76.1 Å²	76.1	42%	0.415	41%	0.405	S	S	.	.			trans	-73.8	101.3	179.4	-56.1	178.2	0	0	0	108.7	K394 E398	K394-I400 HydrophobicContact CB-CB 4.29Å; K394-I400 HydrophobicContact CG-CD1 4.37Å; K394-I400 WeakPolarHBondContact O-CA 3.42Å; K394-I400 WeakPolarHBondContact O-CB 3.39Å; K394-I400 PolarHBondContact O-N 3.09Å; E398-I400 HydrophobicContact CB-CD1 4.02Å; E398-I400 HydrophobicContact CB-CG1 3.86Å; E398-I400 PolarHBondContact O-N 3.41Å; E398-I400 VanDerWaalsContact O-N 3.14Å; E398-I400 WeakPolarHBondContact OE2-CD1 3.25Å
401	T	91.2	Very high	91.7	Very high	51 Å²	51	73.7 Å²	73.7	31%	0.313	39%	0.39	S	S	.	.			trans	-119	159.4	174.5	65.1	0	0	0	0	110.7	G399 F411	G399-T401 PolarHBondContact O-N 3.41Å; T401-F411 CarbonylContact C-O 3.51Å; T401-F411 WeakPolarHBondContact CA-O 3.41Å; T401-F411 WeakPolarHBondContact CB-O 3.44Å
402	F	91	Very high	91.7	Very high	83 Å²	83	75.8 Å²	75.8	36%	0.364	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	109.2	171.5	-58.5	-85.2	0	0	0	108	F411 K414 L417	F402-F411 PolarHBondContact N-O 3.39Å; F402-F411 PolarHBondContact O-N 3.02Å; F402-K414 HydrophobicContact CD1-CB 4.24Å; F402-K414 HydrophobicContact CE1-CB 4.08Å; F402-K414 HydrophobicContact CE2-CB 4.37Å; F402-K414 HydrophobicContact CG-CB 4.44Å; F402-K414 HydrophobicContact CZ-CB 4.15Å; F402-L417 HydrophobicContact CB-CB 4.15Å; F402-L417 HydrophobicContact CB-CD2 3.76Å
403	Q	92.4	Very high	91.5	Very high	88 Å²	88	76.6 Å²	76.6	41%	0.411	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	146	176.9	-178.7	162.8	-5.9	0	0	110.2	K410 L417	Q403-K410 HydrophobicContact CB-CG 4.24Å; Q403-K410 HydrophobicContact CG-CG 4.32Å; Q403-L417 WeakPolarHBondContact O-CD2 3.48Å
404	C	94.6	Very high	91.3	Very high	3 Å²	3	81.2 Å²	81.2	2%	0.02	42%	0.424	C	S	.	.			trans	-79.8	135.9	167.1	-177.3	0	0	0	0	109.6	E406 C407 Q409 L417 H425	C404-E406 VanDerWaalsContact C-N 3.26Å; C404-E406 PolarHBondContact O-N 3.22Å; C404-E406 PolarHBondContact SG-N 3.26Å; C404-C407 CarbonylContact C-O 3.57Å; C404-Q409 PolarHBondContact N-O 3.11Å; C404-L417 HydrophobicContact CB-CD1 3.68Å; C404-H425 PolarHBondContact SG-NE2 3.25Å
405	D	93.8	Very high	91.2	Very high	164 Å²	164	81.4 Å²	81.4	88%	0.877	44%	0.435	S	S	*	.	S	Bend	trans	-77.3	-17.7	179.7	-55.4	-41.6	0	0	0	112.2
406	E	92.5	Very high	91.2	Very high	134 Å²	134	83.2 Å²	83.2	63%	0.626	44%	0.441	S	S	*	.	S	Bend	trans	-99.7	-6.4	-178.9	-64.1	-178.6	-139.9	0	0	113.4	C404 H425	C404-E406 VanDerWaalsContact C-N 3.26Å; C404-E406 PolarHBondContact O-N 3.22Å; C404-E406 PolarHBondContact SG-N 3.26Å; E406-H425 WeakPolarHBondContact CB-CE1 3.48Å; E406-H425 VanDerWaalsContact CB-ND1 3.33Å; E406-H425 WeakPolarHBondContact CB-ND1 3.38Å; E406-H425 WeakPolarHBondContact OE2-CB 3.41Å; E406-H425 IonicContact OE2-CE1 3.72Å; E406-H425 IonicContact OE2-CG 3.24Å; E406-H425 VanDerWaalsContact OE2-CG 3.24Å; E406-H425 IonicContact OE2-ND1 2.73Å; E406-H425 PolarHBondContact OE2-ND1 3.41Å
407	C	94.7	Very high	91.5	Very high	38 Å²	38	80 Å²	80	26%	0.257	42%	0.421	S	S	.	.	S	Bend	trans	-160.7	166.7	173.6	73.8	0	0	0	0	113.2	C404 Q409 H420	C404-C407 CarbonylContact C-O 3.57Å; C407-Q409 PolarHBondContact O-N 3.43Å; C407-Q409 VanDerWaalsContact SG-CG 3.56Å; C407-H420 PolarHBondContact SG-CE1 2.83Å; C407-H420 PolarHBondContact SG-NE2 3.39Å
408	D	93.1	Very high	91.7	Very high	141 Å²	141	81 Å²	81	75%	0.754	43%	0.428	S	S	*	.	S	Bend	trans	-73	8.9	-176.6	-61.2	-45.6	0	0	0	115.5	K410	D408-K410 PolarHBondContact O-N 3.12Å
409	Q	94.7	Very high	91.8	Very high	108 Å²	108	80.8 Å²	80.8	51%	0.505	42%	0.423	S	S	.	.			trans	-73.9	129.3	-178.2	-65.5	-63.5	-48.2	0	0	111.7	C404 C407 F411	C404-Q409 PolarHBondContact N-O 3.11Å; C407-Q409 PolarHBondContact O-N 3.43Å; C407-Q409 VanDerWaalsContact SG-CG 3.56Å; Q409-F411 HydrophobicContact CB-CE2 3.65Å; Q409-F411 HydrophobicContact CB-CZ 3.77Å
410	K	92.5	Very high	92.1	Very high	127 Å²	127	79.4 Å²	79.4	55%	0.552	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114	138.1	178	-64.9	-178	-178.8	-176.9	0	110.9	Q403 D408	Q403-K410 HydrophobicContact CB-CG 4.24Å; Q403-K410 HydrophobicContact CG-CG 4.32Å; D408-K410 PolarHBondContact O-N 3.12Å
411	F	91.9	Very high	92.4	Very high	33 Å²	33	77.5 Å²	77.5	15%	0.145	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147.9	-175.7	-60.2	-83.8	0	0	0	112.2	T401 F402 Q409 A413 Q416 L417 H420	T401-F411 CarbonylContact C-O 3.51Å; T401-F411 WeakPolarHBondContact CA-O 3.41Å; T401-F411 WeakPolarHBondContact CB-O 3.44Å; F402-F411 PolarHBondContact N-O 3.39Å; F402-F411 PolarHBondContact O-N 3.02Å; Q409-F411 HydrophobicContact CB-CE2 3.65Å; Q409-F411 HydrophobicContact CB-CZ 3.77Å; F411-A413 VanDerWaalsContact C-N 3.34Å; F411-Q416 HydrophobicContact CB-CB 4.04Å; F411-Q416 HydrophobicContact CD1-CB 3.75Å; F411-Q416 HydrophobicContact CG-CB 4.15Å; F411-L417 HydrophobicContact CB-CB 4.24Å; F411-L417 HydrophobicContact CD2-CB 3.82Å; F411-L417 HydrophobicContact CD2-CD1 3.71Å; F411-L417 HydrophobicContact CD2-CG 4.38Å; F411-L417 HydrophobicContact CE2-CD1 3.89Å; F411-L417 HydrophobicContact CG-CB 4.2Å; F411-H420 HydrophobicContact CE1-CB 3.93Å; F411-H420 HydrophobicContact CE2-CB 3.77Å; F411-H420 AromaticContact CE2-CD2 3.54Å; F411-H420 AromaticContact CE2-CG 3.58Å; F411-H420 HydrophobicContact CZ-CB 3.32Å; F411-H420 AromaticContact CZ-CD2 3.74Å; F411-H420 AromaticContact CZ-CG 3.27Å; F411-H420 AromaticContact CZ-ND1 3.67Å
412	T	89	Confident	92.6	Very high	80 Å²	80	79.1 Å²	79.1	49%	0.491	40%	0.397	S	S	.	.	S	Bend	trans	-81.9	-14.1	179.1	60.5	0	0	0	0	113.5	Q416	T412-Q416 PolarHBondContact OG1-OE1 3.5Å; T412-Q416 VanDerWaalsContact OG1-OE1 3.09Å
413	A	87.1	Confident	92.7	Very high	29 Å²	29	76.1 Å²	76.1	24%	0.24	39%	0.387	C	S	.	.	S	Bend	trans	-143.3	140.4	-179.3	0	0	0	0	0	111.6	F411 C415 Q416 L417	F411-A413 VanDerWaalsContact C-N 3.34Å; A413-C415 VanDerWaalsContact C-N 3.25Å; A413-C415 PolarHBondContact O-N 3.48Å; A413-Q416 HydrophobicContact CB-CG 4.17Å; A413-Q416 WeakPolarHBondContact O-CB 3.34Å; A413-Q416 PolarHBondContact O-N 2.99Å; A413-L417 PolarHBondContact O-N 3.06Å
414	K	89.5	Confident	92.8	Very high	132 Å²	132	77.2 Å²	77.2	57%	0.574	39%	0.394	S	S	*	.	H	α-helix	trans	-56	-35.9	179.7	-171.1	169.1	-175.5	169.6	0	113.6	F402 Q416 L417 N418	F402-K414 HydrophobicContact CD1-CB 4.24Å; F402-K414 HydrophobicContact CE1-CB 4.08Å; F402-K414 HydrophobicContact CE2-CB 4.37Å; F402-K414 HydrophobicContact CG-CB 4.44Å; F402-K414 HydrophobicContact CZ-CB 4.15Å; K414-Q416 VanDerWaalsContact C-N 3.25Å; K414-Q416 PolarHBondContact O-N 2.94Å; K414-L417 PolarHBondContact O-N 3.31Å; K414-N418 PolarHBondContact O-N 3.41Å; K414-N418 PolarHBondContact O-OD1 3.02Å
415	C	88.1	Confident	92.8	Very high	95 Å²	95	79.6 Å²	79.6	64%	0.642	41%	0.405	S	S	*	.	H	α-helix	trans	-66.4	-26.5	176.5	62.7	0	0	0	0	113.5	A413 R419	A413-C415 VanDerWaalsContact C-N 3.25Å; A413-C415 PolarHBondContact O-N 3.48Å; C415-R419 WeakPolarHBondContact O-CB 3.27Å; C415-R419 PolarHBondContact O-N 2.99Å
416	Q	92.5	Very high	92.8	Very high	63 Å²	63	77.6 Å²	77.6	29%	0.294	39%	0.39	S	S	.	.	H	α-helix	trans	-75	-42.9	175	-62.5	171.3	-9.1	0	0	110.5	F411 T412 A413 K414 R419 H420	F411-Q416 HydrophobicContact CB-CB 4.04Å; F411-Q416 HydrophobicContact CD1-CB 3.75Å; F411-Q416 HydrophobicContact CG-CB 4.15Å; T412-Q416 PolarHBondContact OG1-OE1 3.5Å; T412-Q416 VanDerWaalsContact OG1-OE1 3.09Å; A413-Q416 HydrophobicContact CB-CG 4.17Å; A413-Q416 WeakPolarHBondContact O-CB 3.34Å; A413-Q416 PolarHBondContact O-N 2.99Å; K414-Q416 VanDerWaalsContact C-N 3.25Å; K414-Q416 PolarHBondContact O-N 2.94Å; Q416-R419 PolarHBondContact O-N 3.41Å; Q416-H420 WeakPolarHBondContact O-CB 3.47Å; Q416-H420 PolarHBondContact O-N 2.78Å
417	L	94.4	Very high	92.7	Very high	19 Å²	19	73.4 Å²	73.4	10%	0.099	38%	0.383	C	S	.	.	H	α-helix	trans	-59.3	-52.3	173.2	173.4	62.4	0	0	0	111.1	F402 Q403 C404 F411 A413 K414 R419 H420 I421	F402-L417 HydrophobicContact CB-CB 4.15Å; F402-L417 HydrophobicContact CB-CD2 3.76Å; Q403-L417 WeakPolarHBondContact O-CD2 3.48Å; C404-L417 HydrophobicContact CB-CD1 3.68Å; F411-L417 HydrophobicContact CB-CB 4.24Å; F411-L417 HydrophobicContact CD2-CB 3.82Å; F411-L417 HydrophobicContact CD2-CD1 3.71Å; F411-L417 HydrophobicContact CD2-CG 4.38Å; F411-L417 HydrophobicContact CE2-CD1 3.89Å; F411-L417 HydrophobicContact CG-CB 4.2Å; A413-L417 PolarHBondContact O-N 3.06Å; K414-L417 PolarHBondContact O-N 3.31Å; L417-R419 VanDerWaalsContact C-N 3.28Å; L417-R419 PolarHBondContact O-N 2.77Å; L417-H420 CarbonylContact O-C 3.5Å; L417-H420 WeakPolarHBondContact O-CA 3.39Å; L417-H420 VanDerWaalsContact O-CB 3.31Å; L417-H420 WeakPolarHBondContact O-CB 3.5Å; L417-H420 PolarHBondContact O-N 3.33Å; L417-I421 HydrophobicContact CD1-CD1 3.91Å; L417-I421 HydrophobicContact CD1-CG1 4.07Å; L417-I421 HydrophobicContact CD2-CD1 4.49Å; L417-I421 HydrophobicContact CG-CD1 3.89Å; L417-I421 HydrophobicContact CG-CG1 4.44Å; L417-I421 WeakPolarHBondContact O-CG1 3.34Å; L417-I421 PolarHBondContact O-N 3.21Å
418	N	94.2	Very high	92.6	Very high	74 Å²	74	74.6 Å²	74.6	40%	0.396	39%	0.389	S	S	.	.	H	α-helix	trans	-57.7	-42.3	179.9	-71.7	10.6	0	0	0	112	K414 H420 I421 Q422	K414-N418 PolarHBondContact O-N 3.41Å; K414-N418 PolarHBondContact O-OD1 3.02Å; N418-H420 VanDerWaalsContact C-N 3.31Å; N418-H420 PolarHBondContact O-N 3.15Å; N418-I421 PolarHBondContact O-N 3.25Å; N418-Q422 WeakPolarHBondContact O-CB 3.27Å; N418-Q422 VanDerWaalsContact O-CG 3.3Å; N418-Q422 WeakPolarHBondContact O-CG 3.43Å; N418-Q422 PolarHBondContact O-N 3.09Å
419	R	93.2	Very high	92.6	Very high	105 Å²	105	74.9 Å²	74.9	40%	0.396	38%	0.379	S	S	.	.	H	α-helix	trans	-64.5	-38.8	175.5	-178.4	-178.5	63.9	-154.8	-6.4	111.6	C415 Q416 L417 S423	C415-R419 WeakPolarHBondContact O-CB 3.27Å; C415-R419 PolarHBondContact O-N 2.99Å; Q416-R419 PolarHBondContact O-N 3.41Å; L417-R419 VanDerWaalsContact C-N 3.28Å; L417-R419 PolarHBondContact O-N 2.77Å; R419-S423 VanDerWaalsContact O-CB 3.31Å; R419-S423 WeakPolarHBondContact O-CB 3.24Å; R419-S423 PolarHBondContact O-N 3.3Å; R419-S423 PolarHBondContact O-OG 2.85Å
420	H	94.3	Very high	92.6	Very high	20 Å²	20	73.2 Å²	73.2	9%	0.093	37%	0.37	C	S	.	.	H	α-helix	trans	-61.4	-51.2	176	159.1	79.3	0	0	0	110.8	C407 F411 Q416 L417 N418 Q422 S423 I424 H425	C407-H420 PolarHBondContact SG-CE1 2.83Å; C407-H420 PolarHBondContact SG-NE2 3.39Å; F411-H420 HydrophobicContact CE1-CB 3.93Å; F411-H420 HydrophobicContact CE2-CB 3.77Å; F411-H420 AromaticContact CE2-CD2 3.54Å; F411-H420 AromaticContact CE2-CG 3.58Å; F411-H420 HydrophobicContact CZ-CB 3.32Å; F411-H420 AromaticContact CZ-CD2 3.74Å; F411-H420 AromaticContact CZ-CG 3.27Å; F411-H420 AromaticContact CZ-ND1 3.67Å; Q416-H420 WeakPolarHBondContact O-CB 3.47Å; Q416-H420 PolarHBondContact O-N 2.78Å; L417-H420 CarbonylContact O-C 3.5Å; L417-H420 WeakPolarHBondContact O-CA 3.39Å; L417-H420 VanDerWaalsContact O-CB 3.31Å; L417-H420 WeakPolarHBondContact O-CB 3.5Å; L417-H420 PolarHBondContact O-N 3.33Å; N418-H420 VanDerWaalsContact C-N 3.31Å; N418-H420 PolarHBondContact O-N 3.15Å; H420-Q422 VanDerWaalsContact C-N 3.34Å; H420-Q422 PolarHBondContact O-N 2.99Å; H420-S423 PolarHBondContact O-N 3.09Å; H420-S423 VanDerWaalsContact O-N 3.11Å; H420-S423 PolarHBondContact O-OG 2.82Å; H420-S423 VanDerWaalsContact O-OG 3.1Å; H420-I424 WeakPolarHBondContact O-CB 3.39Å; H420-I424 WeakPolarHBondContact O-CG1 3.34Å; H420-I424 PolarHBondContact O-N 2.93Å; H420-H425 AromaticContact CE1-NE2 3.68Å; H420-H425 AromaticContact NE2-CD2 3.6Å; H420-H425 AromaticContact NE2-NE2 3.24Å; H420-H425 PolarHBondContact NE2-NE2 3.06Å
421	I	95.5	Very high	92.6	Very high	40 Å²	40	71 Å²	71	21%	0.205	37%	0.368	C	S	.	.	I	π-helix	trans	-52.6	-53.4	174.9	-65.4	169.4	0	0	0	110.2	L417 N418 S423 H425 E426	L417-I421 HydrophobicContact CD1-CD1 3.91Å; L417-I421 HydrophobicContact CD1-CG1 4.07Å; L417-I421 HydrophobicContact CD2-CD1 4.49Å; L417-I421 HydrophobicContact CG-CD1 3.89Å; L417-I421 HydrophobicContact CG-CG1 4.44Å; L417-I421 WeakPolarHBondContact O-CG1 3.34Å; L417-I421 PolarHBondContact O-N 3.21Å; N418-I421 PolarHBondContact O-N 3.25Å; I421-S423 VanDerWaalsContact C-N 3.32Å; I421-S423 PolarHBondContact O-N 2.89Å; I421-H425 HydrophobicContact CG2-CB 4.41Å; I421-H425 WeakPolarHBondContact O-CA 3.4Å; I421-H425 WeakPolarHBondContact O-CB 3.35Å; I421-H425 PolarHBondContact O-N 2.9Å; I421-E426 HydrophobicContact CG2-CG 4.17Å; I421-E426 PolarHBondContact O-N 3.25Å
422	Q	94.7	Very high	92.8	Very high	85 Å²	85	70 Å²	70	40%	0.397	37%	0.365	S	S	.	.	I	π-helix	trans	-55.1	-46	177.7	-77.3	176.4	-13.5	0	0	112.5	N418 H420 E426 G427 V428	N418-Q422 WeakPolarHBondContact O-CB 3.27Å; N418-Q422 VanDerWaalsContact O-CG 3.3Å; N418-Q422 WeakPolarHBondContact O-CG 3.43Å; N418-Q422 PolarHBondContact O-N 3.09Å; H420-Q422 VanDerWaalsContact C-N 3.34Å; H420-Q422 PolarHBondContact O-N 2.99Å; Q422-E426 WeakPolarHBondContact CG-OE2 3.43Å; Q422-E426 CarbonylContact O-C 3.51Å; Q422-G427 PolarHBondContact O-N 2.9Å; Q422-G427 VanDerWaalsContact O-N 3.14Å; Q422-V428 HydrophobicContact CB-CB 4.14Å; Q422-V428 HydrophobicContact CB-CG2 4.33Å; Q422-V428 WeakPolarHBondContact O-CA 3.32Å; Q422-V428 WeakPolarHBondContact O-CB 3.46Å; Q422-V428 PolarHBondContact O-N 3.44Å
423	S	94.8	Very high	93	Very high	21 Å²	21	75.5 Å²	75.5	15%	0.147	39%	0.385	C	S	.	.	I	π-helix	trans	-81.9	-30.7	-172.9	65.2	0	0	0	0	115.3	R419 H420 I421	R419-S423 VanDerWaalsContact O-CB 3.31Å; R419-S423 WeakPolarHBondContact O-CB 3.24Å; R419-S423 PolarHBondContact O-N 3.3Å; R419-S423 PolarHBondContact O-OG 2.85Å; H420-S423 PolarHBondContact O-N 3.09Å; H420-S423 VanDerWaalsContact O-N 3.11Å; H420-S423 PolarHBondContact O-OG 2.82Å; H420-S423 VanDerWaalsContact O-OG 3.1Å; I421-S423 VanDerWaalsContact C-N 3.32Å; I421-S423 PolarHBondContact O-N 2.89Å
424	I	93.6	Very high	93.4	Very high	111 Å²	111	80.1 Å²	80.1	57%	0.569	40%	0.401	S	S	*	.	I	π-helix	trans	-103.3	-46.7	-171.8	-59.9	-55	0	0	0	110.9	H420	H420-I424 WeakPolarHBondContact O-CB 3.39Å; H420-I424 WeakPolarHBondContact O-CG1 3.34Å; H420-I424 PolarHBondContact O-N 2.93Å
425	H	94	Very high	93.6	Very high	53 Å²	53	75.6 Å²	75.6	25%	0.245	39%	0.386	C	S	.	.	I	π-helix	trans	-93.5	-45.7	-171.6	-64.5	-80	0	0	0	111.6	C404 E406 H420 I421	C404-H425 PolarHBondContact SG-NE2 3.25Å; E406-H425 WeakPolarHBondContact CB-CE1 3.48Å; E406-H425 VanDerWaalsContact CB-ND1 3.33Å; E406-H425 WeakPolarHBondContact CB-ND1 3.38Å; E406-H425 WeakPolarHBondContact OE2-CB 3.41Å; E406-H425 IonicContact OE2-CE1 3.72Å; E406-H425 IonicContact OE2-CG 3.24Å; E406-H425 VanDerWaalsContact OE2-CG 3.24Å; E406-H425 IonicContact OE2-ND1 2.73Å; E406-H425 PolarHBondContact OE2-ND1 3.41Å; H420-H425 AromaticContact CE1-NE2 3.68Å; H420-H425 AromaticContact NE2-CD2 3.6Å; H420-H425 AromaticContact NE2-NE2 3.24Å; H420-H425 PolarHBondContact NE2-NE2 3.06Å; I421-H425 HydrophobicContact CG2-CB 4.41Å; I421-H425 WeakPolarHBondContact O-CA 3.4Å; I421-H425 WeakPolarHBondContact O-CB 3.35Å; I421-H425 PolarHBondContact O-N 2.9Å
426	E	93.6	Very high	93.8	Very high	122 Å²	122	78.9 Å²	78.9	57%	0.57	40%	0.397	S	S	*	.	S	Bend	trans	-87.7	-10.1	178.4	-58.9	176.3	166.7	0	0	113.1	I421 Q422 V428	I421-E426 HydrophobicContact CG2-CG 4.17Å; I421-E426 PolarHBondContact O-N 3.25Å; Q422-E426 WeakPolarHBondContact CG-OE2 3.43Å; Q422-E426 CarbonylContact O-C 3.51Å; E426-V428 HydrophobicContact CB-CG2 3.86Å; E426-V428 PolarHBondContact O-N 2.77Å
427	G	91.7	Very high	93.9	Very high	45 Å²	45	81.4 Å²	81.4	46%	0.464	41%	0.407	S	S	.	.			trans	64.5	17.5	179.7	0	0	0	0	0	115.2	Q422 R429	Q422-G427 PolarHBondContact O-N 2.9Å; Q422-G427 VanDerWaalsContact O-N 3.14Å; G427-R429 PolarHBondContact O-N 3Å
428	V	92.6	Very high	93.9	Very high	63 Å²	63	86.6 Å²	86.6	38%	0.382	43%	0.429	S	S	.	.			trans	-63.4	123.4	179.1	-179	0	0	0	0	110.1	Q422 E426	Q422-V428 HydrophobicContact CB-CB 4.14Å; Q422-V428 HydrophobicContact CB-CG2 4.33Å; Q422-V428 WeakPolarHBondContact O-CA 3.32Å; Q422-V428 WeakPolarHBondContact O-CB 3.46Å; Q422-V428 PolarHBondContact O-N 3.44Å; E426-V428 HydrophobicContact CB-CG2 3.86Å; E426-V428 PolarHBondContact O-N 2.77Å
429	R	93.3	Very high	93.9	Very high	147 Å²	147	85 Å²	85	56%	0.555	42%	0.419	S	S	*	.			trans	-134	147.3	177.3	-61.1	-174.1	178.1	-169.6	0.5	111.1	G427 K438 F439	G427-R429 PolarHBondContact O-N 3Å; R429-K438 HydrophobicContact CB-CB 3.93Å; R429-K438 HydrophobicContact CG-CB 4.47Å; R429-F439 CarbonylContact C-O 3.49Å; R429-F439 VanDerWaalsContact CA-O 3.3Å; R429-F439 WeakPolarHBondContact CA-O 3.31Å
430	F	93.7	Very high	93.8	Very high	74 Å²	74	83 Å²	83	33%	0.325	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	115.2	172.5	-55.8	-83.1	0	0	0	109.1	K438 F439 Q442 L445	F430-K438 CarbonylContact O-C 3.59Å; F430-K438 WeakPolarHBondContact O-CA 3.26Å; F430-F439 WeakPolarHBondContact CD2-O 3.45Å; F430-F439 PolarHBondContact N-O 2.95Å; F430-F439 PolarHBondContact O-N 2.83Å; F430-Q442 HydrophobicContact CD1-CB 4.49Å; F430-Q442 HydrophobicContact CE1-CB 4.35Å; F430-Q442 HydrophobicContact CZ-CB 4.39Å; F430-L445 HydrophobicContact CB-CB 4.29Å; F430-L445 HydrophobicContact CB-CD2 3.72Å
431	T	94	Very high	93.7	Very high	81 Å²	81	86 Å²	86	50%	0.497	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	137.9	177.6	35.6	0	0	0	0	111	K438 L445	T431-K438 HydrophobicContact CG2-CD 3.94Å; T431-K438 HydrophobicContact CG2-CG 3.72Å; T431-L445 WeakPolarHBondContact O-CD2 3.41Å
432	C	95.3	Very high	93.5	Very high	11 Å²	11	88.9 Å²	88.9	7%	0.074	44%	0.443	C	S	.	.			trans	-72.8	138.3	162.9	-174	0	0	0	0	109.6	Q434 C435 K437 L445 H453	C432-Q434 VanDerWaalsContact C-N 3.31Å; C432-Q434 PolarHBondContact SG-N 3.02Å; C432-C435 CarbonylContact C-O 3.49Å; C432-C435 WeakPolarHBondContact CB-O 3.34Å; C432-K437 PolarHBondContact N-O 2.75Å; C432-L445 HydrophobicContact CB-CD1 3.69Å; C432-H453 PolarHBondContact SG-NE2 3.45Å; C432-H453 VanDerWaalsContact SG-NE2 3.41Å
433	E	93.9	Very high	93.2	Very high	195 Å²	195	88.3 Å²	88.3	91%	0.911	45%	0.448	S	S	*	.	S	Bend	trans	-80.6	-16.2	177.2	-64.8	-179.9	173.5	0	0	112.6
434	Q	94	Very high	93	Very high	127 Å²	127	89.8 Å²	89.8	59%	0.593	46%	0.457	S	S	*	.	S	Bend	trans	-105.7	-4.5	-175.9	-60.6	-179.1	45.3	0	0	113.1	C432 H453	C432-Q434 VanDerWaalsContact C-N 3.31Å; C432-Q434 PolarHBondContact SG-N 3.02Å; Q434-H453 WeakPolarHBondContact CB-CE1 3.35Å; Q434-H453 WeakPolarHBondContact CB-ND1 3.28Å; Q434-H453 PolarHBondContact O-CE1 3.18Å; Q434-H453 VanDerWaalsContact OE1-CB 3.25Å; Q434-H453 VanDerWaalsContact OE1-CG 3.32Å; Q434-H453 PolarHBondContact OE1-ND1 3.34Å
435	C	94.4	Very high	93	Very high	37 Å²	37	85.3 Å²	85.3	25%	0.25	43%	0.434	C	S	.	.	S	Bend	trans	-161.2	168.4	172.1	71.8	0	0	0	0	111.6	C432 K437 H448 H453	C432-C435 CarbonylContact C-O 3.49Å; C432-C435 WeakPolarHBondContact CB-O 3.34Å; C435-K437 PolarHBondContact O-N 3.14Å; C435-H448 PolarHBondContact SG-NE2 3.38Å; C435-H453 PolarHBondContact SG-NE2 3.2Å
436	D	92.9	Very high	92.9	Very high	163 Å²	163	87.4 Å²	87.4	87%	0.872	44%	0.443	S	S	*	.	S	Bend	trans	-75.2	8.2	-175.5	-58.3	-49.8	0	0	0	115.4
437	K	94.9	Very high	92.7	Very high	117 Å²	117	84.3 Å²	84.3	51%	0.509	43%	0.431	S	S	.	.			trans	-74.2	134.1	-177.2	-66.9	-170	-177.5	-175.5	0	111.5	C432 C435 F439	C432-K437 PolarHBondContact N-O 2.75Å; C435-K437 PolarHBondContact O-N 3.14Å; K437-F439 HydrophobicContact CB-CE2 3.68Å; K437-F439 HydrophobicContact CB-CZ 3.86Å; K437-F439 HydrophobicContact CD-CZ 4.4Å
438	K	93.8	Very high	92.7	Very high	128 Å²	128	83 Å²	83	56%	0.557	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.7	138.7	179.1	-58.6	-170	-178.6	179.7	0	110.8	R429 F430 T431	R429-K438 HydrophobicContact CB-CB 3.93Å; R429-K438 HydrophobicContact CG-CB 4.47Å; F430-K438 CarbonylContact O-C 3.59Å; F430-K438 WeakPolarHBondContact O-CA 3.26Å; T431-K438 HydrophobicContact CG2-CD 3.94Å; T431-K438 HydrophobicContact CG2-CG 3.72Å
439	F	93.6	Very high	92.7	Very high	41 Å²	41	81.3 Å²	81.3	18%	0.18	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151.5	-174.6	-60.5	-89.6	0	0	0	111.8	R429 F430 K437 L445 H448	R429-F439 CarbonylContact C-O 3.49Å; R429-F439 VanDerWaalsContact CA-O 3.3Å; R429-F439 WeakPolarHBondContact CA-O 3.31Å; F430-F439 WeakPolarHBondContact CD2-O 3.45Å; F430-F439 PolarHBondContact N-O 2.95Å; F430-F439 PolarHBondContact O-N 2.83Å; K437-F439 HydrophobicContact CB-CE2 3.68Å; K437-F439 HydrophobicContact CB-CZ 3.86Å; K437-F439 HydrophobicContact CD-CZ 4.4Å; F439-L445 HydrophobicContact CB-CB 4.19Å; F439-L445 HydrophobicContact CD2-CB 3.83Å; F439-L445 HydrophobicContact CD2-CD1 3.68Å; F439-L445 HydrophobicContact CD2-CG 4.35Å; F439-L445 HydrophobicContact CE2-CD1 3.83Å; F439-L445 HydrophobicContact CG-CB 4.13Å; F439-H448 HydrophobicContact CE1-CB 3.89Å; F439-H448 HydrophobicContact CE2-CB 3.96Å; F439-H448 AromaticContact CE2-CD2 3.42Å; F439-H448 VanDerWaalsContact CE2-CD2 3.42Å; F439-H448 WeakPolarHBondContact CE2-CD2 3.38Å; F439-H448 AromaticContact CE2-CG 3.7Å; F439-H448 HydrophobicContact CZ-CB 3.4Å; F439-H448 AromaticContact CZ-CD2 3.49Å; F439-H448 VanDerWaalsContact CZ-CD2 3.49Å; F439-H448 WeakPolarHBondContact CZ-CD2 3.4Å; F439-H448 AromaticContact CZ-CG 3.26Å; F439-H448 AromaticContact CZ-ND1 3.86Å
440	T	91.8	Very high	92.6	Very high	62 Å²	62	77.1 Å²	77.1	38%	0.38	39%	0.388	S	S	.	.	S	Bend	trans	-87.5	-7.4	177	56.1	0	0	0	0	113.5
441	K	91.1	Very high	92.5	Very high	83 Å²	83	74.8 Å²	74.8	36%	0.361	38%	0.38	S	S	.	.	S	Bend	trans	-136.6	138.6	178.9	-57.7	176	-174.3	166.6	0	110.6	S443 T444 L445	K441-S443 PolarHBondContact O-N 2.77Å; K441-T444 HydrophobicContact CB-CG2 4.31Å; K441-T444 WeakPolarHBondContact CB-OG1 3.43Å; K441-T444 PolarHBondContact O-N 2.84Å; K441-T444 VanDerWaalsContact O-N 3.11Å; K441-T444 PolarHBondContact O-OG1 3.5Å; K441-L445 PolarHBondContact O-N 3Å; K441-L445 VanDerWaalsContact O-N 3.16Å
442	Q	91.1	Very high	92.4	Very high	101 Å²	101	74.8 Å²	74.8	47%	0.472	38%	0.38	S	S	.	.	H	α-helix	trans	-58.7	-38	173.8	-170.7	61.6	12.2	0	0	112.3	F430 T444 L445 H446	F430-Q442 HydrophobicContact CD1-CB 4.49Å; F430-Q442 HydrophobicContact CE1-CB 4.35Å; F430-Q442 HydrophobicContact CZ-CB 4.39Å; Q442-T444 VanDerWaalsContact C-N 3.29Å; Q442-T444 PolarHBondContact O-N 3.47Å; Q442-L445 PolarHBondContact O-N 3.12Å; Q442-H446 WeakPolarHBondContact O-CB 3.44Å; Q442-H446 PolarHBondContact O-N 2.99Å
443	S	89	Confident	92.2	Very high	72 Å²	72	77 Å²	77	50%	0.503	39%	0.389	S	S	.	.	H	α-helix	trans	-63.2	-35	178.2	65.2	0	0	0	0	113	K441 H446 D447	K441-S443 PolarHBondContact O-N 2.77Å; S443-H446 PolarHBondContact O-N 3.24Å; S443-D447 PolarHBondContact O-N 3.31Å
444	T	91.4	Very high	92.1	Very high	53 Å²	53	72.8 Å²	72.8	33%	0.325	37%	0.369	S	S	.	.	H	α-helix	trans	-75.5	-34	178.4	47.1	0	0	0	0	111.7	K441 Q442 H448	K441-T444 HydrophobicContact CB-CG2 4.31Å; K441-T444 WeakPolarHBondContact CB-OG1 3.43Å; K441-T444 PolarHBondContact O-N 2.84Å; K441-T444 VanDerWaalsContact O-N 3.11Å; K441-T444 PolarHBondContact O-OG1 3.5Å; Q442-T444 VanDerWaalsContact C-N 3.29Å; Q442-T444 PolarHBondContact O-N 3.47Å; T444-H448 VanDerWaalsContact O-CB 3.3Å; T444-H448 WeakPolarHBondContact O-CB 3.5Å; T444-H448 PolarHBondContact O-N 3.13Å
445	L	93.8	Very high	91.9	Very high	16 Å²	16	69.2 Å²	69.2	8%	0.084	37%	0.367	C	S	.	.	H	α-helix	trans	-62.9	-46.6	169.7	171	60.9	0	0	0	110.5	F430 T431 C432 F439 K441 Q442 D447 H448 V449	F430-L445 HydrophobicContact CB-CB 4.29Å; F430-L445 HydrophobicContact CB-CD2 3.72Å; T431-L445 WeakPolarHBondContact O-CD2 3.41Å; C432-L445 HydrophobicContact CB-CD1 3.69Å; F439-L445 HydrophobicContact CB-CB 4.19Å; F439-L445 HydrophobicContact CD2-CB 3.83Å; F439-L445 HydrophobicContact CD2-CD1 3.68Å; F439-L445 HydrophobicContact CD2-CG 4.35Å; F439-L445 HydrophobicContact CE2-CD1 3.83Å; F439-L445 HydrophobicContact CG-CB 4.13Å; K441-L445 PolarHBondContact O-N 3Å; K441-L445 VanDerWaalsContact O-N 3.16Å; Q442-L445 PolarHBondContact O-N 3.12Å; L445-D447 PolarHBondContact O-N 3.32Å; L445-H448 WeakPolarHBondContact O-CA 3.2Å; L445-H448 WeakPolarHBondContact O-CB 3.46Å; L445-H448 PolarHBondContact O-N 3.42Å; L445-H448 VanDerWaalsContact O-N 3.13Å; L445-V449 HydrophobicContact CD1-CG2 4.03Å; L445-V449 WeakPolarHBondContact O-CG2 3.2Å; L445-V449 PolarHBondContact O-N 3.37Å
446	H	91.2	Very high	91.6	Very high	97 Å²	97	71.8 Å²	71.8	45%	0.449	38%	0.377	S	S	.	.	H	α-helix	trans	-59.4	-47.5	178.4	-173.7	68.8	0	0	0	112.9	Q442 S443 H448 V449 K450	Q442-H446 WeakPolarHBondContact O-CB 3.44Å; Q442-H446 PolarHBondContact O-N 2.99Å; S443-H446 PolarHBondContact O-N 3.24Å; H446-H448 VanDerWaalsContact C-N 3.26Å; H446-H448 PolarHBondContact O-N 3.13Å; H446-V449 PolarHBondContact O-N 3.33Å; H446-K450 WeakPolarHBondContact NE2-CE 3.45Å; H446-K450 PolarHBondContact NE2-NZ 2.95Å; H446-K450 WeakPolarHBondContact O-CG 3.17Å; H446-K450 PolarHBondContact O-N 3.18Å
447	D	89.8	Confident	91.4	Very high	58 Å²	58	70.6 Å²	70.6	31%	0.31	36%	0.361	S	S	.	.	H	α-helix	trans	-62.7	-36.2	175.5	-75	-16.6	0	0	0	111.4	S443 L445 V451	S443-D447 PolarHBondContact O-N 3.31Å; L445-D447 PolarHBondContact O-N 3.32Å; D447-V451 WeakPolarHBondContact O-CB 3.31Å; D447-V451 WeakPolarHBondContact O-CG2 3.28Å; D447-V451 PolarHBondContact O-N 2.77Å; D447-V451 VanDerWaalsContact O-N 3.13Å
448	H	91.8	Very high	91.1	Very high	17 Å²	17	68.7 Å²	68.7	8%	0.079	35%	0.351	C	S	.	.	H	α-helix	trans	-63.7	-48.6	174.7	161.6	66.2	0	0	0	112.2	C435 F439 T444 L445 H446 K450 V451 V452 H453	C435-H448 PolarHBondContact SG-NE2 3.38Å; F439-H448 HydrophobicContact CE1-CB 3.89Å; F439-H448 HydrophobicContact CE2-CB 3.96Å; F439-H448 AromaticContact CE2-CD2 3.42Å; F439-H448 VanDerWaalsContact CE2-CD2 3.42Å; F439-H448 WeakPolarHBondContact CE2-CD2 3.38Å; F439-H448 AromaticContact CE2-CG 3.7Å; F439-H448 HydrophobicContact CZ-CB 3.4Å; F439-H448 AromaticContact CZ-CD2 3.49Å; F439-H448 VanDerWaalsContact CZ-CD2 3.49Å; F439-H448 WeakPolarHBondContact CZ-CD2 3.4Å; F439-H448 AromaticContact CZ-CG 3.26Å; F439-H448 AromaticContact CZ-ND1 3.86Å; T444-H448 VanDerWaalsContact O-CB 3.3Å; T444-H448 WeakPolarHBondContact O-CB 3.5Å; T444-H448 PolarHBondContact O-N 3.13Å; L445-H448 WeakPolarHBondContact O-CA 3.2Å; L445-H448 WeakPolarHBondContact O-CB 3.46Å; L445-H448 PolarHBondContact O-N 3.42Å; L445-H448 VanDerWaalsContact O-N 3.13Å; H446-H448 VanDerWaalsContact C-N 3.26Å; H446-H448 PolarHBondContact O-N 3.13Å; H448-K450 VanDerWaalsContact C-N 3.34Å; H448-K450 PolarHBondContact O-N 2.86Å; H448-V451 PolarHBondContact O-N 2.87Å; H448-V452 VanDerWaalsContact ND1-CG2 3.35Å; H448-V452 WeakPolarHBondContact ND1-CG2 3.43Å; H448-V452 WeakPolarHBondContact O-CB 3.34Å; H448-V452 PolarHBondContact O-N 3.26Å; H448-H453 AromaticContact CE1-NE2 3.88Å; H448-H453 AromaticContact NE2-CD2 3.8Å; H448-H453 AromaticContact NE2-NE2 3.48Å; H448-H453 PolarHBondContact NE2-NE2 3.3Å
449	V	92.8	Very high	90.9	Very high	28 Å²	28	65.8 Å²	65.8	17%	0.17	35%	0.347	C	S	.	.	I	π-helix	trans	-58.3	-48.5	178.7	172.4	0	0	0	0	110.7	L445 H446 V451 H453 E454	L445-V449 HydrophobicContact CD1-CG2 4.03Å; L445-V449 WeakPolarHBondContact O-CG2 3.2Å; L445-V449 PolarHBondContact O-N 3.37Å; H446-V449 PolarHBondContact O-N 3.33Å; V449-V451 VanDerWaalsContact C-N 3.32Å; V449-V451 PolarHBondContact O-N 3.42Å; V449-H453 HydrophobicContact CG1-CB 4.42Å; V449-H453 WeakPolarHBondContact O-CA 3.34Å; V449-H453 WeakPolarHBondContact O-CB 3.4Å; V449-H453 PolarHBondContact O-N 3.23Å; V449-E454 HydrophobicContact CG1-CG 4.49Å; V449-E454 PolarHBondContact O-N 2.99Å
450	K	91.6	Very high	90.9	Very high	59 Å²	59	64 Å²	64	26%	0.257	34%	0.339	S	S	.	.	I	π-helix	trans	-56.1	-44.8	177.5	-75.8	-172.3	164.4	-173	0	113.3	H446 H448 E454 G455 L456	H446-K450 WeakPolarHBondContact NE2-CE 3.45Å; H446-K450 PolarHBondContact NE2-NZ 2.95Å; H446-K450 WeakPolarHBondContact O-CG 3.17Å; H446-K450 PolarHBondContact O-N 3.18Å; H448-K450 VanDerWaalsContact C-N 3.34Å; H448-K450 PolarHBondContact O-N 2.86Å; K450-E454 CarbonylContact O-C 3.58Å; K450-E454 WeakPolarHBondContact O-CB 3.31Å; K450-G455 PolarHBondContact O-N 2.85Å; K450-L456 HydrophobicContact CB-CB 4.36Å; K450-L456 HydrophobicContact CB-CD1 4.42Å; K450-L456 HydrophobicContact CD-CD1 4.49Å; K450-L456 HydrophobicContact CG-CD1 4.27Å; K450-L456 WeakPolarHBondContact O-CB 3.32Å; K450-L456 PolarHBondContact O-N 3.31Å
451	V	91.3	Very high	90.8	Very high	24 Å²	24	70 Å²	70	15%	0.145	36%	0.363	C	S	.	.	I	π-helix	trans	-82	-41.5	-172.5	174.7	0	0	0	0	112.3	D447 H448 V449 S468	D447-V451 WeakPolarHBondContact O-CB 3.31Å; D447-V451 WeakPolarHBondContact O-CG2 3.28Å; D447-V451 PolarHBondContact O-N 2.77Å; D447-V451 VanDerWaalsContact O-N 3.13Å; H448-V451 PolarHBondContact O-N 2.87Å; V449-V451 VanDerWaalsContact C-N 3.32Å; V449-V451 PolarHBondContact O-N 3.42Å; V451-S468 WeakPolarHBondContact CG2-O 3.45Å
452	V	90.7	Very high	90.7	Very high	82 Å²	82	72.9 Å²	72.9	50%	0.497	38%	0.376	S	S	.	.	I	π-helix	trans	-91.1	-41.5	-170.6	178.5	0	0	0	0	111.6	H448	H448-V452 VanDerWaalsContact ND1-CG2 3.35Å; H448-V452 WeakPolarHBondContact ND1-CG2 3.43Å; H448-V452 WeakPolarHBondContact O-CB 3.34Å; H448-V452 PolarHBondContact O-N 3.26Å
453	H	92.3	Very high	90.7	Very high	57 Å²	57	70.6 Å²	70.6	26%	0.264	37%	0.37	S	S	.	.	I	π-helix	trans	-98.3	-37.5	-173.2	-66.4	-68	0	0	0	112.5	C432 Q434 C435 H448 V449	C432-H453 PolarHBondContact SG-NE2 3.45Å; C432-H453 VanDerWaalsContact SG-NE2 3.41Å; Q434-H453 WeakPolarHBondContact CB-CE1 3.35Å; Q434-H453 WeakPolarHBondContact CB-ND1 3.28Å; Q434-H453 PolarHBondContact O-CE1 3.18Å; Q434-H453 VanDerWaalsContact OE1-CB 3.25Å; Q434-H453 VanDerWaalsContact OE1-CG 3.32Å; Q434-H453 PolarHBondContact OE1-ND1 3.34Å; C435-H453 PolarHBondContact SG-NE2 3.2Å; H448-H453 AromaticContact CE1-NE2 3.88Å; H448-H453 AromaticContact NE2-CD2 3.8Å; H448-H453 AromaticContact NE2-NE2 3.48Å; H448-H453 PolarHBondContact NE2-NE2 3.3Å; V449-H453 HydrophobicContact CG1-CB 4.42Å; V449-H453 WeakPolarHBondContact O-CA 3.34Å; V449-H453 WeakPolarHBondContact O-CB 3.4Å; V449-H453 PolarHBondContact O-N 3.23Å
454	E	92	Very high	90.7	Very high	107 Å²	107	69.6 Å²	69.6	50%	0.5	37%	0.372	S	S	.	.	S	Bend	trans	-94.5	-7.1	177.6	-55.5	173.9	178.1	0	0	113.1	V449 K450 L456	V449-E454 HydrophobicContact CG1-CG 4.49Å; V449-E454 PolarHBondContact O-N 2.99Å; K450-E454 CarbonylContact O-C 3.58Å; K450-E454 WeakPolarHBondContact O-CB 3.31Å; E454-L456 HydrophobicContact CB-CD1 4.25Å; E454-L456 HydrophobicContact CB-CG 3.91Å; E454-L456 PolarHBondContact O-N 2.92Å; E454-L456 VanDerWaalsContact O-N 3.1Å; E454-L456 WeakPolarHBondContact OE2-CD1 3.48Å
455	G	88.3	Confident	90.6	Very high	52 Å²	52	73 Å²	73	54%	0.536	38%	0.382	S	S	.	.			trans	64.5	11.4	-178.9	0	0	0	0	0	115	K450 R457	K450-G455 PolarHBondContact O-N 2.85Å; G455-R457 PolarHBondContact O-N 3.39Å
456	L	89.1	Confident	90.4	Very high	91 Å²	91	74.9 Å²	74.9	48%	0.476	40%	0.396	S	S	.	.			trans	-71.2	116.1	-178.1	-61.5	-179.2	0	0	0	110.5	K450 E454	K450-L456 HydrophobicContact CB-CB 4.36Å; K450-L456 HydrophobicContact CB-CD1 4.42Å; K450-L456 HydrophobicContact CD-CD1 4.49Å; K450-L456 HydrophobicContact CG-CD1 4.27Å; K450-L456 WeakPolarHBondContact O-CB 3.32Å; K450-L456 PolarHBondContact O-N 3.31Å; E454-L456 HydrophobicContact CB-CD1 4.25Å; E454-L456 HydrophobicContact CB-CG 3.91Å; E454-L456 PolarHBondContact O-N 2.92Å; E454-L456 VanDerWaalsContact O-N 3.1Å; E454-L456 WeakPolarHBondContact OE2-CD1 3.48Å
457	R	89	Confident	90.2	Very high	137 Å²	137	72.4 Å²	72.4	52%	0.517	38%	0.384	S	S	.	.			trans	-121	153.2	175.1	-55.6	-172.4	74.8	94.8	-4.1	110.9	G455 S466	G455-R457 PolarHBondContact O-N 3.39Å; R457-S466 PolarHBondContact NE-O 3.26Å; R457-S466 PolarHBondContact NH2-O 3.33Å; R457-S466 VanDerWaalsContact NH2-O 3.1Å
458	Y	88.2	Confident	90	Very high	77 Å²	77	71.6 Å²	71.6	30%	0.302	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	105.5	175.4	-62.2	-85.8	0	0	0	109.2	S466 F467 T469 K470	Y458-S466 WeakPolarHBondContact O-CA 3.25Å; Y458-F467 PolarHBondContact N-O 3.36Å; Y458-F467 PolarHBondContact O-N 3.21Å; Y458-T469 VanDerWaalsContact CD2-C 3.47Å; Y458-K470 HydrophobicContact CD1-CB 4.22Å; Y458-K470 HydrophobicContact CE1-CB 4.06Å; Y458-K470 HydrophobicContact CE2-CB 4.49Å; Y458-K470 HydrophobicContact CG-CB 4.48Å
459	S	90	Very high	89.7	Confident	68 Å²	68	72 Å²	72	48%	0.476	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	140.7	177.6	52.2	0	0	0	0	112	K465	S459-K465 CarbonylContact C-O 3.6Å
460	C	92	Very high	89.4	Confident	3 Å²	3	76 Å²	76	2%	0.02	40%	0.402	C	S	.	.			trans	-78.5	124.8	167.9	-177.3	0	0	0	0	109.6	F462 C463 G464 K465 F467 L473 H481	C460-F462 PolarHBondContact O-N 3.43Å; C460-C463 VanDerWaalsContact SG-SG 3.69Å; C460-G464 VanDerWaalsContact O-CA 3.28Å; C460-G464 WeakPolarHBondContact O-CA 3.48Å; C460-G464 PolarHBondContact O-N 2.8Å; C460-K465 WeakPolarHBondContact CB-O 3.42Å; C460-K465 PolarHBondContact N-O 3.39Å; C460-F467 HydrophobicContact CB-CE2 4.32Å; C460-L473 HydrophobicContact CB-CD1 3.63Å; C460-H481 PolarHBondContact SG-CD2 3.48Å; C460-H481 PolarHBondContact SG-NE2 3.15Å
461	Q	90.6	Very high	89.3	Confident	187 Å²	187	81 Å²	81	87%	0.874	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-22.2	179.9	-65.9	-179.2	-8.7	0	0	113.1
462	F	88.6	Confident	89.2	Confident	144 Å²	144	86 Å²	86	63%	0.632	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-27.3	-178	-57.4	-71.1	0	0	0	113.8	C460 V477 H481	C460-F462 PolarHBondContact O-N 3.43Å; F462-V477 HydrophobicContact CD2-CG1 4.38Å; F462-V477 HydrophobicContact CE2-CG1 3.99Å; F462-H481 HydrophobicContact CB-CB 4.43Å; F462-H481 HydrophobicContact CD2-CB 3.77Å; F462-H481 AromaticContact CD2-CD2 3.71Å; F462-H481 AromaticContact CD2-CG 3.72Å; F462-H481 HydrophobicContact CE2-CB 4.23Å; F462-H481 HydrophobicContact CG-CB 4.13Å; F462-H481 AromaticContact CG-CG 3.88Å
463	C	92.4	Very high	89.3	Confident	54 Å²	54	83.4 Å²	83.4	37%	0.365	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.9	4.3	-175.4	71.5	0	0	0	0	115.3	C460 K465 H476	C460-C463 VanDerWaalsContact SG-SG 3.69Å; C463-K465 PolarHBondContact O-N 3.47Å; C463-H476 PolarHBondContact SG-NE2 2.85Å
464	G	87.8	Confident	89.2	Confident	51 Å²	51	87.9 Å²	87.9	53%	0.526	44%	0.439	S	S	.	.			trans	72.6	-11.6	179.3	0	0	0	0	0	115.9	C460 S466	C460-G464 VanDerWaalsContact O-CA 3.28Å; C460-G464 WeakPolarHBondContact O-CA 3.48Å; C460-G464 PolarHBondContact O-N 2.8Å; G464-S466 PolarHBondContact O-N 2.97Å; G464-S466 PolarHBondContact O-OG 3.1Å
465	K	90.4	Very high	89.2	Confident	125 Å²	125	88.8 Å²	88.8	54%	0.543	44%	0.441	S	S	.	.			trans	-57.4	134.3	179.9	-70.1	-177.4	-178.9	179.9	0	111.2	S459 C460 C463 F467	S459-K465 CarbonylContact C-O 3.6Å; C460-K465 WeakPolarHBondContact CB-O 3.42Å; C460-K465 PolarHBondContact N-O 3.39Å; C463-K465 PolarHBondContact O-N 3.47Å; K465-F467 HydrophobicContact CB-CE2 3.82Å; K465-F467 HydrophobicContact CB-CZ 3.95Å; K465-F467 WeakPolarHBondContact O-CE2 3.35Å
466	S	88	Confident	89.4	Confident	55 Å²	55	87.2 Å²	87.2	39%	0.385	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127.4	-172.4	-72.1	0	0	0	0	113.5	R457 Y458 G464	R457-S466 PolarHBondContact NE-O 3.26Å; R457-S466 PolarHBondContact NH2-O 3.33Å; R457-S466 VanDerWaalsContact NH2-O 3.1Å; Y458-S466 WeakPolarHBondContact O-CA 3.25Å; G464-S466 PolarHBondContact O-N 2.97Å; G464-S466 PolarHBondContact O-OG 3.1Å
467	F	88.3	Confident	89.5	Confident	44 Å²	44	84.1 Å²	84.1	19%	0.193	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	151.6	-171.8	-59.1	-90	0	0	0	112.3	Y458 C460 K465 L473 H476	Y458-F467 PolarHBondContact N-O 3.36Å; Y458-F467 PolarHBondContact O-N 3.21Å; C460-F467 HydrophobicContact CB-CE2 4.32Å; K465-F467 HydrophobicContact CB-CE2 3.82Å; K465-F467 HydrophobicContact CB-CZ 3.95Å; K465-F467 WeakPolarHBondContact O-CE2 3.35Å; F467-L473 HydrophobicContact CB-CB 4.21Å; F467-L473 HydrophobicContact CD2-CB 3.95Å; F467-L473 HydrophobicContact CD2-CD1 3.71Å; F467-L473 HydrophobicContact CD2-CG 4.43Å; F467-L473 HydrophobicContact CE2-CD1 3.93Å; F467-L473 HydrophobicContact CG-CB 4.25Å; F467-H476 HydrophobicContact CE1-CB 3.81Å; F467-H476 HydrophobicContact CE2-CB 3.88Å; F467-H476 AromaticContact CE2-CD2 3.45Å; F467-H476 VanDerWaalsContact CE2-CD2 3.45Å; F467-H476 WeakPolarHBondContact CE2-CD2 3.49Å; F467-H476 AromaticContact CE2-CG 3.69Å; F467-H476 HydrophobicContact CZ-CB 3.38Å; F467-H476 AromaticContact CZ-CD2 3.46Å; F467-H476 VanDerWaalsContact CZ-CD2 3.46Å; F467-H476 WeakPolarHBondContact CZ-CD2 3.33Å; F467-H476 AromaticContact CZ-CG 3.21Å; F467-H476 AromaticContact CZ-ND1 3.81Å
468	S	85.5	Confident	89.6	Confident	42 Å²	42	84.7 Å²	84.7	29%	0.294	41%	0.406	S	S	.	.	S	Bend	trans	-71.1	-29.8	178.9	54	0	0	0	0	113.6	V451	V451-S468 WeakPolarHBondContact CG2-O 3.45Å
469	T	85.2	Confident	89.8	Confident	25 Å²	25	86 Å²	86	15%	0.153	42%	0.419	C	S	.	.	S	Bend	trans	-133.6	151.7	179.3	74	0	0	0	0	111.7	Y458 K471 Y472 L473	Y458-T469 VanDerWaalsContact CD2-C 3.47Å; T469-K471 PolarHBondContact O-N 3.39Å; T469-Y472 HydrophobicContact CG2-CD2 4.32Å; T469-Y472 PolarHBondContact O-N 3.13Å; T469-Y472 VanDerWaalsContact O-N 3.12Å; T469-Y472 WeakPolarHBondContact OG1-CD2 3.33Å; T469-Y472 PolarHBondContact OG1-N 3.16Å; T469-L473 PolarHBondContact O-N 2.93Å; T469-L473 VanDerWaalsContact O-N 3.13Å
470	K	87.2	Confident	89.8	Confident	113 Å²	113	87.5 Å²	87.5	49%	0.491	42%	0.421	S	S	.	.	H	α-helix	trans	-58.8	-27.4	174.1	-167.1	168.6	-172.7	166.3	0	112.6	Y458 R474	Y458-K470 HydrophobicContact CD1-CB 4.22Å; Y458-K470 HydrophobicContact CE1-CB 4.06Å; Y458-K470 HydrophobicContact CE2-CB 4.49Å; Y458-K470 HydrophobicContact CG-CB 4.48Å; K470-R474 WeakPolarHBondContact O-CB 3.4Å; K470-R474 VanDerWaalsContact O-CG 3.31Å; K470-R474 WeakPolarHBondContact O-CG 3.34Å; K470-R474 PolarHBondContact O-N 3.07Å
471	K	88.5	Confident	89.6	Confident	163 Å²	163	90.2 Å²	90.2	71%	0.709	43%	0.434	S	S	*	.	H	α-helix	trans	-65.1	-47.1	175.5	-178.4	-177.8	175.2	-175.1	0	111.3	T469 R474 K475	T469-K471 PolarHBondContact O-N 3.39Å; K471-R474 PolarHBondContact O-N 2.86Å; K471-K475 PolarHBondContact O-N 3.49Å
472	Y	90.2	Very high	89.2	Confident	129 Å²	129	86.8 Å²	86.8	51%	0.506	42%	0.418	S	S	.	.	H	α-helix	trans	-67.4	-40.3	178.2	-70.7	-58.6	0	0	0	112	T469 R474 K475 H476	T469-Y472 HydrophobicContact CG2-CD2 4.32Å; T469-Y472 PolarHBondContact O-N 3.13Å; T469-Y472 VanDerWaalsContact O-N 3.12Å; T469-Y472 WeakPolarHBondContact OG1-CD2 3.33Å; T469-Y472 PolarHBondContact OG1-N 3.16Å; Y472-R474 PolarHBondContact O-N 3.02Å; Y472-K475 PolarHBondContact O-N 3.32Å; Y472-H476 WeakPolarHBondContact O-CB 3.38Å; Y472-H476 PolarHBondContact O-N 3.14Å
473	L	91.6	Very high	88.2	Confident	27 Å²	27	91 Å²	91	14%	0.141	43%	0.43	C	S	.	.	H	α-helix	trans	-57.8	-47.6	172.8	173.2	61.3	0	0	0	111.5	C460 F467 T469 K475 H476 V477	C460-L473 HydrophobicContact CB-CD1 3.63Å; F467-L473 HydrophobicContact CB-CB 4.21Å; F467-L473 HydrophobicContact CD2-CB 3.95Å; F467-L473 HydrophobicContact CD2-CD1 3.71Å; F467-L473 HydrophobicContact CD2-CG 4.43Å; F467-L473 HydrophobicContact CE2-CD1 3.93Å; F467-L473 HydrophobicContact CG-CB 4.25Å; T469-L473 PolarHBondContact O-N 2.93Å; T469-L473 VanDerWaalsContact O-N 3.13Å; L473-K475 PolarHBondContact O-N 3.46Å; L473-H476 WeakPolarHBondContact O-CB 3.47Å; L473-H476 PolarHBondContact O-N 2.99Å; L473-V477 HydrophobicContact CD1-CG2 3.92Å; L473-V477 HydrophobicContact CG-CG2 4.39Å; L473-V477 WeakPolarHBondContact O-CG2 3.36Å; L473-V477 PolarHBondContact O-N 3.5Å
474	R	91	Very high	86.3	Confident	151 Å²	151	97 Å²	97	57%	0.57	45%	0.452	S	S	*	.	H	α-helix	trans	-60.8	-42.8	177.8	-77.2	175.8	177	171.1	-2.1	112.8	K470 K471 Y472 H476 V477 R478	K470-R474 WeakPolarHBondContact O-CB 3.4Å; K470-R474 VanDerWaalsContact O-CG 3.31Å; K470-R474 WeakPolarHBondContact O-CG 3.34Å; K470-R474 PolarHBondContact O-N 3.07Å; K471-R474 PolarHBondContact O-N 2.86Å; Y472-R474 PolarHBondContact O-N 3.02Å; R474-H476 VanDerWaalsContact C-N 3.31Å; R474-V477 PolarHBondContact O-N 3.35Å; R474-R478 WeakPolarHBondContact O-CB 3.47Å; R474-R478 PolarHBondContact O-N 3.09Å
475	K	92.1	Very high	84.1	Confident	126 Å²	126	104 Å²	104	55%	0.548	47%	0.471	S	S	.	.	H	α-helix	trans	-62.2	-41.4	175.7	-174.4	-177.7	178	-175	0	110.8	K471 Y472 L473 N479	K471-K475 PolarHBondContact O-N 3.49Å; Y472-K475 PolarHBondContact O-N 3.32Å; L473-K475 PolarHBondContact O-N 3.46Å; K475-N479 WeakPolarHBondContact O-CB 3.45Å; K475-N479 VanDerWaalsContact O-CG 3.28Å; K475-N479 PolarHBondContact O-N 2.9Å; K475-N479 PolarHBondContact O-OD1 3.32Å
476	H	91.8	Very high	81.5	Confident	19 Å²	19	106.5 Å²	106.5	9%	0.088	51%	0.505	C	S	.	.	H	α-helix	trans	-62.2	-50.3	175.8	168	64.1	0	0	0	111.8	C463 F467 Y472 L473 R474 R478 N479 N480 H481	C463-H476 PolarHBondContact SG-NE2 2.85Å; F467-H476 HydrophobicContact CE1-CB 3.81Å; F467-H476 HydrophobicContact CE2-CB 3.88Å; F467-H476 AromaticContact CE2-CD2 3.45Å; F467-H476 VanDerWaalsContact CE2-CD2 3.45Å; F467-H476 WeakPolarHBondContact CE2-CD2 3.49Å; F467-H476 AromaticContact CE2-CG 3.69Å; F467-H476 HydrophobicContact CZ-CB 3.38Å; F467-H476 AromaticContact CZ-CD2 3.46Å; F467-H476 VanDerWaalsContact CZ-CD2 3.46Å; F467-H476 WeakPolarHBondContact CZ-CD2 3.33Å; F467-H476 AromaticContact CZ-CG 3.21Å; F467-H476 AromaticContact CZ-ND1 3.81Å; Y472-H476 WeakPolarHBondContact O-CB 3.38Å; Y472-H476 PolarHBondContact O-N 3.14Å; L473-H476 WeakPolarHBondContact O-CB 3.47Å; L473-H476 PolarHBondContact O-N 2.99Å; R474-H476 VanDerWaalsContact C-N 3.31Å; H476-R478 PolarHBondContact O-N 2.98Å; H476-N479 PolarHBondContact O-N 3.09Å; H476-N480 PolarHBondContact ND1-ND2 2.9Å; H476-N480 VanDerWaalsContact ND1-ND2 3.16Å; H476-N480 WeakPolarHBondContact O-CB 3.36Å; H476-N480 PolarHBondContact O-N 3.1Å; H476-N480 PolarHBondContact O-ND2 2.83Å; H476-H481 AromaticContact CD2-NE2 3.99Å; H476-H481 AromaticContact CE1-NE2 3.71Å; H476-H481 AromaticContact NE2-CD2 3.72Å; H476-H481 AromaticContact NE2-NE2 3.12Å; H476-H481 PolarHBondContact NE2-NE2 3.4Å; H476-H481 VanDerWaalsContact NE2-NE2 3.12Å
477	V	91.9	Very high	81.2	Confident	26 Å²	26	109.1 Å²	109.1	16%	0.158	51%	0.511	C	S	.	.	H	α-helix	trans	-58.2	-48.3	179.1	172.3	0	0	0	0	111.1	F462 L473 R474 N479 N480 H481 E482	F462-V477 HydrophobicContact CD2-CG1 4.38Å; F462-V477 HydrophobicContact CE2-CG1 3.99Å; L473-V477 HydrophobicContact CD1-CG2 3.92Å; L473-V477 HydrophobicContact CG-CG2 4.39Å; L473-V477 WeakPolarHBondContact O-CG2 3.36Å; L473-V477 PolarHBondContact O-N 3.5Å; R474-V477 PolarHBondContact O-N 3.35Å; V477-N479 PolarHBondContact O-N 3.01Å; V477-N480 PolarHBondContact O-N 2.96Å; V477-H481 HydrophobicContact CG1-CB 4.38Å; V477-H481 WeakPolarHBondContact O-CA 3.47Å; V477-H481 WeakPolarHBondContact O-CB 3.39Å; V477-H481 PolarHBondContact O-N 3.26Å; V477-E482 HydrophobicContact CG1-CG 4.32Å; V477-E482 PolarHBondContact O-N 3.38Å
478	R	90.9	Very high	80.8	Confident	149 Å²	149	112.5 Å²	112.5	56%	0.562	53%	0.527	S	S	*	.	H	α-helix	trans	-56.7	-47.8	176	-175.7	179.2	-55	149.4	3.1	113.1	R474 H476 N480 E482	R474-R478 WeakPolarHBondContact O-CB 3.47Å; R474-R478 PolarHBondContact O-N 3.09Å; H476-R478 PolarHBondContact O-N 2.98Å; R478-N480 PolarHBondContact O-N 3.05Å; R478-E482 WeakPolarHBondContact CA-OE2 3.46Å; R478-E482 WeakPolarHBondContact CB-OE2 3.46Å; R478-E482 WeakPolarHBondContact CG-OE2 3.41Å
479	N	91.7	Very high	80.5	Confident	105 Å²	105	116.4 Å²	116.4	56%	0.561	54%	0.54	S	S	*	.	H	α-helix	trans	-81	-15.6	-172.4	-69.9	19.1	0	0	0	114.1	K475 H476 V477	K475-N479 WeakPolarHBondContact O-CB 3.45Å; K475-N479 VanDerWaalsContact O-CG 3.28Å; K475-N479 PolarHBondContact O-N 2.9Å; K475-N479 PolarHBondContact O-OD1 3.32Å; H476-N479 PolarHBondContact O-N 3.09Å; V477-N479 PolarHBondContact O-N 3.01Å
480	N	89.3	Confident	80.3	Confident	99 Å²	99	121.8 Å²	121.8	53%	0.529	56%	0.563	S	S	.	*	H	α-helix	trans	-125	-22.7	-170.7	-62.6	-102	0	0	0	113.7	H476 V477 R478	H476-N480 PolarHBondContact ND1-ND2 2.9Å; H476-N480 VanDerWaalsContact ND1-ND2 3.16Å; H476-N480 WeakPolarHBondContact O-CB 3.36Å; H476-N480 PolarHBondContact O-N 3.1Å; H476-N480 PolarHBondContact O-ND2 2.83Å; V477-N480 PolarHBondContact O-N 2.96Å; R478-N480 PolarHBondContact O-N 3.05Å
481	H	89.4	Confident	79.8	Confident	61 Å²	61	122.4 Å²	122.4	28%	0.282	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-125.3	-27.1	-173.3	-57	-56.1	0	0	0	113.2	C460 F462 H476 V477 R483	C460-H481 PolarHBondContact SG-CD2 3.48Å; C460-H481 PolarHBondContact SG-NE2 3.15Å; F462-H481 HydrophobicContact CB-CB 4.43Å; F462-H481 HydrophobicContact CD2-CB 3.77Å; F462-H481 AromaticContact CD2-CD2 3.71Å; F462-H481 AromaticContact CD2-CG 3.72Å; F462-H481 HydrophobicContact CE2-CB 4.23Å; F462-H481 HydrophobicContact CG-CB 4.13Å; F462-H481 AromaticContact CG-CG 3.88Å; H476-H481 AromaticContact CD2-NE2 3.99Å; H476-H481 AromaticContact CE1-NE2 3.71Å; H476-H481 AromaticContact NE2-CD2 3.72Å; H476-H481 AromaticContact NE2-NE2 3.12Å; H476-H481 PolarHBondContact NE2-NE2 3.4Å; H476-H481 VanDerWaalsContact NE2-NE2 3.12Å; V477-H481 HydrophobicContact CG1-CB 4.38Å; V477-H481 WeakPolarHBondContact O-CA 3.47Å; V477-H481 WeakPolarHBondContact O-CB 3.39Å; V477-H481 PolarHBondContact O-N 3.26Å; H481-R483 PolarHBondContact O-N 2.92Å
482	E	81.8	Confident	79.3	Confident	114 Å²	114	119.7 Å²	119.7	53%	0.533	56%	0.558	S	S	.	*			trans	-81.3	92.2	168	-61.9	174.2	178.4	0	0	107.4	V477 R478 E484	V477-E482 HydrophobicContact CG1-CG 4.32Å; V477-E482 PolarHBondContact O-N 3.38Å; R478-E482 WeakPolarHBondContact CA-OE2 3.46Å; R478-E482 WeakPolarHBondContact CB-OE2 3.46Å; R478-E482 WeakPolarHBondContact CG-OE2 3.41Å; E482-E484 PolarHBondContact O-N 3.48Å
483	R	67.6	Low	78.5	Confident	234 Å²	234	119 Å²	119	88%	0.883	56%	0.562	S	S	*	*			trans	-67.7	123.8	164.3	-69.7	-176.5	-179.2	-175.2	-0.1	106.7	H481 E485	H481-R483 PolarHBondContact O-N 2.92Å; R483-E485 VanDerWaalsContact C-N 3.32Å; R483-E485 PolarHBondContact O-N 3.43Å
484	E	53	Low	77.5	Confident	179 Å²	179	126.1 Å²	126.1	84%	0.836	59%	0.594	S	S	*	*			trans	-62.7	97.9	168.8	-68.3	-175.1	161.9	0	0	107.4	E482 S486	E482-E484 PolarHBondContact O-N 3.48Å; E484-S486 VanDerWaalsContact C-N 3.31Å; E484-S486 PolarHBondContact O-N 3.34Å
485	E	41.2	Very low	76.4	Confident	197 Å²	197	124 Å²	124	92%	0.921	60%	0.596	S	S	*	*			trans	-64.6	102	158.3	-73.9	-175.4	162.6	0	0	105.9	R483	R483-E485 VanDerWaalsContact C-N 3.32Å; R483-E485 PolarHBondContact O-N 3.43Å
486	S	35.6	Very low	74.9	Confident	179 Å²	179	123.8 Å²	123.8	100%	1.252	60%	0.601	S	S	*	*			trans	-89	0	168.7	-49	0	0	0	0	109	E484	E484-S486 VanDerWaalsContact C-N 3.31Å; E484-S486 PolarHBondContact O-N 3.34Å

Retrieved 486 of 486 residues in 166.3 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).