A0A087YCS8_POEFO Loading...

Matrix metallopeptidase 23B

AlphaFold DB , UniProt , Accession A0A087YCS8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 406 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.6	Very low	25.3	Very low	246 Å²	246	165.4 Å²	165.4	100%	1.212	83%	0.832	S	S	*	*				0	100.1	0	-84.9	-174.3	-100.4	0	0	108.6
2	V	23.5	Very low	25.2	Very low	153 Å²	153	170.8 Å²	170.8	93%	0.927	84%	0.838	S	S	*	*			trans	-149.6	125.3	162	-175.2	0	0	0	0	106.2
3	G	20	Very low	25.2	Very low	60 Å²	60	173.5 Å²	173.5	62%	0.619	84%	0.843	S	S	*	*			trans	-85.9	176.5	-170.1	0	0	0	0	0	115.1
4	P	26.3	Very low	25.3	Very low	118 Å²	118	169.1 Å²	169.1	77%	0.766	84%	0.835	S	S	*	*			trans	-87.4	132.3	-174.2	33.6	-30	0	0	0	111.7
5	F	23.8	Very low	25.4	Very low	210 Å²	210	170.3 Å²	170.3	92%	0.921	83%	0.833	S	S	*	*			trans	-86.6	109.5	167.7	-99.3	-91.1	0	0	0	109.8
6	F	24.8	Very low	25.5	Very low	194 Å²	194	167.4 Å²	167.4	85%	0.851	83%	0.833	S	S	*	*			trans	-87.6	138.6	155	-93.8	-93.3	0	0	0	108.4
7	A	24.7	Very low	25.4	Very low	86 Å²	86	166.3 Å²	166.3	71%	0.711	83%	0.831	S	S	*	*			trans	-127.6	100.5	159.6	0	0	0	0	0	109.2
8	D	23.8	Very low	25.5	Very low	126 Å²	126	164 Å²	164	67%	0.674	83%	0.833	S	S	*	*			trans	-62.4	126.6	158.4	179.8	5.3	0	0	0	108.6	R10	D8-R10 PolarHBondContact OD1-N 2.92Å
9	R	27.3	Very low	25.5	Very low	227 Å²	227	160.7 Å²	160.7	86%	0.857	83%	0.834	S	S	*	*			trans	-137	83.8	161	-90.2	-167.7	-110.8	-145.4	-1.3	110.9
10	R	27.3	Very low	25.6	Very low	212 Å²	212	158 Å²	158	80%	0.8	84%	0.836	S	S	*	*			trans	-74.7	141.9	140.1	-88.2	-176.4	-86	-171.8	-6.7	110.2	D8	D8-R10 PolarHBondContact OD1-N 2.92Å
11	K	27.7	Very low	25.6	Very low	187 Å²	187	155.3 Å²	155.3	81%	0.813	84%	0.836	S	S	*	*			trans	88.9	102.4	176	-61.1	178.9	177.2	178.8	0	114.9
12	Y	24.1	Very low	25.4	Very low	231 Å²	231	152.2 Å²	152.2	91%	0.906	82%	0.821	S	S	*	*				-171	98.2	112.8	-94.8	-77.4	0	0	0	107.3
13	F	25.4	Very low	25.5	Very low	206 Å²	206	151.2 Å²	151.2	90%	0.904	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-94.2	126.6	162.5	-84.8	-86.1	0	0	0	107.2
14	P	27.6	Very low	25.7	Very low	112 Å²	112	153.9 Å²	153.9	73%	0.727	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-80.9	128	155.1	28.4	-21.6	0	0	0	108.8
15	K	25.7	Very low	25.5	Very low	187 Å²	187	154.3 Å²	154.3	81%	0.813	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-63.6	128.6	162.9	-75.1	176.6	172.2	-177.8	0	108.1
16	C	26.9	Very low	25.5	Very low	123 Å²	123	147.9 Å²	147.9	83%	0.831	82%	0.821	S	S	*	*			trans	-107.1	101.3	159.6	-75.5	0	0	0	0	107.5
17	D	24.9	Very low	25.7	Very low	149 Å²	149	144.9 Å²	144.9	80%	0.797	82%	0.819	S	S	*	*			trans	-71.3	137.9	166.1	-78.2	-40.4	0	0	0	109.3
18	S	26.1	Very low	26.3	Very low	125 Å²	125	146.9 Å²	146.9	87%	0.874	83%	0.825	S	S	*	*			trans	-75.8	124.1	172.8	-60.7	0	0	0	0	109.8
19	A	26.6	Very low	26.4	Very low	102 Å²	102	144.5 Å²	144.5	84%	0.843	83%	0.83	S	S	*	*			trans	-155.6	116.6	154.6	0	0	0	0	0	110
20	A	26.3	Very low	26.3	Very low	106 Å²	106	137.2 Å²	137.2	88%	0.876	83%	0.825	S	S	*	*			trans	-73.1	139.8	168.5	0	0	0	0	0	110.6
21	A	26.1	Very low	26.3	Very low	101 Å²	101	134.2 Å²	134.2	84%	0.835	82%	0.824	S	S	*	*			trans	-168.5	134.1	144.3	0	0	0	0	0	110.7
22	M	23.4	Very low	26.2	Very low	181 Å²	181	135.7 Å²	135.7	89%	0.892	83%	0.825	S	S	*	*			trans	-57.1	155.7	172.5	-67.5	170.3	172.1	0	0	113.2
23	V	26	Very low	26.4	Very low	132 Å²	132	129.9 Å²	129.9	80%	0.8	82%	0.818	S	S	*	*				164.5	128.9	111.7	162.2	0	0	0	0	111.6
24	S	24.8	Very low	26.4	Very low	116 Å²	116	123.5 Å²	123.5	81%	0.811	81%	0.811	S	S	*	*			trans	37.4	124.5	153.5	-63.8	0	0	0	0	123.4
25	C	22.2	Very low	26.5	Very low	128 Å²	128	124.8 Å²	124.8	87%	0.865	81%	0.811	S	S	*	*			trans	-83.4	131.6	160.9	-160.1	0	0	0	0	110.2
26	G	23.9	Very low	26.5	Very low	75 Å²	75	126.2 Å²	126.2	77%	0.773	81%	0.812	S	S	*	*			trans	-138.4	110.5	164.9	0	0	0	0	0	109.4
27	T	29.1	Very low	26.4	Very low	130 Å²	130	125 Å²	125	80%	0.798	80%	0.804	S	S	*	*			trans	-76.5	163.4	156.2	42.1	0	0	0	0	109.2
28	P	38	Very low	26.5	Very low	129 Å²	129	123.6 Å²	123.6	84%	0.838	81%	0.805	S	S	*	*			cis	-151.8	177.2	35.2	39	-16.5	0	0	0	118
29	G	24.6	Very low	26.7	Very low	76 Å²	76	122 Å²	122	78%	0.784	80%	0.8	S	S	*	*				123.3	113.7	128.4	0	0	0	0	0	120.5
30	G	25.5	Very low	27.5	Very low	73 Å²	73	122.5 Å²	122.5	75%	0.753	79%	0.794	S	S	*	*			trans	72.5	158	137.2	0	0	0	0	0	119.1
31	L	26.8	Very low	27.8	Very low	149 Å²	149	124.7 Å²	124.7	78%	0.78	79%	0.79	S	S	*	*			cis	-176.3	154.4	-16.9	-148.8	82.5	0	0	0	106
32	R	27	Very low	27.9	Very low	218 Å²	218	127.2 Å²	127.2	82%	0.823	79%	0.789	S	S	*	*			trans	74.9	131	158.8	-69.4	175.4	170.4	-155.3	-4.8	118.3
33	S	27.6	Very low	28.4	Very low	110 Å²	110	124.2 Å²	124.2	77%	0.769	78%	0.781	S	S	*	*			cis	107.4	121.8	26.1	73.3	0	0	0	0	112.8
34	G	25.6	Very low	28.6	Very low	72 Å²	72	122.9 Å²	122.9	74%	0.742	78%	0.784	S	S	*	*			trans	109.6	148.9	151.2	0	0	0	0	0	115.4
35	D	29.2	Very low	28.8	Very low	138 Å²	138	122.5 Å²	122.5	74%	0.738	79%	0.788	S	S	*	*			cis	-179.7	157.1	-17.9	-135.8	-1.2	0	0	0	105.6
36	W	26.7	Very low	29.1	Very low	218 Å²	218	123.9 Å²	123.9	83%	0.826	79%	0.786	S	S	*	*			trans	83.7	147.3	155.5	-60.1	17.5	0	0	0	119.2
37	C	25	Very low	29.4	Very low	98 Å²	98	127.5 Å²	127.5	66%	0.662	79%	0.787	S	S	*	*			cis	-172.1	158.6	-16.4	-106.7	0	0	0	0	108.3
38	S	27.1	Very low	29.3	Very low	118 Å²	118	126.2 Å²	126.2	83%	0.825	78%	0.783	S	S	*	*			trans	69.6	114.8	146.7	44.2	0	0	0	0	122.6
39	A	30.3	Very low	28.9	Very low	93 Å²	93	128.8 Å²	128.8	77%	0.769	79%	0.789	S	S	*	*			trans	-78.4	168.7	143	0	0	0	0	0	110.1
40	P	42.9	Very low	29.1	Very low	112 Å²	112	131.9 Å²	131.9	73%	0.727	79%	0.787	S	S	*	*				-157.9	164.6	77	37.9	-15.1	0	0	0	119.7
41	L	31.1	Very low	29.2	Very low	151 Å²	151	137.4 Å²	137.4	79%	0.791	79%	0.79	S	S	*	*			trans	62.8	133.7	138.5	-68.5	163	0	0	0	125
42	L	28.9	Very low	29.2	Very low	155 Å²	155	135.4 Å²	135.4	81%	0.812	80%	0.795	S	S	*	*				165	100.9	121.3	-84.6	163.9	0	0	0	110.8
43	T	33.2	Very low	29.2	Very low	117 Å²	117	129 Å²	129	72%	0.718	80%	0.797	S	S	*	*				79	113.3	94.7	57.2	0	0	0	0	119.4
44	A	30.9	Very low	29.2	Very low	104 Å²	104	131.3 Å²	131.3	86%	0.86	80%	0.797	S	S	*	*			trans	59	128.3	130.6	0	0	0	0	0	124
45	A	28.7	Very low	29.2	Very low	108 Å²	108	135.5 Å²	135.5	89%	0.893	80%	0.797	S	S	*	*				-168.4	134.1	129.5	0	0	0	0	0	112.1
46	L	30.1	Very low	29.1	Very low	158 Å²	158	135.4 Å²	135.4	83%	0.827	80%	0.796	S	S	*	*			trans	-126.2	144.4	175.7	-106.4	165	0	0	0	109.5
47	L	29.7	Very low	29	Very low	150 Å²	150	130.3 Å²	130.3	79%	0.785	79%	0.789	S	S	*	*			trans	64.4	119.3	151.6	-80.2	146.7	0	0	0	120.7
48	S	25.8	Very low	29.1	Very low	104 Å²	104	131.9 Å²	131.9	73%	0.727	80%	0.796	S	S	*	*				160.6	128.1	108.9	-66.6	0	0	0	0	111.7
49	L	29.6	Very low	28.9	Very low	183 Å²	183	131 Å²	131	96%	0.958	80%	0.796	S	S	*	*			trans	-178.8	125	133	-98.2	150.8	0	0	0	111.3
50	L	29.3	Very low	28.8	Very low	140 Å²	140	136.3 Å²	136.3	73%	0.733	80%	0.802	S	S	*	*			trans	-112.3	157.9	177.2	-98.7	159.9	0	0	0	109.3
51	F	27.1	Very low	28.1	Very low	189 Å²	189	136.3 Å²	136.3	83%	0.829	80%	0.802	S	S	*	*			trans	84.9	110.3	161.9	-60	-71.6	0	0	0	119.4
52	A	27.2	Very low	27.7	Very low	107 Å²	107	133.3 Å²	133.3	88%	0.884	79%	0.794	S	S	*	*				168.8	132.5	97.1	0	0	0	0	0	110.8
53	G	27.6	Very low	27.3	Very low	83 Å²	83	136.3 Å²	136.3	86%	0.856	80%	0.795	S	S	*	*			trans	157.4	61	170.9	0	0	0	0	0	114.7
54	M	26.6	Very low	26.8	Very low	159 Å²	159	141.3 Å²	141.3	78%	0.783	80%	0.8	S	S	*	*			trans	-83.5	138.4	165.1	-70.1	-179.7	68.2	0	0	110.7
55	H	27.2	Very low	26.9	Very low	160 Å²	160	143.9 Å²	143.9	74%	0.741	80%	0.799	S	S	*	*			trans	143.1	132.2	131.6	-77	-65.7	0	0	0	108.5
56	L	25.2	Very low	26.8	Very low	136 Å²	136	148.1 Å²	148.1	71%	0.712	80%	0.8	S	S	*	*			cis	-169.1	131.3	30.6	-142.9	86.4	0	0	0	104
57	T	25.6	Very low	26.6	Very low	112 Å²	112	148.8 Å²	148.8	69%	0.687	80%	0.799	S	S	*	*				175.1	134.5	85.7	32.9	0	0	0	0	111
58	T	26.4	Very low	26.4	Very low	130 Å²	130	150.1 Å²	150.1	80%	0.798	80%	0.801	S	S	*	*			trans	66.8	92.2	147.1	61.4	0	0	0	0	121.6
59	A	23.8	Very low	26.5	Very low	100 Å²	100	148.7 Å²	148.7	83%	0.826	80%	0.795	S	S	*	*				74.4	106.2	116	0	0	0	0	0	121.4
60	F	27.8	Very low	26.3	Very low	204 Å²	204	147.6 Å²	147.6	90%	0.895	79%	0.785	S	S	*	*			trans	-71.3	155.3	144.3	-70.7	-86.4	0	0	0	110.4
61	P	28.1	Very low	26.1	Very low	112 Å²	112	147.4 Å²	147.4	73%	0.727	79%	0.79	S	S	*	*				-142.4	147.6	81.8	21	3.3	0	0	0	112.9
62	S	23.1	Very low	26.1	Very low	89 Å²	89	143.8 Å²	143.8	62%	0.622	78%	0.784	S	S	*	*				57.3	123.1	79	82.7	0	0	0	0	117.4
63	W	21.3	Very low	26	Very low	218 Å²	218	146 Å²	146	83%	0.826	78%	0.778	S	S	*	*			trans	92.7	130.7	153.8	-53.5	102.3	0	0	0	122.7
64	R	21	Very low	25.9	Very low	221 Å²	221	148.2 Å²	148.2	83%	0.834	77%	0.769	S	S	*	*			trans	86.3	148.5	135.2	-126.3	175.3	-80.1	-170	-3.1	120.8
65	L	34	Very low	26.1	Very low	159 Å²	159	146.3 Å²	146.3	83%	0.832	77%	0.766	S	S	*	*			trans	-46.4	146	178.5	-88.6	87.2	0	0	0	113.6
66	E	25.4	Very low	26.1	Very low	196 Å²	196	145.5 Å²	145.5	92%	0.916	77%	0.765	S	S	*	*			trans	-148	120	142.5	-145.1	143.1	-144.9	0	0	111.4
67	E	27.5	Very low	26.7	Very low	172 Å²	172	142.4 Å²	142.4	80%	0.804	77%	0.767	S	S	*	*			trans	-82.1	135.4	158.8	-137	179.2	173.7	0	0	106.5
68	E	26	Very low	26.9	Very low	179 Å²	179	143.8 Å²	143.8	84%	0.836	77%	0.769	S	S	*	*			trans	170.1	112	144.4	-95.8	-176.8	-169.6	0	0	108.3
69	A	26.8	Very low	27.1	Very low	73 Å²	73	147.7 Å²	147.7	60%	0.603	77%	0.769	S	S	*	*				71.9	112.2	85.6	0	0	0	0	0	113.4
70	H	25.4	Very low	27.5	Very low	161 Å²	161	152.5 Å²	152.5	75%	0.745	77%	0.771	S	S	*	*			trans	159.1	98.5	131.6	-75.3	147	0	0	0	111.6
71	T	25.1	Very low	27.7	Very low	135 Å²	135	149 Å²	149	83%	0.828	76%	0.758	S	S	*	*			trans	-138.3	77.8	137.8	-41.9	0	0	0	0	108.5	M73	T71-M73 VanDerWaalsContact C-N 3.29Å; T71-M73 HydrophobicContact CG2-CG 4.35Å; T71-M73 PolarHBondContact O-N 3.28Å
72	T	27.2	Very low	27.8	Very low	114 Å²	114	146.5 Å²	146.5	70%	0.699	75%	0.746	S	S	*	*			trans	-72.7	86.4	164.4	-44.4	0	0	0	0	107.8	L74	T72-L74 PolarHBondContact O-N 3.31Å
73	M	25.2	Very low	28.2	Very low	154 Å²	154	152.5 Å²	152.5	76%	0.759	76%	0.755	S	S	*	*			trans	-87.4	100.6	161	-94.4	-80.5	107.4	0	0	108.2	T71 V75	T71-M73 VanDerWaalsContact C-N 3.29Å; T71-M73 HydrophobicContact CG2-CG 4.35Å; T71-M73 PolarHBondContact O-N 3.28Å; M73-V75 PolarHBondContact O-N 3.29Å
74	L	26.4	Very low	28.6	Very low	128 Å²	128	146.5 Å²	146.5	67%	0.67	75%	0.746	S	S	*	*			trans	-51.1	113.1	165.6	-128.6	118.2	0	0	0	109.1	T72 I76	T72-L74 PolarHBondContact O-N 3.31Å; L74-I76 HydrophobicContact CD2-CD1 3.36Å; L74-I76 HydrophobicContact CD2-CG1 3.7Å
75	V	29.9	Very low	29.1	Very low	119 Å²	119	144 Å²	144	72%	0.721	74%	0.744	S	S	*	*			trans	-112.7	81.6	165.4	-174.4	0	0	0	0	107.9	M73	M73-V75 PolarHBondContact O-N 3.29Å
76	I	27.6	Very low	28.9	Very low	143 Å²	143	141.9 Å²	141.9	73%	0.733	74%	0.737	S	S	*	*			trans	-78	125.4	158.9	-70.8	172.4	0	0	0	107.2	L74	L74-I76 HydrophobicContact CD2-CD1 3.36Å; L74-I76 HydrophobicContact CD2-CG1 3.7Å
77	G	37.2	Very low	29.3	Very low	72 Å²	72	138.5 Å²	138.5	74%	0.742	73%	0.725	S	S	*	*			trans	69.1	71	152.8	0	0	0	0	0	117.5
78	I	30.9	Very low	29.4	Very low	141 Å²	141	138.6 Å²	138.6	72%	0.723	73%	0.725	S	S	*	*			trans	-130.2	126.2	154	-56.9	-177.2	0	0	0	109.7
79	R	29.6	Very low	29.6	Very low	211 Å²	211	136.9 Å²	136.9	80%	0.796	72%	0.721	S	S	*	*			trans	-37.6	143	-178	-104.4	174.1	176	172.1	-3.1	115.4	E81 A82	R79-E81 VanDerWaalsContact CB-OE2 3.31Å; R79-E81 WeakPolarHBondContact CB-OE2 3.45Å; R79-E81 WeakPolarHBondContact CD-OE2 3.39Å; R79-E81 WeakPolarHBondContact CG-OE2 3.37Å; R79-E81 PolarHBondContact O-N 3.46Å; R79-A82 PolarHBondContact O-N 3.45Å
80	K	32.2	Very low	30.2	Very low	201 Å²	201	138.2 Å²	138.2	87%	0.874	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53	-15.5	176	-90.1	179.7	171.9	177.8	0	114.6
81	E	31.8	Very low	30.8	Very low	132 Å²	132	137.8 Å²	137.8	62%	0.617	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-17	-177.4	-68.4	83.1	-153.2	0	0	115.7	R79	R79-E81 VanDerWaalsContact CB-OE2 3.31Å; R79-E81 WeakPolarHBondContact CB-OE2 3.45Å; R79-E81 WeakPolarHBondContact CD-OE2 3.39Å; R79-E81 WeakPolarHBondContact CG-OE2 3.37Å; R79-E81 PolarHBondContact O-N 3.46Å
82	A	29.6	Very low	31.4	Very low	59 Å²	59	135.2 Å²	135.2	49%	0.488	70%	0.699	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.1	-12.2	-174.3	0	0	0	0	0	115.4	R79 S84	R79-A82 PolarHBondContact O-N 3.45Å; A82-S84 VanDerWaalsContact C-N 3.26Å; A82-S84 PolarHBondContact O-N 2.94Å
83	R	31.7	Very low	32.1	Very low	215 Å²	215	133.1 Å²	133.1	81%	0.811	68%	0.68	S	S	*	*	H	α-helix	trans	-71.8	-18.7	175.8	-92.4	-178.2	170.3	169.8	-1.9	113.4
84	S	31.3	Very low	33.3	Very low	91 Å²	91	129.1 Å²	129.1	64%	0.636	66%	0.657	S	S	*	*	H	α-helix	trans	-75.7	-21.7	-177	-174.3	0	0	0	0	113.9	A82	A82-S84 VanDerWaalsContact C-N 3.26Å; A82-S84 PolarHBondContact O-N 2.94Å
85	Q	30.8	Very low	34	Very low	169 Å²	169	124.8 Å²	124.8	79%	0.79	63%	0.631	S	S	*	*	H	α-helix	trans	-97.4	-16.3	-172.9	-69.5	-175.7	-11.1	0	0	113.9
86	V	30.6	Very low	34.8	Very low	114 Å²	114	120.1 Å²	120.1	69%	0.691	60%	0.604	S	S	*	*	H	α-helix	trans	-92.7	-11.4	176.7	-175.3	0	0	0	0	112.3	H88	V86-H88 VanDerWaalsContact C-N 3.29Å; V86-H88 PolarHBondContact O-N 3.19Å
87	L	32.4	Very low	35.7	Very low	126 Å²	126	115 Å²	115	66%	0.66	58%	0.577	S	S	*	*	S	Bend	trans	-84.1	3.9	174.3	-76.2	169.4	0	0	0	114.2	L89	L87-L89 VanDerWaalsContact C-N 3.27Å; L87-L89 PolarHBondContact O-N 3.44Å
88	H	30.4	Very low	36.2	Very low	174 Å²	174	111.9 Å²	111.9	81%	0.806	54%	0.544	S	S	*	.			trans	-91.7	25	178.3	-136.8	-78	0	0	0	113.7	V86 S90	V86-H88 VanDerWaalsContact C-N 3.29Å; V86-H88 PolarHBondContact O-N 3.19Å; H88-S90 PolarHBondContact O-N 3.05Å
89	L	29.8	Very low	37.2	Very low	143 Å²	143	105.8 Å²	105.8	75%	0.749	51%	0.514	S	S	*	.	S	Bend	trans	-76.9	107.2	160.4	-71.9	167.9	0	0	0	107.7	L87 R91	L87-L89 VanDerWaalsContact C-N 3.27Å; L87-L89 PolarHBondContact O-N 3.44Å; L89-R91 PolarHBondContact O-N 3.03Å
90	S	38.8	Very low	38.2	Very low	101 Å²	101	103.9 Å²	103.9	71%	0.706	51%	0.514	S	S	*	.			trans	-21.5	101.9	171.2	-170.2	0	0	0	0	113.6	H88 N92	H88-S90 PolarHBondContact O-N 3.05Å; S90-N92 PolarHBondContact O-N 3.27Å
91	R	38.3	Very low	39.5	Very low	151 Å²	151	100.6 Å²	100.6	57%	0.57	50%	0.501	S	S	*	.			trans	-87.7	105.9	169.4	-78.5	178.4	118.7	144.5	-2.3	108.4	L89	L89-R91 PolarHBondContact O-N 3.03Å
92	N	36.9	Very low	41.6	Very low	81 Å²	81	95.1 Å²	95.1	43%	0.433	48%	0.476	S	S	.	.			trans	-53	133.7	175.8	-80.7	7.9	0	0	0	111.6	S90 E358	S90-N92 PolarHBondContact O-N 3.27Å; N92-E358 VanDerWaalsContact CA-OE2 3.23Å; N92-E358 WeakPolarHBondContact CA-OE2 3.4Å; N92-E358 WeakPolarHBondContact CB-OE2 3.42Å; N92-E358 PolarHBondContact OD1-OE2 3.17Å
93	K	43.9	Very low	44.2	Very low	71 Å²	71	96.5 Å²	96.5	31%	0.309	47%	0.471	S	S	.	.			trans	-81.2	119.1	172.7	-53.1	-143.8	173.5	175.4	0	109.2	F310 E358	K93-F310 HydrophobicContact CB-CD1 4.49Å; K93-F310 HydrophobicContact CB-CE1 3.7Å; K93-F310 HydrophobicContact CB-CZ 3.72Å; K93-F310 HydrophobicContact CD-CD1 3.58Å; K93-F310 HydrophobicContact CD-CD2 4.33Å; K93-F310 HydrophobicContact CD-CE1 3.67Å; K93-F310 HydrophobicContact CD-CE2 4.34Å; K93-F310 HydrophobicContact CD-CG 3.96Å; K93-F310 HydrophobicContact CD-CZ 4.04Å; K93-F310 HydrophobicContact CG-CD1 3.64Å; K93-F310 HydrophobicContact CG-CE1 3.28Å; K93-F310 HydrophobicContact CG-CG 4.48Å; K93-F310 HydrophobicContact CG-CZ 3.79Å; K93-E358 PolarHBondContact N-OE1 3.45Å; K93-E358 PolarHBondContact N-OE2 2.89Å
94	R	49.4	Very low	47.1	Very low	70 Å²	70	87.1 Å²	87.1	26%	0.264	44%	0.436	S	S	.	.			trans	-90.4	0.9	-162.1	-74.7	-175.4	-105.3	169.5	-2.1	116.4	M239 D240	R94-M239 PolarHBondContact O-N 3.42Å; R94-D240 IonicContact NH1-OD2 3.07Å; R94-D240 PolarHBondContact NH1-OD2 3.22Å
95	Y	40.9	Very low	50	Low	36 Å²	36	90.1 Å²	90.1	14%	0.141	45%	0.445	C	S	.	.	B	Isolated β-bridge	trans	-132.1	137.7	-177.2	-75.7	-67.6	0	0	0	112.7	D260 E261	Y95-D260 HydrophobicContact CE2-CB 4.15Å; Y95-D260 WeakPolarHBondContact CE2-O 3.45Å; Y95-D260 WeakPolarHBondContact CE2-OD1 3.29Å; Y95-D260 WeakPolarHBondContact CE2-OD2 3.49Å; Y95-D260 VanDerWaalsContact CZ-O 3.25Å; Y95-D260 WeakPolarHBondContact OH-CA 3.49Å; Y95-D260 WeakPolarHBondContact OH-CB 3.28Å; Y95-D260 PolarHBondContact OH-O 2.81Å; Y95-D260 PolarHBondContact OH-OD2 3.1Å; Y95-E261 WeakPolarHBondContact OH-CA 3.23Å; Y95-E261 PolarHBondContact OH-N 2.95Å
96	T	45.8	Very low	52.9	Low	22 Å²	22	86 Å²	86	14%	0.135	42%	0.424	C	S	.	.			trans	-96.2	113.9	160.1	-60.8	0	0	0	0	106.5	M236 H361	T96-M236 HydrophobicContact CG2-SD 3.65Å; T96-M236 VanDerWaalsContact O-CB 3.28Å; T96-M236 WeakPolarHBondContact O-CB 3.45Å; T96-M236 WeakPolarHBondContact O-CG 3.27Å; T96-M236 VanDerWaalsContact O-SD 3.33Å; T96-H361 PolarHBondContact OG1-NE2 3.13Å
97	L	47.3	Very low	55.9	Low	35 Å²	35	84.2 Å²	84.2	18%	0.183	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-72.9	135	176.4	-60.5	176.2	0	0	0	109.4	R267 E355	L97-R267 HydrophobicContact CD1-CG 3.43Å; L97-R267 VanDerWaalsContact CD1-CG 3.43Å; L97-R267 VanDerWaalsContact CD1-NE 3.29Å; L97-R267 HydrophobicContact CD2-CB 4.23Å; L97-R267 HydrophobicContact CD2-CG 3.59Å; L97-R267 HydrophobicContact CG-CG 4.17Å; L97-E355 WeakPolarHBondContact CD1-OE1 3.47Å; L97-E355 WeakPolarHBondContact CD1-OE2 3.47Å; L97-E355 WeakPolarHBondContact CG-OE2 3.24Å
98	T	47.7	Very low	59	Low	6 Å²	6	86.1 Å²	86.1	4%	0.037	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-58.7	146.8	161.1	46	0	0	0	0	108.7	L102 F189 G234 M236	T98-L102 HydrophobicContact CG2-CB 4.41Å; T98-L102 HydrophobicContact CG2-CD1 4.16Å; T98-F189 HydrophobicContact CG2-CD1 3.83Å; T98-F189 HydrophobicContact CG2-CE1 3.58Å; T98-F189 HydrophobicContact CG2-CE2 4.45Å; T98-F189 HydrophobicContact CG2-CG 4.36Å; T98-F189 HydrophobicContact CG2-CZ 3.93Å; T98-G234 VanDerWaalsContact CG2-O 3.25Å; T98-G234 WeakPolarHBondContact CG2-O 3.4Å; T98-G234 PolarHBondContact OG1-O 3.15Å; T98-M236 HydrophobicContact CG2-CG 3.49Å; T98-M236 VanDerWaalsContact CG2-CG 3.49Å; T98-M236 HydrophobicContact CG2-SD 4.13Å
99	P	52.4	Low	62.2	Low	14 Å²	14	78 Å²	78	9%	0.091	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-52.7	148.5	172.3	-30.2	41.5	0	0	0	110.7	Q101 L102 A378 I379 E381	P99-Q101 PolarHBondContact O-N 2.01Å; P99-L102 PolarHBondContact O-N 3.26Å; P99-A378 VanDerWaalsContact CG-O 3.29Å; P99-A378 WeakPolarHBondContact CG-O 3.31Å; P99-I379 WeakPolarHBondContact CD-O 3.36Å; P99-I379 WeakPolarHBondContact CG-O 3.41Å; P99-E381 WeakPolarHBondContact CG-O 2.95Å
100	E	51	Low	65.4	Low	170 Å²	170	72.4 Å²	72.4	79%	0.794	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-13.5	-176	-68.9	-173.9	154.1	0	0	115
101	Q	58.6	Low	68.3	Low	132 Å²	132	68.1 Å²	68.1	62%	0.617	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-16.2	180	-63.6	169.6	6	0	0	114.1	P99 K103	P99-Q101 PolarHBondContact O-N 2.01Å; Q101-K103 PolarHBondContact O-N 3.02Å
102	L	75.6	Confident	71.1	Confident	17 Å²	17	61.6 Å²	61.6	9%	0.089	29%	0.289	C	S	.	.	S	Bend	trans	-98.4	53.5	-178.2	-62.6	-179.2	0	0	0	112	T98 P99 F189 P190 A378 I379	T98-L102 HydrophobicContact CG2-CB 4.41Å; T98-L102 HydrophobicContact CG2-CD1 4.16Å; P99-L102 PolarHBondContact O-N 3.26Å; L102-F189 HydrophobicContact CB-CB 4.19Å; L102-F189 HydrophobicContact CD1-CB 4.19Å; L102-F189 HydrophobicContact CD1-CD2 4.37Å; L102-F189 HydrophobicContact CD1-CG 4.29Å; L102-F189 HydrophobicContact CD2-CB 4.29Å; L102-F189 HydrophobicContact CG-CB 4.47Å; L102-P190 WeakPolarHBondContact CA-O 3Å; L102-P190 VanDerWaalsContact CD2-O 3.25Å; L102-P190 WeakPolarHBondContact CD2-O 3.09Å; L102-A378 HydrophobicContact CD1-CB 4.43Å; L102-A378 HydrophobicContact CD2-CB 4.03Å; L102-I379 HydrophobicContact CD1-CB 4.24Å; L102-I379 HydrophobicContact CD1-CG1 3.43Å; L102-I379 VanDerWaalsContact CD1-CG1 3.43Å
103	K	84.8	Confident	74	Confident	88 Å²	88	58.3 Å²	58.3	38%	0.383	27%	0.271	S	S	.	.	S	Bend	trans	-141	157.7	178.5	73.5	178.6	-175.7	177.3	0	111.1	Q101 L268 Y269	Q101-K103 PolarHBondContact O-N 3.02Å; K103-L268 PolarHBondContact NZ-O 2.99Å; K103-Y269 HydrophobicContact CB-CE1 3.77Å; K103-Y269 HydrophobicContact CD-CE1 4.44Å; K103-Y269 HydrophobicContact CG-CE1 4.4Å
104	W	92.3	Very high	76.4	Confident	19 Å²	19	58.8 Å²	58.8	7%	0.072	28%	0.276	C	S	.	.			trans	-73.8	145	170.5	-60.7	107.9	0	0	0	111.6	K106 L109 F143 D155 I156 P190 P191 V232 Y269	W104-K106 WeakPolarHBondContact CB-O 3.39Å; W104-L109 HydrophobicContact CB-CD2 4.3Å; W104-L109 HydrophobicContact CD2-CD1 4.22Å; W104-L109 HydrophobicContact CD2-CD2 3.78Å; W104-L109 HydrophobicContact CE3-CD2 4.1Å; W104-L109 HydrophobicContact CG-CD1 3.92Å; W104-L109 HydrophobicContact CG-CD2 3.87Å; W104-F143 HydrophobicContact CB-CE1 4.12Å; W104-F143 HydrophobicContact CB-CZ 4.45Å; W104-F143 HydrophobicContact CG-CE1 4.37Å; W104-D155 HydrophobicContact CH2-CB 4.18Å; W104-D155 WeakPolarHBondContact CH2-O 3.38Å; W104-D155 HydrophobicContact CZ3-CB 4.38Å; W104-I156 HydrophobicContact CZ2-CG1 4.33Å; W104-P190 HydrophobicContact CD2-CB 3.87Å; W104-P190 HydrophobicContact CD2-CG 4.11Å; W104-P190 HydrophobicContact CE3-CB 4.31Å; W104-P190 HydrophobicContact CG-CB 4.18Å; W104-P190 HydrophobicContact CG-CG 4.13Å; W104-P190 HydrophobicContact CZ2-CB 4.09Å; W104-P190 HydrophobicContact CZ2-CG 4.17Å; W104-P191 WeakPolarHBondContact CH2-O 3.41Å; W104-P191 HydrophobicContact CZ3-CB 4.22Å; W104-V232 HydrophobicContact CZ2-CG1 4.43Å; W104-V232 PolarHBondContact NE1-O 2.81Å; W104-Y269 HydrophobicContact CB-CE1 4.35Å; W104-Y269 PolarHBondContact N-OH 3.24Å; W104-Y269 WeakPolarHBondContact O-CE1 3.33Å
105	D	91.3	Very high	78.6	Confident	153 Å²	153	57 Å²	57	82%	0.818	28%	0.275	S	S	*	.	S	Bend	trans	-89.4	-8.2	171.3	63.4	-14.2	0	0	0	112.8
106	K	93.2	Very high	81.2	Confident	84 Å²	84	58 Å²	58	37%	0.365	28%	0.28	S	S	.	.			trans	-131	154.8	179.6	66	-178.6	176.8	174	0	111.7	W104 L109 F143 D155	W104-K106 WeakPolarHBondContact CB-O 3.39Å; K106-L109 HydrophobicContact CD-CD2 4.45Å; K106-L109 HydrophobicContact CG-CD2 3.9Å; K106-F143 WeakPolarHBondContact O-CE1 3.43Å; K106-D155 VanDerWaalsContact CE-CG 3.48Å; K106-D155 VanDerWaalsContact CE-OD1 3.24Å; K106-D155 WeakPolarHBondContact CE-OD1 3.31Å; K106-D155 VanDerWaalsContact CE-OD2 3.24Å; K106-D155 WeakPolarHBondContact CE-OD2 3.49Å; K106-D155 IonicContact NZ-OD1 3.63Å; K106-D155 PolarHBondContact NZ-OD1 3.45Å; K106-D155 IonicContact NZ-OD2 2.74Å; K106-D155 PolarHBondContact NZ-OD2 3.39Å
107	F	92.9	Very high	83.6	Confident	75 Å²	75	57.6 Å²	57.6	33%	0.329	28%	0.278	S	S	.	.	S	Bend	trans	-100.4	-15.2	178.4	-64.5	-62.2	0	0	0	114.2	L109 P142 F143 S144 Y269	F107-L109 PolarHBondContact O-N 3.18Å; F107-P142 HydrophobicContact CD1-CB 3.9Å; F107-P142 HydrophobicContact CD1-CG 3.51Å; F107-P142 HydrophobicContact CD2-CB 4.41Å; F107-P142 HydrophobicContact CE1-CB 4.11Å; F107-P142 HydrophobicContact CE1-CG 3.37Å; F107-P142 HydrophobicContact CG-CB 4.06Å; F107-P142 HydrophobicContact CG-CG 4.18Å; F107-P142 HydrophobicContact CZ-CB 4.45Å; F107-P142 HydrophobicContact CZ-CG 3.91Å; F107-F143 HydrophobicContact CB-CD1 4.34Å; F107-F143 AromaticContact CD1-CD1 3.97Å; F107-F143 HydrophobicContact CD1-CD1 3.97Å; F107-F143 HydrophobicContact CD1-CD2 4.22Å; F107-F143 AromaticContact CD1-CE1 3.73Å; F107-F143 HydrophobicContact CD1-CE1 3.73Å; F107-F143 AromaticContact CD1-CE2 3.99Å; F107-F143 HydrophobicContact CD1-CE2 3.99Å; F107-F143 HydrophobicContact CD1-CG 4.2Å; F107-F143 AromaticContact CD1-CZ 3.73Å; F107-F143 HydrophobicContact CD1-CZ 3.73Å; F107-F143 HydrophobicContact CE1-CE1 4.42Å; F107-F143 HydrophobicContact CE1-CE2 4.17Å; F107-F143 AromaticContact CE1-CZ 4Å; F107-F143 HydrophobicContact CE1-CZ 4Å; F107-F143 CarbonylContact O-C 3.5Å; F107-F143 VanDerWaalsContact O-CA 3.27Å; F107-F143 WeakPolarHBondContact O-CA 3.31Å; F107-F143 WeakPolarHBondContact O-CD1 3.21Å; F107-S144 PolarHBondContact O-N 2.98Å; F107-Y269 AromaticContact CE1-CD1 3.8Å; F107-Y269 HydrophobicContact CE1-CD1 3.8Å; F107-Y269 AromaticContact CE1-CG 3.96Å; F107-Y269 HydrophobicContact CE1-CG 3.96Å; F107-Y269 HydrophobicContact CZ-CD1 4.37Å
108	K	96.7	Very high	85.7	Confident	167 Å²	167	61 Å²	61	73%	0.726	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	100.8	176	-61.7	-175.3	179.5	178.6	0	108.2
109	L	97.9	Very high	87.4	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	141	-177.6	-58.6	178.5	0	0	0	110.5	W104 K106 F107 F143 S144 F145 R146 D155 I156 L233	W104-L109 HydrophobicContact CB-CD2 4.3Å; W104-L109 HydrophobicContact CD2-CD1 4.22Å; W104-L109 HydrophobicContact CD2-CD2 3.78Å; W104-L109 HydrophobicContact CE3-CD2 4.1Å; W104-L109 HydrophobicContact CG-CD1 3.92Å; W104-L109 HydrophobicContact CG-CD2 3.87Å; K106-L109 HydrophobicContact CD-CD2 4.45Å; K106-L109 HydrophobicContact CG-CD2 3.9Å; F107-L109 PolarHBondContact O-N 3.18Å; L109-F143 HydrophobicContact CD1-CD1 3.53Å; L109-F143 HydrophobicContact CD1-CE1 3.65Å; L109-F143 HydrophobicContact CG-CD1 3.95Å; L109-F143 HydrophobicContact CG-CE1 4.2Å; L109-S144 PolarHBondContact N-O 3.41Å; L109-F145 HydrophobicContact CB-CD1 4.03Å; L109-F145 HydrophobicContact CB-CE1 4.28Å; L109-F145 HydrophobicContact CD1-CE1 3.93Å; L109-F145 VanDerWaalsContact O-CA 3.31Å; L109-F145 WeakPolarHBondContact O-CA 3.15Å; L109-R146 PolarHBondContact O-N 3.42Å; L109-R146 VanDerWaalsContact O-N 3.08Å; L109-D155 WeakPolarHBondContact CA-OD2 3.3Å; L109-D155 HydrophobicContact CB-CB 4.46Å; L109-D155 HydrophobicContact CD2-CB 4.2Å; L109-I156 HydrophobicContact CB-CD1 4.25Å; L109-I156 HydrophobicContact CD1-CD1 4.14Å; L109-L233 HydrophobicContact CD1-CD2 4.09Å
110	T	98.3	Very high	89.2	Confident	26 Å²	26	67 Å²	67	16%	0.16	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	148.5	169.6	52.7	0	0	0	0	110.7	R146 V148 A154 D155 I156	T110-R146 CarbonylContact C-O 3.58Å; T110-R146 VanDerWaalsContact CA-O 3.27Å; T110-R146 WeakPolarHBondContact CA-O 3.45Å; T110-V148 HydrophobicContact CG2-CG1 3.72Å; T110-A154 WeakPolarHBondContact OG1-CA 3.42Å; T110-D155 PolarHBondContact N-OD2 2.5Å; T110-D155 WeakPolarHBondContact O-CB 3.4Å; T110-D155 PolarHBondContact O-N 3.17Å; T110-D155 PolarHBondContact OG1-N 2.87Å; T110-D155 VanDerWaalsContact OG1-N 3.17Å; T110-D155 PolarHBondContact OG1-OD2 2.86Å; T110-I156 PolarHBondContact O-N 2.94Å
111	Y	98.6	Very high	91.2	Very high	11 Å²	11	59.5 Å²	59.5	4%	0.043	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	153.4	172.5	74.7	-91.8	0	0	0	111.7	I130 F134 F145 R146 E147 V148 I156 I158	Y111-I130 HydrophobicContact CD2-CG2 4.4Å; Y111-I130 HydrophobicContact CE2-CG2 3.96Å; Y111-F134 AromaticContact CD1-CD2 3.72Å; Y111-F134 HydrophobicContact CD1-CD2 3.72Å; Y111-F134 AromaticContact CD1-CE2 3.47Å; Y111-F134 HydrophobicContact CD1-CE2 3.47Å; Y111-F134 VanDerWaalsContact CD1-CE2 3.47Å; Y111-F134 HydrophobicContact CD1-CG 4.4Å; Y111-F134 AromaticContact CD1-CZ 3.98Å; Y111-F134 HydrophobicContact CD1-CZ 3.98Å; Y111-F134 HydrophobicContact CD2-CD2 4.39Å; Y111-F134 AromaticContact CD2-CE2 3.71Å; Y111-F134 HydrophobicContact CD2-CE2 3.71Å; Y111-F134 HydrophobicContact CD2-CZ 4.48Å; Y111-F134 AromaticContact CE1-CD2 3.56Å; Y111-F134 HydrophobicContact CE1-CD2 3.56Å; Y111-F134 AromaticContact CE1-CE2 3.77Å; Y111-F134 HydrophobicContact CE1-CE2 3.77Å; Y111-F134 HydrophobicContact CE1-CG 4.29Å; Y111-F134 HydrophobicContact CE2-CD2 4.29Å; Y111-F134 HydrophobicContact CE2-CE2 4.02Å; Y111-F134 HydrophobicContact CG-CD2 4.13Å; Y111-F134 AromaticContact CG-CE2 3.44Å; Y111-F134 HydrophobicContact CG-CE2 3.44Å; Y111-F134 VanDerWaalsContact CG-CE2 3.44Å; Y111-F134 AromaticContact CG-CZ 3.88Å; Y111-F134 HydrophobicContact CG-CZ 3.88Å; Y111-F134 AromaticContact CZ-CD2 3.88Å; Y111-F145 HydrophobicContact CD1-CB 4.16Å; Y111-F145 HydrophobicContact CE1-CB 4.27Å; Y111-R146 PolarHBondContact N-O 3.1Å; Y111-E147 HydrophobicContact CD2-CB 4.46Å; Y111-E147 HydrophobicContact CD2-CG 4.24Å; Y111-E147 HydrophobicContact CE1-CB 4.02Å; Y111-E147 HydrophobicContact CE2-CB 3.78Å; Y111-E147 HydrophobicContact CE2-CG 3.63Å; Y111-E147 CarbonylContact O-C 3.51Å; Y111-E147 VanDerWaalsContact O-CA 3.28Å; Y111-E147 WeakPolarHBondContact O-CA 3.45Å; Y111-E147 PolarHBondContact OH-OE2 2.89Å; Y111-E147 VanDerWaalsContact OH-OE2 3.1Å; Y111-V148 PolarHBondContact O-N 2.77Å; Y111-I156 CarbonylContact C-O 3.49Å; Y111-I156 WeakPolarHBondContact CA-O 3.11Å; Y111-I158 HydrophobicContact CD2-CD1 4.1Å
112	K	97.7	Very high	93	Very high	14 Å²	14	57.1 Å²	57.1	6%	0.061	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	149.9	171.7	69.1	-177.8	173	177.5	0	112.4	L114 V148 A150 E152 A154 I156 K157 I158	K112-L114 HydrophobicContact CD-CD2 4.12Å; K112-L114 HydrophobicContact CG-CD2 4.15Å; K112-V148 HydrophobicContact CB-CG2 4.07Å; K112-A150 PolarHBondContact NZ-O 3.41Å; K112-A150 VanDerWaalsContact NZ-O 3.09Å; K112-E152 WeakPolarHBondContact CD-O 3.27Å; K112-E152 WeakPolarHBondContact CE-O 3.32Å; K112-E152 PolarHBondContact NZ-O 3.4Å; K112-A154 HydrophobicContact CB-CB 4.01Å; K112-A154 HydrophobicContact CD-CB 3.97Å; K112-A154 HydrophobicContact CG-CB 3.73Å; K112-I156 PolarHBondContact N-O 3.5Å; K112-K157 HydrophobicContact CG-CG 4.49Å; K112-I158 PolarHBondContact O-N 3.04Å
113	L	97.4	Very high	94	Very high	12 Å²	12	58 Å²	58	6%	0.063	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.2	172.6	-58.6	-179	0	0	0	109.1	F116 R127 I130 I158	L113-F116 HydrophobicContact CB-CE1 4.3Å; L113-F116 HydrophobicContact CB-CE2 4.49Å; L113-F116 HydrophobicContact CB-CZ 3.92Å; L113-F116 HydrophobicContact CD1-CD1 4.39Å; L113-F116 HydrophobicContact CD1-CE1 3.44Å; L113-F116 VanDerWaalsContact CD1-CE1 3.44Å; L113-F116 HydrophobicContact CD1-CZ 3.75Å; L113-R127 HydrophobicContact CD1-CB 4.48Å; L113-R127 HydrophobicContact CD1-CG 3.53Å; L113-I130 HydrophobicContact CD2-CG1 4.21Å; L113-I130 HydrophobicContact CD2-CG2 4.26Å; L113-I158 CarbonylContact C-O 3.38Å; L113-I158 WeakPolarHBondContact CA-O 3.29Å; L113-I158 HydrophobicContact CD2-CB 3.78Å; L113-I158 HydrophobicContact CD2-CD1 4.19Å; L113-I158 HydrophobicContact CD2-CG2 3.82Å
114	L	95.6	Very high	94.5	Very high	81 Å²	81	57.4 Å²	57.4	42%	0.424	30%	0.304	S	S	.	.	S	Bend	trans	-83	-31.1	179.4	-62.8	-179.8	0	0	0	112.3	K112 K157 I158	K112-L114 HydrophobicContact CD-CD2 4.12Å; K112-L114 HydrophobicContact CG-CD2 4.15Å; L114-K157 HydrophobicContact CD1-CB 4.07Å; L114-I158 PolarHBondContact N-O 3.24Å
115	S	94.8	Very high	94.8	Very high	34 Å²	34	58.3 Å²	58.3	24%	0.238	31%	0.311	C	S	.	.			trans	-149.7	176.3	177.9	60.3	0	0	0	0	110.4	F160	S115-F160 WeakPolarHBondContact O-CD2 3.4Å; S115-F160 PolarHBondContact OG-N 3.06Å; S115-F160 PolarHBondContact OG-O 2.93Å
116	F	95.9	Very high	95.1	Very high	57 Å²	57	51 Å²	51	25%	0.25	27%	0.272	C	S	.	.			trans	-134	153.4	-178.2	-68.2	-86	0	0	0	110.1	L113 A123 T126 R127	L113-F116 HydrophobicContact CB-CE1 4.3Å; L113-F116 HydrophobicContact CB-CE2 4.49Å; L113-F116 HydrophobicContact CB-CZ 3.92Å; L113-F116 HydrophobicContact CD1-CD1 4.39Å; L113-F116 HydrophobicContact CD1-CE1 3.44Å; L113-F116 VanDerWaalsContact CD1-CE1 3.44Å; L113-F116 HydrophobicContact CD1-CZ 3.75Å; F116-A123 HydrophobicContact CB-CB 4.49Å; F116-A123 HydrophobicContact CD1-CB 3.53Å; F116-A123 HydrophobicContact CD2-CB 4.27Å; F116-A123 HydrophobicContact CE1-CB 3.73Å; F116-A123 HydrophobicContact CE2-CB 4.47Å; F116-A123 HydrophobicContact CG-CB 3.83Å; F116-A123 HydrophobicContact CZ-CB 4.23Å; F116-T126 HydrophobicContact CD1-CG2 3.87Å; F116-T126 HydrophobicContact CE1-CG2 4.32Å; F116-R127 HydrophobicContact CE1-CG 4.11Å; F116-R127 VanDerWaalsContact CZ-CZ 3.47Å
117	P	94.9	Very high	95.3	Very high	12 Å²	12	52 Å²	52	8%	0.078	27%	0.273	C	S	.	.			trans	-55.4	139.9	174.6	-26	34.8	0	0	0	112.4	I121 T126 F160 D199 W203	P117-I121 HydrophobicContact CB-CG2 3.54Å; P117-I121 HydrophobicContact CG-CG2 3.49Å; P117-I121 VanDerWaalsContact CG-CG2 3.49Å; P117-T126 WeakPolarHBondContact CD-OG1 3.19Å; P117-T126 HydrophobicContact CG-CG2 4.32Å; P117-F160 HydrophobicContact CB-CD1 4.36Å; P117-F160 HydrophobicContact CG-CD1 3.52Å; P117-F160 HydrophobicContact CG-CD2 4.21Å; P117-F160 HydrophobicContact CG-CE1 3.46Å; P117-F160 VanDerWaalsContact CG-CE1 3.46Å; P117-F160 HydrophobicContact CG-CE2 4.16Å; P117-F160 HydrophobicContact CG-CG 3.91Å; P117-F160 HydrophobicContact CG-CZ 3.8Å; P117-D199 WeakPolarHBondContact CA-OD1 3.48Å; P117-W203 HydrophobicContact CB-CB 4.36Å; P117-W203 HydrophobicContact CB-CG 4.46Å; P117-W203 HydrophobicContact CG-CB 4.26Å; P117-W203 HydrophobicContact CG-CG 4.26Å
118	T	91.6	Very high	95.6	Very high	108 Å²	108	54.4 Å²	54.4	66%	0.663	28%	0.28	S	S	*	.	S	Bend	trans	-95.8	-14.1	-178.8	57	0	0	0	0	114	D199	T118-D199 VanDerWaalsContact CG2-OD2 3.26Å; T118-D199 WeakPolarHBondContact CG2-OD2 3.31Å; T118-D199 PolarHBondContact N-OD1 3.18Å; T118-D199 PolarHBondContact OG1-OD1 3.14Å; T118-D199 PolarHBondContact OG1-OD2 3.45Å
119	N	84.1	Confident	95.6	Very high	64 Å²	64	46.5 Å²	46.5	34%	0.342	25%	0.245	S	C	.	.	S	Bend	trans	-86.8	-58.7	-167.4	-68.6	-40.6	0	0	0	116.3	D199 E201 Y202	N119-D199 PolarHBondContact ND2-O 2.67Å; N119-E201 PolarHBondContact ND2-O 3.34Å; N119-Y202 HydrophobicContact CB-CD1 4.28Å; N119-Y202 HydrophobicContact CB-CE1 4.45Å
120	L	89.4	Confident	95.6	Very high	81 Å²	81	46.4 Å²	46.4	42%	0.424	25%	0.245	S	C	.	.	S	Bend	trans	-136.2	-48	-166.5	-72.8	-178.2	0	0	0	114.6	Y202 I204 L218	L120-Y202 HydrophobicContact CD1-CD1 3.71Å; L120-Y202 HydrophobicContact CD1-CG 4.39Å; L120-Y202 HydrophobicContact CG-CD1 3.99Å; L120-I204 HydrophobicContact CD1-CG2 4.34Å; L120-L218 HydrophobicContact CD1-CD2 3.79Å
121	I	94.3	Very high	95.6	Very high	12 Å²	12	47.2 Å²	47.2	6%	0.062	26%	0.255	C	S	.	.			trans	-82.2	136.3	-177.1	-170.2	175.1	0	0	0	110.2	P117 D125 W203 L205 I221	P117-I121 HydrophobicContact CB-CG2 3.54Å; P117-I121 HydrophobicContact CG-CG2 3.49Å; P117-I121 VanDerWaalsContact CG-CG2 3.49Å; I121-D125 HydrophobicContact CD1-CB 3.83Å; I121-D125 HydrophobicContact CG1-CB 3.47Å; I121-D125 VanDerWaalsContact CG1-CB 3.47Å; I121-W203 HydrophobicContact CG2-CB 3.69Å; I121-L205 HydrophobicContact CD1-CB 3.92Å; I121-I221 HydrophobicContact CD1-CG2 4.15Å
122	N	95.6	Very high	95.6	Very high	82 Å²	82	53.6 Å²	53.6	44%	0.439	28%	0.278	S	S	.	.			trans	-83	163	176.7	65.9	63.2	0	0	0	111.5	S124 D125 T126	N122-S124 VanDerWaalsContact C-N 3.26Å; N122-S124 PolarHBondContact O-N 3.01Å; N122-S124 WeakPolarHBondContact OD1-CB 3.44Å; N122-S124 PolarHBondContact OD1-N 2.96Å; N122-D125 VanDerWaalsContact ND2-CG 3.35Å; N122-D125 PolarHBondContact ND2-OD2 3.22Å; N122-D125 PolarHBondContact O-N 3.08Å; N122-D125 VanDerWaalsContact O-N 3.14Å; N122-D125 PolarHBondContact OD1-N 3.24Å; N122-T126 PolarHBondContact O-N 2.03Å; N122-T126 PolarHBondContact O-OG1 3.27Å; N122-T126 VanDerWaalsContact O-OG1 3.05Å
123	A	96	Very high	95.6	Very high	37 Å²	37	52.9 Å²	52.9	31%	0.306	28%	0.275	S	S	.	.	H	α-helix	trans	-58.8	-31.5	-177	0	0	0	0	0	114.9	F116 R127	F116-A123 HydrophobicContact CB-CB 4.49Å; F116-A123 HydrophobicContact CD1-CB 3.53Å; F116-A123 HydrophobicContact CD2-CB 4.27Å; F116-A123 HydrophobicContact CE1-CB 3.73Å; F116-A123 HydrophobicContact CE2-CB 4.47Å; F116-A123 HydrophobicContact CG-CB 3.83Å; F116-A123 HydrophobicContact CZ-CB 4.23Å; A123-R127 WeakPolarHBondContact O-CG 3.04Å; A123-R127 PolarHBondContact O-N 3.46Å
124	S	96.8	Very high	95.6	Very high	74 Å²	74	52.5 Å²	52.5	52%	0.517	27%	0.273	S	S	.	.	H	α-helix	trans	-69.2	-45.2	177.1	176.1	0	0	0	0	111.3	N122 T126 R127 R128	N122-S124 VanDerWaalsContact C-N 3.26Å; N122-S124 PolarHBondContact O-N 3.01Å; N122-S124 WeakPolarHBondContact OD1-CB 3.44Å; N122-S124 PolarHBondContact OD1-N 2.96Å; S124-T126 VanDerWaalsContact C-N 3.35Å; S124-R127 PolarHBondContact O-N 3.34Å; S124-R128 WeakPolarHBondContact O-CB 3.37Å; S124-R128 PolarHBondContact O-N 3.32Å
125	D	97.3	Very high	95.7	Very high	39 Å²	39	49.5 Å²	49.5	21%	0.209	26%	0.262	C	S	.	.	H	α-helix	trans	-68.3	-36.2	177.7	-67.4	-10.4	0	0	0	111.4	I121 N122 R128 G129 L205	I121-D125 HydrophobicContact CD1-CB 3.83Å; I121-D125 HydrophobicContact CG1-CB 3.47Å; I121-D125 VanDerWaalsContact CG1-CB 3.47Å; N122-D125 VanDerWaalsContact ND2-CG 3.35Å; N122-D125 PolarHBondContact ND2-OD2 3.22Å; N122-D125 PolarHBondContact O-N 3.08Å; N122-D125 VanDerWaalsContact O-N 3.14Å; N122-D125 PolarHBondContact OD1-N 3.24Å; D125-R128 VanDerWaalsContact CG-NH2 3.28Å; D125-R128 PolarHBondContact O-N 2.87Å; D125-R128 IonicContact OD1-CZ 3.9Å; D125-R128 IonicContact OD1-NH1 3.6Å; D125-R128 PolarHBondContact OD1-NH1 2.96Å; D125-R128 IonicContact OD1-NH2 3.6Å; D125-R128 PolarHBondContact OD1-NH2 3.39Å; D125-R128 IonicContact OD2-NH2 3.06Å; D125-G129 PolarHBondContact O-N 3.34Å; D125-L205 HydrophobicContact CB-CD2 4.37Å
126	T	97.8	Very high	95.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.4	-52.3	171.6	-57.7	0	0	0	0	111.1	F116 P117 N122 S124 R128 G129 I130 F160 I221	F116-T126 HydrophobicContact CD1-CG2 3.87Å; F116-T126 HydrophobicContact CE1-CG2 4.32Å; P117-T126 WeakPolarHBondContact CD-OG1 3.19Å; P117-T126 HydrophobicContact CG-CG2 4.32Å; N122-T126 PolarHBondContact O-N 2.03Å; N122-T126 PolarHBondContact O-OG1 3.27Å; N122-T126 VanDerWaalsContact O-OG1 3.05Å; S124-T126 VanDerWaalsContact C-N 3.35Å; T126-R128 VanDerWaalsContact C-N 3.28Å; T126-R128 PolarHBondContact O-N 3.33Å; T126-G129 PolarHBondContact O-N 3.38Å; T126-G129 VanDerWaalsContact O-N 3.11Å; T126-I130 HydrophobicContact CG2-CG1 4.45Å; T126-I130 WeakPolarHBondContact O-CG1 3.37Å; T126-I130 PolarHBondContact O-N 3.38Å; T126-F160 HydrophobicContact CG2-CE2 3.8Å; T126-F160 HydrophobicContact CG2-CZ 3.84Å; T126-I221 HydrophobicContact CG2-CD1 3.8Å
127	R	98	Very high	95.7	Very high	105 Å²	105	46.4 Å²	46.4	40%	0.396	25%	0.245	S	C	.	.	H	α-helix	trans	-55.1	-45.2	175.1	-78.9	-175.6	-178.2	98.5	-4.8	111.7	L113 F116 A123 S124 G129 I130 A131 E147	L113-R127 HydrophobicContact CD1-CB 4.48Å; L113-R127 HydrophobicContact CD1-CG 3.53Å; F116-R127 HydrophobicContact CE1-CG 4.11Å; F116-R127 VanDerWaalsContact CZ-CZ 3.47Å; A123-R127 WeakPolarHBondContact O-CG 3.04Å; A123-R127 PolarHBondContact O-N 3.46Å; S124-R127 PolarHBondContact O-N 3.34Å; R127-G129 VanDerWaalsContact C-N 3.33Å; R127-G129 PolarHBondContact O-N 3.46Å; R127-I130 PolarHBondContact O-N 3.08Å; R127-A131 WeakPolarHBondContact O-CB 3.02Å; R127-A131 PolarHBondContact O-N 3.04Å; R127-E147 WeakPolarHBondContact CD-OE1 3.45Å; R127-E147 IonicContact NE-OE1 2.73Å; R127-E147 PolarHBondContact NE-OE1 3.48Å
128	R	98.1	Very high	95.6	Very high	125 Å²	125	47.2 Å²	47.2	47%	0.472	25%	0.251	S	S	.	.	H	α-helix	trans	-61.5	-40.7	178.2	-172.4	166.5	67.4	-106.1	5.4	112.1	S124 D125 T126 R132 L205	S124-R128 WeakPolarHBondContact O-CB 3.37Å; S124-R128 PolarHBondContact O-N 3.32Å; D125-R128 VanDerWaalsContact CG-NH2 3.28Å; D125-R128 PolarHBondContact O-N 2.87Å; D125-R128 IonicContact OD1-CZ 3.9Å; D125-R128 IonicContact OD1-NH1 3.6Å; D125-R128 PolarHBondContact OD1-NH1 2.96Å; D125-R128 IonicContact OD1-NH2 3.6Å; D125-R128 PolarHBondContact OD1-NH2 3.39Å; D125-R128 IonicContact OD2-NH2 3.06Å; T126-R128 VanDerWaalsContact C-N 3.28Å; T126-R128 PolarHBondContact O-N 3.33Å; R128-R132 VanDerWaalsContact O-CB 3.27Å; R128-R132 WeakPolarHBondContact O-CB 3.25Å; R128-R132 PolarHBondContact O-N 2.73Å; R128-L205 HydrophobicContact CB-CD2 4.43Å; R128-L205 HydrophobicContact CG-CD2 4.33Å; R128-L205 VanDerWaalsContact NE-CD2 3.27Å
129	G	97.7	Very high	95.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.5	-49.5	176.4	0	0	0	0	0	113	D125 T126 R127 R132 A133	D125-G129 PolarHBondContact O-N 3.34Å; T126-G129 PolarHBondContact O-N 3.38Å; T126-G129 VanDerWaalsContact O-N 3.11Å; R127-G129 VanDerWaalsContact C-N 3.33Å; R127-G129 PolarHBondContact O-N 3.46Å; G129-R132 WeakPolarHBondContact O-CB 3.2Å; G129-R132 PolarHBondContact O-N 3.27Å; G129-A133 PolarHBondContact O-N 3.16Å
130	I	98.4	Very high	95.6	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-64	-46.3	178.7	-62.3	-59.8	0	0	0	111.2	Y111 L113 T126 R127 R132 A133 F134 I158 F197 I221 A225	Y111-I130 HydrophobicContact CD2-CG2 4.4Å; Y111-I130 HydrophobicContact CE2-CG2 3.96Å; L113-I130 HydrophobicContact CD2-CG1 4.21Å; L113-I130 HydrophobicContact CD2-CG2 4.26Å; T126-I130 HydrophobicContact CG2-CG1 4.45Å; T126-I130 WeakPolarHBondContact O-CG1 3.37Å; T126-I130 PolarHBondContact O-N 3.38Å; R127-I130 PolarHBondContact O-N 3.08Å; I130-R132 VanDerWaalsContact C-N 3.26Å; I130-R132 PolarHBondContact O-N 1.99Å; I130-A133 WeakPolarHBondContact O-CB 3.45Å; I130-A133 PolarHBondContact O-N 2.98Å; I130-A133 VanDerWaalsContact O-N 3.1Å; I130-F134 HydrophobicContact CG2-CD2 3.81Å; I130-F134 HydrophobicContact CG2-CE2 3.65Å; I130-F134 WeakPolarHBondContact O-CD2 2.92Å; I130-F134 PolarHBondContact O-N 2.76Å; I130-I158 HydrophobicContact CG2-CD1 3.77Å; I130-F197 HydrophobicContact CD1-CE2 4.08Å; I130-F197 HydrophobicContact CD1-CZ 3.98Å; I130-I221 HydrophobicContact CD1-CD1 4.07Å; I130-I221 HydrophobicContact CD1-CG1 4.14Å; I130-I221 HydrophobicContact CG1-CD1 4.3Å; I130-A225 HydrophobicContact CD1-CB 3.72Å
131	A	98.3	Very high	95.5	Very high	43 Å²	43	39.9 Å²	39.9	36%	0.355	21%	0.21	S	C	.	.	H	α-helix	trans	-59.7	-37.5	175.5	0	0	0	0	0	111.9	R127 G135	R127-A131 WeakPolarHBondContact O-CB 3.02Å; R127-A131 PolarHBondContact O-N 3.04Å; A131-G135 PolarHBondContact O-N 3.12Å
132	R	97.8	Very high	95.2	Very high	144 Å²	144	41.7 Å²	41.7	54%	0.543	22%	0.222	S	C	.	.	H	α-helix	trans	-63.9	-42.4	174.9	-178.7	57.9	174.7	167.1	1.1	111.8	R128 G129 I130 G135 L136 V222	R128-R132 VanDerWaalsContact O-CB 3.27Å; R128-R132 WeakPolarHBondContact O-CB 3.25Å; R128-R132 PolarHBondContact O-N 2.73Å; G129-R132 WeakPolarHBondContact O-CB 3.2Å; G129-R132 PolarHBondContact O-N 3.27Å; I130-R132 VanDerWaalsContact C-N 3.26Å; I130-R132 PolarHBondContact O-N 1.99Å; R132-G135 PolarHBondContact O-N 3.03Å; R132-L136 WeakPolarHBondContact O-CG 3.08Å; R132-L136 PolarHBondContact O-N 2.72Å; R132-L136 VanDerWaalsContact O-N 3.1Å; R132-V222 HydrophobicContact CB-CG1 4.45Å; R132-V222 HydrophobicContact CB-CG2 4.3Å; R132-V222 HydrophobicContact CG-CG1 3.95Å; R132-V222 HydrophobicContact CG-CG2 4.32Å
133	A	97.9	Very high	95.1	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.9	-45.4	178	0	0	0	0	0	112.1	G129 I130 G135 L136 W137 A225 I229	G129-A133 PolarHBondContact O-N 3.16Å; I130-A133 WeakPolarHBondContact O-CB 3.45Å; I130-A133 PolarHBondContact O-N 2.98Å; I130-A133 VanDerWaalsContact O-N 3.1Å; A133-G135 VanDerWaalsContact C-N 3.28Å; A133-G135 PolarHBondContact O-N 2.94Å; A133-L136 WeakPolarHBondContact O-CB 3.44Å; A133-L136 PolarHBondContact O-N 3.34Å; A133-W137 PolarHBondContact O-N 3.13Å; A133-A225 HydrophobicContact CB-CB 3.69Å; A133-I229 HydrophobicContact CB-CD1 3.66Å
134	F	98.1	Very high	95	Very high	4 Å²	4	39 Å²	39	2%	0.018	21%	0.207	C	C	.	.	H	α-helix	trans	-60.9	-37.6	171.5	-80.3	-61.9	0	0	0	112.7	Y111 I130 L136 W137 S138 F145 I156 I158 I229	Y111-F134 AromaticContact CD1-CD2 3.72Å; Y111-F134 HydrophobicContact CD1-CD2 3.72Å; Y111-F134 AromaticContact CD1-CE2 3.47Å; Y111-F134 HydrophobicContact CD1-CE2 3.47Å; Y111-F134 VanDerWaalsContact CD1-CE2 3.47Å; Y111-F134 HydrophobicContact CD1-CG 4.4Å; Y111-F134 AromaticContact CD1-CZ 3.98Å; Y111-F134 HydrophobicContact CD1-CZ 3.98Å; Y111-F134 HydrophobicContact CD2-CD2 4.39Å; Y111-F134 AromaticContact CD2-CE2 3.71Å; Y111-F134 HydrophobicContact CD2-CE2 3.71Å; Y111-F134 HydrophobicContact CD2-CZ 4.48Å; Y111-F134 AromaticContact CE1-CD2 3.56Å; Y111-F134 HydrophobicContact CE1-CD2 3.56Å; Y111-F134 AromaticContact CE1-CE2 3.77Å; Y111-F134 HydrophobicContact CE1-CE2 3.77Å; Y111-F134 HydrophobicContact CE1-CG 4.29Å; Y111-F134 HydrophobicContact CE2-CD2 4.29Å; Y111-F134 HydrophobicContact CE2-CE2 4.02Å; Y111-F134 HydrophobicContact CG-CD2 4.13Å; Y111-F134 AromaticContact CG-CE2 3.44Å; Y111-F134 HydrophobicContact CG-CE2 3.44Å; Y111-F134 VanDerWaalsContact CG-CE2 3.44Å; Y111-F134 AromaticContact CG-CZ 3.88Å; Y111-F134 HydrophobicContact CG-CZ 3.88Å; Y111-F134 AromaticContact CZ-CD2 3.88Å; I130-F134 HydrophobicContact CG2-CD2 3.81Å; I130-F134 HydrophobicContact CG2-CE2 3.65Å; I130-F134 WeakPolarHBondContact O-CD2 2.92Å; I130-F134 PolarHBondContact O-N 2.76Å; F134-L136 VanDerWaalsContact C-N 3.32Å; F134-L136 PolarHBondContact O-N 2.8Å; F134-W137 PolarHBondContact O-N 3.4Å; F134-S138 PolarHBondContact O-N 2.74Å; F134-F145 HydrophobicContact CB-CB 4Å; F134-F145 HydrophobicContact CB-CD2 3.83Å; F134-F145 HydrophobicContact CB-CG 3.95Å; F134-F145 HydrophobicContact CD1-CB 3.91Å; F134-F145 AromaticContact CD1-CD1 3.29Å; F134-F145 HydrophobicContact CD1-CD1 3.29Å; F134-F145 AromaticContact CD1-CD2 3.68Å; F134-F145 HydrophobicContact CD1-CD2 3.68Å; F134-F145 AromaticContact CD1-CE1 3.58Å; F134-F145 HydrophobicContact CD1-CE1 3.58Å; F134-F145 AromaticContact CD1-CE2 3.96Å; F134-F145 HydrophobicContact CD1-CE2 3.96Å; F134-F145 AromaticContact CD1-CG 3.32Å; F134-F145 HydrophobicContact CD1-CG 3.32Å; F134-F145 AromaticContact CD1-CZ 3.91Å; F134-F145 HydrophobicContact CD1-CZ 3.91Å; F134-F145 AromaticContact CE1-CD1 3.5Å; F134-F145 HydrophobicContact CE1-CD1 3.5Å; F134-F145 VanDerWaalsContact CE1-CD1 3.5Å; F134-F145 AromaticContact CE1-CE1 3.71Å; F134-F145 HydrophobicContact CE1-CE1 3.71Å; F134-F145 HydrophobicContact CE1-CG 4.01Å; F134-F145 HydrophobicContact CE1-CZ 4.4Å; F134-F145 HydrophobicContact CG-CB 3.96Å; F134-F145 HydrophobicContact CG-CD1 4.2Å; F134-F145 HydrophobicContact CG-CD2 4.13Å; F134-F145 AromaticContact CG-CG 3.84Å; F134-F145 HydrophobicContact CG-CG 3.84Å; F134-I156 HydrophobicContact CE1-CD1 3.84Å; F134-I156 HydrophobicContact CZ-CD1 4.08Å; F134-I156 HydrophobicContact CZ-CG2 4.32Å; F134-I158 HydrophobicContact CE2-CD1 3.74Å; F134-I158 HydrophobicContact CZ-CD1 3.96Å; F134-I229 HydrophobicContact CD1-CD1 3.71Å; F134-I229 HydrophobicContact CD1-CG1 4.18Å; F134-I229 HydrophobicContact CD1-CG2 3.96Å; F134-I229 HydrophobicContact CD2-CD1 4.04Å; F134-I229 HydrophobicContact CE1-CD1 3.79Å; F134-I229 HydrophobicContact CE1-CG1 3.8Å; F134-I229 HydrophobicContact CE1-CG2 3.87Å; F134-I229 HydrophobicContact CE2-CD1 4.11Å; F134-I229 HydrophobicContact CG-CD1 3.85Å; F134-I229 HydrophobicContact CZ-CD1 3.99Å; F134-I229 HydrophobicContact CZ-CG1 4.03Å
135	G	96.2	Very high	95.1	Very high	18 Å²	18	37.1 Å²	37.1	19%	0.186	19%	0.19	C	C	.	.	H	α-helix	trans	-54.7	-47.1	174	0	0	0	0	0	112.2	A131 R132 A133 W137 S138 D139	A131-G135 PolarHBondContact O-N 3.12Å; R132-G135 PolarHBondContact O-N 3.03Å; A133-G135 VanDerWaalsContact C-N 3.28Å; A133-G135 PolarHBondContact O-N 2.94Å; G135-W137 VanDerWaalsContact C-N 3.31Å; G135-W137 PolarHBondContact O-N 2.86Å; G135-S138 WeakPolarHBondContact CA-OG 3.06Å; G135-S138 PolarHBondContact O-N 2.82Å; G135-S138 PolarHBondContact O-OG 2.87Å; G135-D139 VanDerWaalsContact O-CG 3.31Å; G135-D139 PolarHBondContact O-N 3.42Å
136	L	95.3	Very high	95.1	Very high	26 Å²	26	42.2 Å²	42.2	14%	0.136	21%	0.206	C	C	.	.	H	α-helix	trans	-56.9	-44.4	177.9	-65.2	171	0	0	0	111.7	R132 A133 F134 D139 V222 T226 K255 I257	R132-L136 WeakPolarHBondContact O-CG 3.08Å; R132-L136 PolarHBondContact O-N 2.72Å; R132-L136 VanDerWaalsContact O-N 3.1Å; A133-L136 WeakPolarHBondContact O-CB 3.44Å; A133-L136 PolarHBondContact O-N 3.34Å; F134-L136 VanDerWaalsContact C-N 3.32Å; F134-L136 PolarHBondContact O-N 2.8Å; L136-D139 PolarHBondContact O-N 3.14Å; L136-V222 HydrophobicContact CD1-CG1 4.18Å; L136-T226 HydrophobicContact CD1-CG2 4.1Å; L136-T226 WeakPolarHBondContact CD1-OG1 2.99Å; L136-K255 VanDerWaalsContact CD1-O 3.29Å; L136-K255 WeakPolarHBondContact CD1-O 3.17Å; L136-I257 VanDerWaalsContact C-CD1 3.42Å; L136-I257 HydrophobicContact CB-CD1 3.89Å; L136-I257 HydrophobicContact CB-CG1 4.39Å; L136-I257 VanDerWaalsContact O-CD1 3.29Å; L136-I257 WeakPolarHBondContact O-CD1 3.41Å
137	W	95.4	Very high	95.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-68.9	-40.9	177.4	-73.4	107.2	0	0	0	112.9	A133 F134 G135 D139 V140 S141 F145 T226 I229 G230 L233 L235 I244 M245 I257 E261 L265	A133-W137 PolarHBondContact O-N 3.13Å; F134-W137 PolarHBondContact O-N 3.4Å; G135-W137 VanDerWaalsContact C-N 3.31Å; G135-W137 PolarHBondContact O-N 2.86Å; W137-D139 PolarHBondContact O-N 3.05Å; W137-V140 HydrophobicContact CE3-CG2 4.38Å; W137-V140 WeakPolarHBondContact O-CG2 3.43Å; W137-V140 PolarHBondContact O-N 3.01Å; W137-S141 VanDerWaalsContact O-CB 3.23Å; W137-S141 WeakPolarHBondContact O-CB 3.36Å; W137-S141 PolarHBondContact O-N 3.36Å; W137-S141 PolarHBondContact O-OG 2.98Å; W137-F145 HydrophobicContact CB-CE2 4.09Å; W137-F145 HydrophobicContact CB-CZ 4.36Å; W137-T226 HydrophobicContact CZ2-CG2 4.47Å; W137-T226 VanDerWaalsContact CZ2-O 3.3Å; W137-T226 WeakPolarHBondContact CZ2-O 3.48Å; W137-T226 PolarHBondContact NE1-O 3.07Å; W137-I229 HydrophobicContact CB-CG2 4.42Å; W137-I229 HydrophobicContact CD2-CG2 4.45Å; W137-I229 HydrophobicContact CG-CG2 3.8Å; W137-G230 VanDerWaalsContact CZ2-CA 3.41Å; W137-L233 HydrophobicContact CB-CD1 3.99Å; W137-L233 HydrophobicContact CD2-CD1 3.79Å; W137-L233 HydrophobicContact CE3-CD1 3.81Å; W137-L233 HydrophobicContact CG-CD1 3.9Å; W137-L235 HydrophobicContact CH2-CD1 3.39Å; W137-L235 HydrophobicContact CZ2-CD1 4.43Å; W137-L235 HydrophobicContact CZ3-CD1 3.63Å; W137-I244 HydrophobicContact CZ2-CG2 4.33Å; W137-M245 HydrophobicContact CH2-CG 4.43Å; W137-M245 HydrophobicContact CH2-SD 4.39Å; W137-M245 HydrophobicContact CZ2-SD 4.16Å; W137-I257 HydrophobicContact CB-CD1 4.45Å; W137-I257 HydrophobicContact CD2-CD1 3.56Å; W137-I257 HydrophobicContact CE3-CD1 3.64Å; W137-I257 HydrophobicContact CG-CD1 3.93Å; W137-I257 HydrophobicContact CH2-CD1 4.45Å; W137-I257 HydrophobicContact CH2-CG2 4.46Å; W137-I257 HydrophobicContact CZ2-CD1 4.39Å; W137-I257 HydrophobicContact CZ3-CD1 4.1Å; W137-I257 HydrophobicContact CZ3-CG2 4.21Å; W137-E261 HydrophobicContact CH2-CB 3.93Å; W137-E261 HydrophobicContact CH2-CG 3.91Å; W137-E261 HydrophobicContact CZ3-CB 4.05Å; W137-L265 HydrophobicContact CE3-CD1 3.76Å; W137-L265 HydrophobicContact CZ3-CD1 3.68Å; W137-L265 HydrophobicContact CZ3-CG 4.3Å
138	S	92.9	Very high	95.1	Very high	29 Å²	29	40.6 Å²	40.6	20%	0.203	20%	0.203	C	C	.	.	H	α-helix	trans	-64.5	-28.8	177.3	73.9	0	0	0	0	113.1	F134 G135 V140 S141 F143 R274	F134-S138 PolarHBondContact O-N 2.74Å; G135-S138 WeakPolarHBondContact CA-OG 3.06Å; G135-S138 PolarHBondContact O-N 2.82Å; G135-S138 PolarHBondContact O-OG 2.87Å; S138-V140 PolarHBondContact O-N 2.8Å; S138-S141 VanDerWaalsContact O-O 3.09Å; S138-F143 WeakPolarHBondContact CB-O 3.48Å; S138-R274 PolarHBondContact O-NH1 2.98Å
139	D	88.9	Confident	95	Very high	57 Å²	57	37.7 Å²	37.7	31%	0.305	20%	0.201	S	C	.	.	H	α-helix	trans	-67.9	-25	177.5	-77.2	-22.4	0	0	0	112.4	G135 L136 W137 R296	G135-D139 VanDerWaalsContact O-CG 3.31Å; G135-D139 PolarHBondContact O-N 3.42Å; L136-D139 PolarHBondContact O-N 3.14Å; W137-D139 PolarHBondContact O-N 3.05Å; D139-R296 VanDerWaalsContact O-CG 3.25Å; D139-R296 WeakPolarHBondContact O-CG 3.44Å; D139-R296 IonicContact OD1-CZ 2.91Å; D139-R296 IonicContact OD1-NE 2.7Å; D139-R296 IonicContact OD1-NH1 3.15Å; D139-R296 PolarHBondContact OD1-NH1 3.46Å; D139-R296 IonicContact OD1-NH2 2.65Å; D139-R296 PolarHBondContact OD1-NH2 3.04Å
140	V	87	Confident	94.5	Very high	40 Å²	40	40.7 Å²	40.7	24%	0.242	23%	0.225	C	C	.	.	H	α-helix	trans	-118	-7	-175.5	-57.1	0	0	0	0	114.1	W137 S138 I257 V262 R274	W137-V140 HydrophobicContact CE3-CG2 4.38Å; W137-V140 WeakPolarHBondContact O-CG2 3.43Å; W137-V140 PolarHBondContact O-N 3.01Å; S138-V140 PolarHBondContact O-N 2.8Å; V140-I257 HydrophobicContact CG2-CD1 3.73Å; V140-I257 HydrophobicContact CG2-CG2 4.12Å; V140-V262 HydrophobicContact CB-CG2 4.06Å; V140-V262 HydrophobicContact CG2-CG2 4.39Å; V140-R274 PolarHBondContact O-NH2 2.95Å
141	S	88	Confident	94.1	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.007	26%	0.262	C	S	.	.	S	Bend	trans	-130.9	157.4	-176.1	78.3	0	0	0	0	112.6	W137 S138 F143 R274	W137-S141 VanDerWaalsContact O-CB 3.23Å; W137-S141 WeakPolarHBondContact O-CB 3.36Å; W137-S141 PolarHBondContact O-N 3.36Å; W137-S141 PolarHBondContact O-OG 2.98Å; S138-S141 VanDerWaalsContact O-O 3.09Å; S141-F143 PolarHBondContact O-N 3.45Å; S141-F143 WeakPolarHBondContact OG-CB 3.21Å; S141-F143 WeakPolarHBondContact OG-CD2 3.26Å; S141-F143 PolarHBondContact OG-N 3.26Å; S141-R274 VanDerWaalsContact CA-NH2 3.3Å; S141-R274 PolarHBondContact O-NH1 2.85Å; S141-R274 PolarHBondContact O-NH2 2.86Å
142	P	87.3	Confident	94	Very high	50 Å²	50	49.4 Å²	49.4	33%	0.325	26%	0.263	S	S	.	.	S	Bend	trans	-64.5	-5.7	176.3	27.9	-36.6	0	0	0	114	F107	F107-P142 HydrophobicContact CD1-CB 3.9Å; F107-P142 HydrophobicContact CD1-CG 3.51Å; F107-P142 HydrophobicContact CD2-CB 4.41Å; F107-P142 HydrophobicContact CE1-CB 4.11Å; F107-P142 HydrophobicContact CE1-CG 3.37Å; F107-P142 HydrophobicContact CG-CB 4.06Å; F107-P142 HydrophobicContact CG-CG 4.18Å; F107-P142 HydrophobicContact CZ-CB 4.45Å; F107-P142 HydrophobicContact CZ-CG 3.91Å
143	F	93.1	Very high	93.8	Very high	5 Å²	5	49.4 Å²	49.4	2%	0.022	27%	0.269	C	S	.	.			trans	-69.7	143.7	-178.4	-69.9	-82.3	0	0	0	113.1	W104 K106 F107 L109 S138 S141 F145 L233 L265 Y269	W104-F143 HydrophobicContact CB-CE1 4.12Å; W104-F143 HydrophobicContact CB-CZ 4.45Å; W104-F143 HydrophobicContact CG-CE1 4.37Å; K106-F143 WeakPolarHBondContact O-CE1 3.43Å; F107-F143 HydrophobicContact CB-CD1 4.34Å; F107-F143 AromaticContact CD1-CD1 3.97Å; F107-F143 HydrophobicContact CD1-CD1 3.97Å; F107-F143 HydrophobicContact CD1-CD2 4.22Å; F107-F143 AromaticContact CD1-CE1 3.73Å; F107-F143 HydrophobicContact CD1-CE1 3.73Å; F107-F143 AromaticContact CD1-CE2 3.99Å; F107-F143 HydrophobicContact CD1-CE2 3.99Å; F107-F143 HydrophobicContact CD1-CG 4.2Å; F107-F143 AromaticContact CD1-CZ 3.73Å; F107-F143 HydrophobicContact CD1-CZ 3.73Å; F107-F143 HydrophobicContact CE1-CE1 4.42Å; F107-F143 HydrophobicContact CE1-CE2 4.17Å; F107-F143 AromaticContact CE1-CZ 4Å; F107-F143 HydrophobicContact CE1-CZ 4Å; F107-F143 CarbonylContact O-C 3.5Å; F107-F143 VanDerWaalsContact O-CA 3.27Å; F107-F143 WeakPolarHBondContact O-CA 3.31Å; F107-F143 WeakPolarHBondContact O-CD1 3.21Å; L109-F143 HydrophobicContact CD1-CD1 3.53Å; L109-F143 HydrophobicContact CD1-CE1 3.65Å; L109-F143 HydrophobicContact CG-CD1 3.95Å; L109-F143 HydrophobicContact CG-CE1 4.2Å; S138-F143 WeakPolarHBondContact CB-O 3.48Å; S141-F143 PolarHBondContact O-N 3.45Å; S141-F143 WeakPolarHBondContact OG-CB 3.21Å; S141-F143 WeakPolarHBondContact OG-CD2 3.26Å; S141-F143 PolarHBondContact OG-N 3.26Å; F143-F145 HydrophobicContact CB-CE1 4.18Å; F143-F145 HydrophobicContact CB-CE2 3.69Å; F143-F145 HydrophobicContact CB-CZ 3.45Å; F143-F145 VanDerWaalsContact CB-CZ 3.45Å; F143-F145 HydrophobicContact CG-CZ 4.11Å; F143-L233 HydrophobicContact CD1-CD2 4.04Å; F143-L233 HydrophobicContact CD2-CD1 4.38Å; F143-L233 HydrophobicContact CD2-CD2 3.89Å; F143-L233 HydrophobicContact CE1-CD2 4.06Å; F143-L233 HydrophobicContact CE2-CD2 3.92Å; F143-L233 HydrophobicContact CG-CD2 3.97Å; F143-L233 HydrophobicContact CZ-CD2 4Å; F143-L265 HydrophobicContact CE2-CD2 4.4Å; F143-Y269 HydrophobicContact CE2-CD1 4.28Å; F143-Y269 AromaticContact CE2-CD2 3.73Å; F143-Y269 HydrophobicContact CE2-CD2 3.73Å; F143-Y269 HydrophobicContact CE2-CE1 4.2Å; F143-Y269 AromaticContact CE2-CE2 3.64Å; F143-Y269 HydrophobicContact CE2-CE2 3.64Å; F143-Y269 HydrophobicContact CE2-CG 4.05Å; F143-Y269 AromaticContact CE2-CZ 3.89Å; F143-Y269 AromaticContact CZ-CD1 3.87Å; F143-Y269 HydrophobicContact CZ-CD1 3.87Å; F143-Y269 HydrophobicContact CZ-CD2 4.06Å; F143-Y269 AromaticContact CZ-CE1 3.53Å; F143-Y269 HydrophobicContact CZ-CE1 3.53Å; F143-Y269 AromaticContact CZ-CE2 3.73Å; F143-Y269 HydrophobicContact CZ-CE2 3.73Å; F143-Y269 HydrophobicContact CZ-CG 4.12Å; F143-Y269 AromaticContact CZ-CZ 3.45Å; F143-Y269 VanDerWaalsContact CZ-CZ 3.45Å
144	S	94.9	Very high	93.8	Very high	57 Å²	57	49.9 Å²	49.9	40%	0.399	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	137	166.4	65	0	0	0	0	109	F107 L109	F107-S144 PolarHBondContact O-N 2.98Å; L109-S144 PolarHBondContact N-O 3.41Å
145	F	98.1	Very high	93.8	Very high	36 Å²	36	51.3 Å²	51.3	16%	0.158	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	138.3	-175.6	-53.6	-83.5	0	0	0	110.3	L109 Y111 F134 W137 F143 I156 L233	L109-F145 HydrophobicContact CB-CD1 4.03Å; L109-F145 HydrophobicContact CB-CE1 4.28Å; L109-F145 HydrophobicContact CD1-CE1 3.93Å; L109-F145 VanDerWaalsContact O-CA 3.31Å; L109-F145 WeakPolarHBondContact O-CA 3.15Å; Y111-F145 HydrophobicContact CD1-CB 4.16Å; Y111-F145 HydrophobicContact CE1-CB 4.27Å; F134-F145 HydrophobicContact CB-CB 4Å; F134-F145 HydrophobicContact CB-CD2 3.83Å; F134-F145 HydrophobicContact CB-CG 3.95Å; F134-F145 HydrophobicContact CD1-CB 3.91Å; F134-F145 AromaticContact CD1-CD1 3.29Å; F134-F145 HydrophobicContact CD1-CD1 3.29Å; F134-F145 AromaticContact CD1-CD2 3.68Å; F134-F145 HydrophobicContact CD1-CD2 3.68Å; F134-F145 AromaticContact CD1-CE1 3.58Å; F134-F145 HydrophobicContact CD1-CE1 3.58Å; F134-F145 AromaticContact CD1-CE2 3.96Å; F134-F145 HydrophobicContact CD1-CE2 3.96Å; F134-F145 AromaticContact CD1-CG 3.32Å; F134-F145 HydrophobicContact CD1-CG 3.32Å; F134-F145 AromaticContact CD1-CZ 3.91Å; F134-F145 HydrophobicContact CD1-CZ 3.91Å; F134-F145 AromaticContact CE1-CD1 3.5Å; F134-F145 HydrophobicContact CE1-CD1 3.5Å; F134-F145 VanDerWaalsContact CE1-CD1 3.5Å; F134-F145 AromaticContact CE1-CE1 3.71Å; F134-F145 HydrophobicContact CE1-CE1 3.71Å; F134-F145 HydrophobicContact CE1-CG 4.01Å; F134-F145 HydrophobicContact CE1-CZ 4.4Å; F134-F145 HydrophobicContact CG-CB 3.96Å; F134-F145 HydrophobicContact CG-CD1 4.2Å; F134-F145 HydrophobicContact CG-CD2 4.13Å; F134-F145 AromaticContact CG-CG 3.84Å; F134-F145 HydrophobicContact CG-CG 3.84Å; W137-F145 HydrophobicContact CB-CE2 4.09Å; W137-F145 HydrophobicContact CB-CZ 4.36Å; F143-F145 HydrophobicContact CB-CE1 4.18Å; F143-F145 HydrophobicContact CB-CE2 3.69Å; F143-F145 HydrophobicContact CB-CZ 3.45Å; F143-F145 VanDerWaalsContact CB-CZ 3.45Å; F143-F145 HydrophobicContact CG-CZ 4.11Å; F145-I156 HydrophobicContact CD1-CD1 4.27Å; F145-I156 HydrophobicContact CE1-CD1 4.23Å; F145-L233 HydrophobicContact CE1-CD2 4.07Å; F145-L233 HydrophobicContact CZ-CD1 4.22Å; F145-L233 HydrophobicContact CZ-CD2 3.94Å
146	R	98	Very high	93.9	Very high	146 Å²	146	50.5 Å²	50.5	55%	0.551	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.1	124.9	175.9	-176.2	178.5	71.5	105	0.8	110.1	L109 T110 Y111	L109-R146 PolarHBondContact O-N 3.42Å; L109-R146 VanDerWaalsContact O-N 3.08Å; T110-R146 CarbonylContact C-O 3.58Å; T110-R146 VanDerWaalsContact CA-O 3.27Å; T110-R146 WeakPolarHBondContact CA-O 3.45Å; Y111-R146 PolarHBondContact N-O 3.1Å
147	E	98.1	Very high	94	Very high	64 Å²	64	52.2 Å²	52.2	30%	0.299	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	135.1	169.4	-163.7	169	150	0	0	109.6	Y111 R127	Y111-E147 HydrophobicContact CD2-CB 4.46Å; Y111-E147 HydrophobicContact CD2-CG 4.24Å; Y111-E147 HydrophobicContact CE1-CB 4.02Å; Y111-E147 HydrophobicContact CE2-CB 3.78Å; Y111-E147 HydrophobicContact CE2-CG 3.63Å; Y111-E147 CarbonylContact O-C 3.51Å; Y111-E147 VanDerWaalsContact O-CA 3.28Å; Y111-E147 WeakPolarHBondContact O-CA 3.45Å; Y111-E147 PolarHBondContact OH-OE2 2.89Å; Y111-E147 VanDerWaalsContact OH-OE2 3.1Å; R127-E147 WeakPolarHBondContact CD-OE1 3.45Å; R127-E147 IonicContact NE-OE1 2.73Å; R127-E147 PolarHBondContact NE-OE1 3.48Å
148	V	98	Very high	94.1	Very high	7 Å²	7	52.2 Å²	52.2	4%	0.042	28%	0.279	C	S	.	.			trans	-118.6	154.6	172.1	-61.3	0	0	0	0	110.7	T110 Y111 K112 E152 A154	T110-V148 HydrophobicContact CG2-CG1 3.72Å; Y111-V148 PolarHBondContact O-N 2.77Å; K112-V148 HydrophobicContact CB-CG2 4.07Å; V148-E152 HydrophobicContact CB-CB 4.16Å; V148-E152 HydrophobicContact CG2-CB 4.18Å; V148-A154 HydrophobicContact CG2-CB 3.7Å
149	P	94.7	Very high	94.2	Very high	64 Å²	64	50.9 Å²	50.9	42%	0.416	27%	0.27	S	S	.	.			trans	-53.1	155.6	172	-27.4	36.9	0	0	0	113.3	D151 E152	P149-D151 WeakPolarHBondContact CB-OD1 3.43Å; P149-D151 PolarHBondContact O-N 2.73Å; P149-E152 HydrophobicContact CB-CG 4.46Å; P149-E152 PolarHBondContact O-N 2.82Å; P149-E152 VanDerWaalsContact O-N 3.13Å
150	A	87.4	Confident	94.6	Very high	63 Å²	63	48.5 Å²	48.5	52%	0.521	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-28.8	-174.7	0	0	0	0	0	113.5	K112	K112-A150 PolarHBondContact NZ-O 3.41Å; K112-A150 VanDerWaalsContact NZ-O 3.09Å
151	D	91.4	Very high	94.9	Very high	144 Å²	144	48.8 Å²	48.8	77%	0.77	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-13.3	177.8	58.3	-50.1	0	0	0	113.8	P149	P149-D151 WeakPolarHBondContact CB-OD1 3.43Å; P149-D151 PolarHBondContact O-N 2.73Å
152	E	94.9	Very high	94.9	Very high	82 Å²	82	52 Å²	52	38%	0.383	27%	0.274	S	S	.	.	S	Bend	trans	-87.3	150.6	171.9	-70.6	-175.5	-150.2	0	0	111.4	K112 V148 P149	K112-E152 WeakPolarHBondContact CD-O 3.27Å; K112-E152 WeakPolarHBondContact CE-O 3.32Å; K112-E152 PolarHBondContact NZ-O 3.4Å; V148-E152 HydrophobicContact CB-CB 4.16Å; V148-E152 HydrophobicContact CG2-CB 4.18Å; P149-E152 HydrophobicContact CB-CG 4.46Å; P149-E152 PolarHBondContact O-N 2.82Å; P149-E152 VanDerWaalsContact O-N 3.13Å
153	E	94.6	Very high	94.7	Very high	144 Å²	144	51.1 Å²	51.1	67%	0.673	27%	0.272	S	S	*	.			trans	-71.7	143.1	168.8	-74.7	-55.8	132.7	0	0	111.2
154	A	97.3	Very high	94.2	Very high	11 Å²	11	55.5 Å²	55.5	9%	0.091	30%	0.295	C	S	.	.			trans	-134.4	146.7	-178.4	0	0	0	0	0	110.9	T110 K112 V148 I156	T110-A154 WeakPolarHBondContact OG1-CA 3.42Å; K112-A154 HydrophobicContact CB-CB 4.01Å; K112-A154 HydrophobicContact CD-CB 3.97Å; K112-A154 HydrophobicContact CG-CB 3.73Å; V148-A154 HydrophobicContact CG2-CB 3.7Å; A154-I156 VanDerWaalsContact C-N 3.25Å; A154-I156 PolarHBondContact O-N 3.07Å
155	D	97.8	Very high	93.7	Very high	34 Å²	34	53 Å²	53	18%	0.182	28%	0.277	C	S	.	.	S	Bend	trans	-64.9	-35.1	173.8	-60.3	-50.3	0	0	0	111.6	W104 K106 L109 T110	W104-D155 HydrophobicContact CH2-CB 4.18Å; W104-D155 WeakPolarHBondContact CH2-O 3.38Å; W104-D155 HydrophobicContact CZ3-CB 4.38Å; K106-D155 VanDerWaalsContact CE-CG 3.48Å; K106-D155 VanDerWaalsContact CE-OD1 3.24Å; K106-D155 WeakPolarHBondContact CE-OD1 3.31Å; K106-D155 VanDerWaalsContact CE-OD2 3.24Å; K106-D155 WeakPolarHBondContact CE-OD2 3.49Å; K106-D155 IonicContact NZ-OD1 3.63Å; K106-D155 PolarHBondContact NZ-OD1 3.45Å; K106-D155 IonicContact NZ-OD2 2.74Å; K106-D155 PolarHBondContact NZ-OD2 3.39Å; L109-D155 WeakPolarHBondContact CA-OD2 3.3Å; L109-D155 HydrophobicContact CB-CB 4.46Å; L109-D155 HydrophobicContact CD2-CB 4.2Å; T110-D155 PolarHBondContact N-OD2 2.5Å; T110-D155 WeakPolarHBondContact O-CB 3.4Å; T110-D155 PolarHBondContact O-N 3.17Å; T110-D155 PolarHBondContact OG1-N 2.87Å; T110-D155 VanDerWaalsContact OG1-N 3.17Å; T110-D155 PolarHBondContact OG1-OD2 2.86Å
156	I	98.3	Very high	93	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	121.6	-177.4	-53	168.5	0	0	0	110.3	W104 L109 T110 Y111 K112 F134 F145 A154 I158 G193 I195 V232	W104-I156 HydrophobicContact CZ2-CG1 4.33Å; L109-I156 HydrophobicContact CB-CD1 4.25Å; L109-I156 HydrophobicContact CD1-CD1 4.14Å; T110-I156 PolarHBondContact O-N 2.94Å; Y111-I156 CarbonylContact C-O 3.49Å; Y111-I156 WeakPolarHBondContact CA-O 3.11Å; K112-I156 PolarHBondContact N-O 3.5Å; F134-I156 HydrophobicContact CE1-CD1 3.84Å; F134-I156 HydrophobicContact CZ-CD1 4.08Å; F134-I156 HydrophobicContact CZ-CG2 4.32Å; F145-I156 HydrophobicContact CD1-CD1 4.27Å; F145-I156 HydrophobicContact CE1-CD1 4.23Å; A154-I156 VanDerWaalsContact C-N 3.25Å; A154-I156 PolarHBondContact O-N 3.07Å; I156-I158 HydrophobicContact CG2-CD1 4.39Å; I156-I158 HydrophobicContact CG2-CG1 4.05Å; I156-G193 CarbonylContact C-O 3.4Å; I156-G193 WeakPolarHBondContact CA-O 3.24Å; I156-I195 HydrophobicContact CG2-CD1 4.42Å; I156-I195 HydrophobicContact CG2-CG1 4.48Å; I156-V232 HydrophobicContact CB-CG1 4.39Å; I156-V232 HydrophobicContact CD1-CG1 3.53Å; I156-V232 HydrophobicContact CG1-CG1 3.59Å; I156-V232 HydrophobicContact CG2-CG1 3.93Å
157	K	97.6	Very high	91.9	Very high	62 Å²	62	52 Å²	52	27%	0.27	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	129.4	177.1	-59.7	170.4	-169.7	166.5	0	109.7	K112 L114 G193 E194 I195	K112-K157 HydrophobicContact CG-CG 4.49Å; L114-K157 HydrophobicContact CD1-CB 4.07Å; K157-G193 PolarHBondContact N-O 3.2Å; K157-E194 HydrophobicContact CB-CG 4.24Å; K157-E194 IonicContact NZ-OE1 3.35Å; K157-E194 CarbonylContact O-C 3.54Å; K157-E194 WeakPolarHBondContact O-CA 3.24Å; K157-I195 PolarHBondContact O-N 2.76Å
158	I	97.9	Very high	91.1	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	129.4	-176	-56	175.8	0	0	0	108.9	Y111 K112 L113 L114 I130 F134 I156 I195 F197	Y111-I158 HydrophobicContact CD2-CD1 4.1Å; K112-I158 PolarHBondContact O-N 3.04Å; L113-I158 CarbonylContact C-O 3.38Å; L113-I158 WeakPolarHBondContact CA-O 3.29Å; L113-I158 HydrophobicContact CD2-CB 3.78Å; L113-I158 HydrophobicContact CD2-CD1 4.19Å; L113-I158 HydrophobicContact CD2-CG2 3.82Å; L114-I158 PolarHBondContact N-O 3.24Å; I130-I158 HydrophobicContact CG2-CD1 3.77Å; F134-I158 HydrophobicContact CE2-CD1 3.74Å; F134-I158 HydrophobicContact CZ-CD1 3.96Å; I156-I158 HydrophobicContact CG2-CD1 4.39Å; I156-I158 HydrophobicContact CG2-CG1 4.05Å; I158-I195 WeakPolarHBondContact CA-O 3.42Å; I158-I195 HydrophobicContact CD1-CD1 4.3Å; I158-I195 HydrophobicContact CG1-CB 4.2Å; I158-I195 HydrophobicContact CG1-CD1 4.21Å; I158-I195 HydrophobicContact CG1-CG1 4.36Å; I158-I195 HydrophobicContact CG2-CB 4.41Å; I158-F197 HydrophobicContact CG2-CD2 3.92Å; I158-F197 HydrophobicContact CG2-CE2 3.58Å
159	G	95.8	Very high	90.1	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	156.2	176.9	0	0	0	0	0	113	Y161 I195 H196 F197	G159-Y161 VanDerWaalsContact C-CE2 3.5Å; G159-Y161 VanDerWaalsContact CA-CE2 3.47Å; G159-I195 PolarHBondContact N-O 2.81Å; G159-H196 CarbonylContact O-C 3.51Å; G159-H196 WeakPolarHBondContact O-CA 3.03Å; G159-F197 PolarHBondContact O-N 2.97Å
160	F	96.3	Very high	89.2	Confident	7 Å²	7	63.9 Å²	63.9	3%	0.031	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.1	169.7	-61.5	-93.7	0	0	0	107.8	S115 P117 T126 F197 D199 W203 I221	S115-F160 WeakPolarHBondContact O-CD2 3.4Å; S115-F160 PolarHBondContact OG-N 3.06Å; S115-F160 PolarHBondContact OG-O 2.93Å; P117-F160 HydrophobicContact CB-CD1 4.36Å; P117-F160 HydrophobicContact CG-CD1 3.52Å; P117-F160 HydrophobicContact CG-CD2 4.21Å; P117-F160 HydrophobicContact CG-CE1 3.46Å; P117-F160 VanDerWaalsContact CG-CE1 3.46Å; P117-F160 HydrophobicContact CG-CE2 4.16Å; P117-F160 HydrophobicContact CG-CG 3.91Å; P117-F160 HydrophobicContact CG-CZ 3.8Å; T126-F160 HydrophobicContact CG2-CE2 3.8Å; T126-F160 HydrophobicContact CG2-CZ 3.84Å; F160-F197 WeakPolarHBondContact CA-O 3.29Å; F160-F197 HydrophobicContact CD1-CB 3.32Å; F160-F197 HydrophobicContact CD1-CD2 4.38Å; F160-F197 AromaticContact CD1-CG 4Å; F160-F197 HydrophobicContact CD1-CG 4Å; F160-F197 HydrophobicContact CE1-CB 3.4Å; F160-F197 VanDerWaalsContact CE1-CB 3.4Å; F160-F197 HydrophobicContact CE1-CD1 4.15Å; F160-F197 AromaticContact CE1-CD2 3.84Å; F160-F197 HydrophobicContact CE1-CD2 3.84Å; F160-F197 AromaticContact CE1-CG 3.54Å; F160-F197 HydrophobicContact CE1-CG 3.54Å; F160-F197 HydrophobicContact CE2-CD2 4.36Å; F160-F197 HydrophobicContact CG-CB 4.1Å; F160-F197 HydrophobicContact CZ-CB 4.25Å; F160-F197 AromaticContact CZ-CD2 3.82Å; F160-F197 HydrophobicContact CZ-CD2 3.82Å; F160-F197 HydrophobicContact CZ-CE2 4.36Å; F160-F197 HydrophobicContact CZ-CG 4.01Å; F160-D199 HydrophobicContact CB-CB 4.22Å; F160-W203 AromaticContact CD1-NE1 3.97Å; F160-W203 HydrophobicContact CE1-CD2 4.48Å; F160-W203 HydrophobicContact CE1-CG 4.48Å; F160-I221 HydrophobicContact CE1-CD1 4.25Å; F160-I221 HydrophobicContact CZ-CD1 3.84Å
161	Y	93.3	Very high	88.5	Confident	46 Å²	46	62.6 Å²	62.6	18%	0.18	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	148.8	-172.9	-58.7	-88.2	0	0	0	112	G159 H165 T166 H196 F197 D199	G159-Y161 VanDerWaalsContact C-CE2 3.5Å; G159-Y161 VanDerWaalsContact CA-CE2 3.47Å; Y161-H165 HydrophobicContact CD1-CB 3.94Å; Y161-H165 HydrophobicContact CG-CB 3.76Å; Y161-T166 HydrophobicContact CE1-CG2 4.42Å; Y161-H196 HydrophobicContact CD2-CB 3.77Å; Y161-H196 AromaticContact CD2-CG 3.92Å; Y161-H196 HydrophobicContact CE2-CB 4.04Å; Y161-H196 AromaticContact CE2-CD2 3.45Å; Y161-H196 VanDerWaalsContact CE2-CD2 3.45Å; Y161-H196 WeakPolarHBondContact CE2-CD2 3.19Å; Y161-H196 AromaticContact CE2-CG 3.77Å; Y161-F197 PolarHBondContact N-O 3.46Å; Y161-D199 WeakPolarHBondContact O-CB 3.4Å; Y161-D199 PolarHBondContact O-N 3.19Å
162	P	88.6	Confident	87.1	Confident	69 Å²	69	62.3 Å²	62.3	45%	0.448	31%	0.306	S	S	.	.			trans	-67.7	166.7	167	31.7	-35.2	0	0	0	110.6	N164 H165	P162-N164 VanDerWaalsContact C-N 3.33Å; P162-N164 CarbonylContact O-C 3.57Å; P162-N164 PolarHBondContact O-N 3.38Å; P162-N164 VanDerWaalsContact O-N 3.12Å; P162-H165 PolarHBondContact O-ND1 3.15Å
163	A	82.7	Confident	85.5	Confident	32 Å²	32	61.4 Å²	61.4	26%	0.264	30%	0.303	S	S	.	.	S	Bend	trans	-32.1	-60	175.4	0	0	0	0	0	114.4	H165 C176 F177 H200	A163-H165 PolarHBondContact O-N 2.98Å; A163-H165 PolarHBondContact O-ND1 3.29Å; A163-H165 VanDerWaalsContact O-ND1 3.1Å; A163-C176 WeakPolarHBondContact O-CA 3.27Å; A163-C176 VanDerWaalsContact O-CB 3.24Å; A163-C176 WeakPolarHBondContact O-CB 3.46Å; A163-F177 WeakPolarHBondContact CB-O 3.47Å; A163-F177 PolarHBondContact O-N 2.94Å; A163-F177 VanDerWaalsContact O-N 3.12Å; A163-H200 PolarHBondContact N-CE1 3.28Å
164	N	82.1	Confident	84.6	Confident	97 Å²	97	54.6 Å²	54.6	52%	0.519	27%	0.272	S	S	.	.	S	Bend	trans	-81.2	111.6	173	-177.7	10.1	0	0	0	110.5	P162 W169	P162-N164 VanDerWaalsContact C-N 3.33Å; P162-N164 CarbonylContact O-C 3.57Å; P162-N164 PolarHBondContact O-N 3.38Å; P162-N164 VanDerWaalsContact O-N 3.12Å; N164-W169 VanDerWaalsContact CG-CD1 3.45Å; N164-W169 PolarHBondContact ND2-NE1 2.96Å; N164-W169 PolarHBondContact OD1-NE1 3.4Å
165	H	84.2	Confident	83.7	Confident	5 Å²	5	58.3 Å²	58.3	2%	0.023	29%	0.287	C	S	.	.			trans	-144.4	149	179.9	66.9	-76.1	0	0	0	113.6	Y161 P162 A163 D167 C168 H174 F177 H186 H196	Y161-H165 HydrophobicContact CD1-CB 3.94Å; Y161-H165 HydrophobicContact CG-CB 3.76Å; P162-H165 PolarHBondContact O-ND1 3.15Å; A163-H165 PolarHBondContact O-N 2.98Å; A163-H165 PolarHBondContact O-ND1 3.29Å; A163-H165 VanDerWaalsContact O-ND1 3.1Å; H165-D167 PolarHBondContact O-N 3.44Å; H165-C168 PolarHBondContact N-SG 2.93Å; H165-C168 WeakPolarHBondContact O-CB 3.16Å; H165-C168 PolarHBondContact O-N 2.89Å; H165-C168 PolarHBondContact O-SG 3.38Å; H165-H174 AromaticContact CD2-CE1 3.67Å; H165-H174 AromaticContact CD2-NE2 3.47Å; H165-H174 PolarHBondContact CD2-NE2 3.49Å; H165-H174 AromaticContact CE1-NE2 3.77Å; H165-H174 AromaticContact NE2-CE1 3.71Å; H165-H174 AromaticContact NE2-NE2 3.06Å; H165-H174 PolarHBondContact NE2-NE2 3.29Å; H165-H174 PolarHBondContact O-CE1 3.35Å; H165-F177 AromaticContact CE1-CD2 3.31Å; H165-F177 WeakPolarHBondContact CE1-CD2 3.25Å; H165-F177 AromaticContact CE1-CE2 3.23Å; H165-F177 WeakPolarHBondContact CE1-CE2 3.46Å; H165-F177 AromaticContact CE1-CG 3.81Å; H165-F177 AromaticContact CE1-CZ 3.67Å; H165-F177 AromaticContact ND1-CD2 3.61Å; H165-F177 AromaticContact ND1-CE2 3.78Å; H165-F177 AromaticContact NE2-CE2 3.49Å; H165-F177 WeakPolarHBondContact NE2-CE2 3.39Å; H165-F177 AromaticContact NE2-CZ 3.71Å; H165-H186 AromaticContact CE1-CE1 3.91Å; H165-H186 AromaticContact CE1-NE2 3.67Å; H165-H186 AromaticContact NE2-CE1 3.57Å; H165-H186 AromaticContact NE2-NE2 3.02Å; H165-H186 PolarHBondContact NE2-NE2 2.81Å; H165-H196 AromaticContact CD2-CG 3.89Å; H165-H196 AromaticContact CD2-ND1 3.3Å; H165-H196 PolarHBondContact CD2-ND1 2.79Å; H165-H196 VanDerWaalsContact CD2-ND1 3.3Å; H165-H196 AromaticContact NE2-CG 3.83Å; H165-H196 AromaticContact NE2-ND1 3.26Å; H165-H196 PolarHBondContact NE2-ND1 3.22Å
166	T	83.4	Confident	83.2	Confident	83 Å²	83	58.1 Å²	58.1	51%	0.509	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	40.4	-117.2	-174.5	71.1	0	0	0	0	112.9	Y161 H174	Y161-T166 HydrophobicContact CE1-CG2 4.42Å; T166-H174 PolarHBondContact OG1-CE1 3.29Å; T166-H174 PolarHBondContact OG1-ND1 2.92Å
167	D	75.1	Confident	82.8	Confident	77 Å²	77	58.6 Å²	58.6	41%	0.412	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	19.1	-177.5	66.8	-32.9	0	0	0	113.3	H165 W169 Q170 S171 H174	H165-D167 PolarHBondContact O-N 3.44Å; D167-W169 VanDerWaalsContact C-N 3.26Å; D167-W169 PolarHBondContact O-N 3.17Å; D167-W169 VanDerWaalsContact O-N 3.08Å; D167-Q170 PolarHBondContact O-N 3.32Å; D167-S171 PolarHBondContact O-N 2.62Å; D167-S171 WeakPolarHBondContact OD2-CB 3.1Å; D167-H174 IonicContact OD1-CE1 2.99Å; D167-H174 IonicContact OD1-CG 3.68Å; D167-H174 IonicContact OD1-ND1 3.91Å; D167-H174 PolarHBondContact OD1-ND1 3.42Å
168	C	81.3	Confident	82.3	Confident	7 Å²	7	61.2 Å²	61.2	5%	0.047	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-23.5	-166.3	76.3	0	0	0	0	115.8	H165 H174 C176	H165-C168 PolarHBondContact N-SG 2.93Å; H165-C168 WeakPolarHBondContact O-CB 3.16Å; H165-C168 PolarHBondContact O-N 2.89Å; H165-C168 PolarHBondContact O-SG 3.38Å; C168-H174 CarbonylContact C-O 3.53Å; C168-H174 WeakPolarHBondContact CA-O 3.41Å; C168-H174 PolarHBondContact N-ND1 2.65Å; C168-H174 VanDerWaalsContact O-O 3.08Å; C168-C176 HydrophobicContact CB-CB 3.93Å; C168-C176 WeakPolarHBondContact CB-SG 3.23Å; C168-C176 WeakPolarHBondContact SG-CA 3.35Å; C168-C176 WeakPolarHBondContact SG-CB 3.5Å; C168-C176 CovalentContact SG-SG 2.04Å; C168-C176 PolarHBondContact SG-SG 2.93Å
169	W	78.5	Confident	81.7	Confident	195 Å²	195	61.7 Å²	61.7	74%	0.739	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-22	174.9	-72.8	97.6	0	0	0	113.6	N164 D167	N164-W169 VanDerWaalsContact CG-CD1 3.45Å; N164-W169 PolarHBondContact ND2-NE1 2.96Å; N164-W169 PolarHBondContact OD1-NE1 3.4Å; D167-W169 VanDerWaalsContact C-N 3.26Å; D167-W169 PolarHBondContact O-N 3.17Å; D167-W169 VanDerWaalsContact O-N 3.08Å
170	Q	74.8	Confident	81.2	Confident	182 Å²	182	65.8 Å²	65.8	85%	0.85	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-23.7	-172.1	-62.7	174.7	5.5	0	0	111.5	D167	D167-Q170 PolarHBondContact O-N 3.32Å
171	S	72.5	Confident	80.5	Confident	36 Å²	36	68.9 Å²	68.9	25%	0.252	35%	0.352	S	S	.	.			trans	-93.6	130	-179.2	-176.8	0	0	0	0	112	D167 L173 H174	D167-S171 PolarHBondContact O-N 2.62Å; D167-S171 WeakPolarHBondContact OD2-CB 3.1Å; S171-L173 VanDerWaalsContact C-N 3.26Å; S171-L173 PolarHBondContact OG-N 3.13Å; S171-H174 VanDerWaalsContact O-O 3.12Å; S171-H174 WeakPolarHBondContact OG-CB 3.49Å; S171-H174 PolarHBondContact OG-N 2.91Å
172	Y	62.9	Low	80.1	Confident	139 Å²	139	68.2 Å²	68.2	55%	0.545	36%	0.36	S	S	.	.	S	Bend	trans	-76.3	-18.2	171.9	-169.4	-100.4	0	0	0	112.6	K332 V375	Y172-K332 VanDerWaalsContact OH-CE 3.24Å; Y172-K332 WeakPolarHBondContact OH-CE 3.04Å; Y172-K332 PolarHBondContact OH-NZ 3.27Å; Y172-V375 HydrophobicContact CD1-CG1 4.46Å; Y172-V375 HydrophobicContact CE1-CG1 4.29Å
173	L	61.2	Low	80	Confident	63 Å²	63	67 Å²	67	33%	0.33	35%	0.348	S	S	.	.	S	Bend	trans	-103.3	-14.3	-176.3	-64.7	175.9	0	0	0	112.6	S171 E329 N377	S171-L173 VanDerWaalsContact C-N 3.26Å; S171-L173 PolarHBondContact OG-N 3.13Å; L173-E329 HydrophobicContact CD1-CG 3.99Å; L173-E329 WeakPolarHBondContact CD1-OE1 3.49Å; L173-N377 HydrophobicContact CD1-CB 3.96Å; L173-N377 HydrophobicContact CD2-CB 4.32Å
174	H	74.7	Confident	80.4	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.005	34%	0.338	C	S	.	.	S	Bend	trans	-117.3	101	173.5	176.2	-133.8	0	0	0	108.4	H165 T166 D167 C168 S171 H186 F188 H196	H165-H174 AromaticContact CD2-CE1 3.67Å; H165-H174 AromaticContact CD2-NE2 3.47Å; H165-H174 PolarHBondContact CD2-NE2 3.49Å; H165-H174 AromaticContact CE1-NE2 3.77Å; H165-H174 AromaticContact NE2-CE1 3.71Å; H165-H174 AromaticContact NE2-NE2 3.06Å; H165-H174 PolarHBondContact NE2-NE2 3.29Å; H165-H174 PolarHBondContact O-CE1 3.35Å; T166-H174 PolarHBondContact OG1-CE1 3.29Å; T166-H174 PolarHBondContact OG1-ND1 2.92Å; D167-H174 IonicContact OD1-CE1 2.99Å; D167-H174 IonicContact OD1-CG 3.68Å; D167-H174 IonicContact OD1-ND1 3.91Å; D167-H174 PolarHBondContact OD1-ND1 3.42Å; C168-H174 CarbonylContact C-O 3.53Å; C168-H174 WeakPolarHBondContact CA-O 3.41Å; C168-H174 PolarHBondContact N-ND1 2.65Å; C168-H174 VanDerWaalsContact O-O 3.08Å; S171-H174 VanDerWaalsContact O-O 3.12Å; S171-H174 WeakPolarHBondContact OG-CB 3.49Å; S171-H174 PolarHBondContact OG-N 2.91Å; H174-H186 AromaticContact CD2-CE1 3.19Å; H174-H186 PolarHBondContact CD2-CE1 3Å; H174-H186 AromaticContact CD2-ND1 3.97Å; H174-H186 AromaticContact CD2-NE2 3.76Å; H174-H186 AromaticContact NE2-CE1 3.29Å; H174-H186 PolarHBondContact NE2-CE1 3.4Å; H174-H186 VanDerWaalsContact NE2-CE1 3.29Å; H174-H186 AromaticContact NE2-NE2 3.48Å; H174-H186 PolarHBondContact NE2-NE2 2.9Å; H174-F188 HydrophobicContact CB-CE1 4.16Å; H174-F188 HydrophobicContact CB-CZ 3.9Å; H174-F188 AromaticContact CD2-CZ 3.43Å; H174-F188 VanDerWaalsContact CD2-CZ 3.43Å; H174-F188 WeakPolarHBondContact CD2-CZ 3.35Å; H174-F188 AromaticContact CG-CZ 3.7Å; H174-H196 AromaticContact NE2-CE1 3.76Å; H174-H196 AromaticContact NE2-ND1 3.34Å; H174-H196 PolarHBondContact NE2-ND1 2.7Å
175	H	78.9	Confident	80.9	Confident	88 Å²	88	61.7 Å²	61.7	41%	0.407	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-90.1	151.5	179.5	59.6	-28.6	0	0	0	112.8	E183 H186	H175-E183 IonicContact CD2-OE2 3.47Å; H175-E183 PolarHBondContact CD2-OE2 2.88Å; H175-E183 VanDerWaalsContact CE1-CD 3.44Å; H175-E183 IonicContact CE1-OE1 2.92Å; H175-E183 PolarHBondContact CE1-OE1 2.78Å; H175-E183 IonicContact CE1-OE2 3.24Å; H175-E183 PolarHBondContact CE1-OE2 2.9Å; H175-E183 VanDerWaalsContact CE1-OE2 3.24Å; H175-E183 IonicContact CG-OE2 3.91Å; H175-E183 IonicContact ND1-OE1 3.94Å; H175-E183 IonicContact ND1-OE2 3.76Å; H175-E183 IonicContact NE2-OE1 3.21Å; H175-E183 PolarHBondContact NE2-OE1 2.75Å; H175-E183 IonicContact NE2-OE2 3.13Å; H175-E183 PolarHBondContact NE2-OE2 2.8Å; H175-E183 VanDerWaalsContact NE2-OE2 3.13Å; H175-H186 AromaticContact CE1-ND1 3.53Å; H175-H186 AromaticContact ND1-CE1 3.89Å; H175-H186 AromaticContact ND1-ND1 3.32Å; H175-H186 PolarHBondContact ND1-ND1 2.84Å; H175-H186 PolarHBondContact O-CE1 2.78Å; H175-H186 VanDerWaalsContact O-CE1 3.24Å
176	C	86.7	Confident	81.2	Confident	31 Å²	31	62.4 Å²	62.4	21%	0.209	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-75.5	149.1	175.7	-55.8	0	0	0	0	110.5	A163 C168	A163-C176 WeakPolarHBondContact O-CA 3.27Å; A163-C176 VanDerWaalsContact O-CB 3.24Å; A163-C176 WeakPolarHBondContact O-CB 3.46Å; C168-C176 HydrophobicContact CB-CB 3.93Å; C168-C176 WeakPolarHBondContact CB-SG 3.23Å; C168-C176 WeakPolarHBondContact SG-CA 3.35Å; C168-C176 WeakPolarHBondContact SG-CB 3.5Å; C168-C176 CovalentContact SG-SG 2.04Å; C168-C176 PolarHBondContact SG-SG 2.93Å
177	F	91.4	Very high	81.7	Confident	9 Å²	9	59.3 Å²	59.3	4%	0.039	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-67.7	152.6	174.2	-56.4	-59.3	0	0	0	111.5	A163 H165 E183 H186 H196 F197 D198	A163-F177 WeakPolarHBondContact CB-O 3.47Å; A163-F177 PolarHBondContact O-N 2.94Å; A163-F177 VanDerWaalsContact O-N 3.12Å; H165-F177 AromaticContact CE1-CD2 3.31Å; H165-F177 WeakPolarHBondContact CE1-CD2 3.25Å; H165-F177 AromaticContact CE1-CE2 3.23Å; H165-F177 WeakPolarHBondContact CE1-CE2 3.46Å; H165-F177 AromaticContact CE1-CG 3.81Å; H165-F177 AromaticContact CE1-CZ 3.67Å; H165-F177 AromaticContact ND1-CD2 3.61Å; H165-F177 AromaticContact ND1-CE2 3.78Å; H165-F177 AromaticContact NE2-CE2 3.49Å; H165-F177 WeakPolarHBondContact NE2-CE2 3.39Å; H165-F177 AromaticContact NE2-CZ 3.71Å; F177-E183 HydrophobicContact CD1-CB 4.3Å; F177-E183 HydrophobicContact CD1-CG 4.03Å; F177-E183 HydrophobicContact CE1-CG 4.22Å; F177-H186 AromaticContact CE1-CD2 3.74Å; F177-H186 AromaticContact CE1-NE2 3.69Å; F177-H186 AromaticContact CZ-CD2 3.72Å; F177-H186 AromaticContact CZ-NE2 3.56Å; F177-H196 HydrophobicContact CE2-CB 4.21Å; F177-H196 HydrophobicContact CZ-CB 3.79Å; F177-H196 WeakPolarHBondContact CZ-O 3.31Å; F177-F197 WeakPolarHBondContact CE2-O 3.03Å; F177-D198 HydrophobicContact CB-CB 3.99Å; F177-D198 WeakPolarHBondContact CB-OD2 3.45Å; F177-D198 HydrophobicContact CD1-CB 3.97Å; F177-D198 HydrophobicContact CD2-CB 3.65Å; F177-D198 HydrophobicContact CE1-CB 4.33Å; F177-D198 HydrophobicContact CE2-CB 4.03Å; F177-D198 HydrophobicContact CG-CB 3.62Å; F177-D198 HydrophobicContact CZ-CB 4.35Å
178	D	85.7	Confident	82.2	Confident	118 Å²	118	57.9 Å²	57.9	63%	0.631	29%	0.293	S	S	*	.			trans	-101.8	-0.3	-175.9	61.8	-16	0	0	0	113.5	G182 E183	D178-G182 VanDerWaalsContact OD1-CA 3.31Å; D178-G182 WeakPolarHBondContact OD1-CA 3.35Å; D178-G182 WeakPolarHBondContact OD2-CA 3.4Å; D178-E183 PolarHBondContact OD1-N 2.85Å
179	G	85.3	Confident	82.5	Confident	11 Å²	11	58.7 Å²	58.7	11%	0.113	30%	0.296	C	S	.	.			trans	91.1	-162.3	175.8	0	0	0	0	0	113.3	T181 G182 D198	G179-T181 PolarHBondContact O-N 2.75Å; G179-G182 PolarHBondContact O-N 2.81Å; G179-G182 VanDerWaalsContact O-N 3.11Å; G179-D198 WeakPolarHBondContact CA-OD2 3.26Å; G179-D198 PolarHBondContact N-OD2 2.94Å
180	I	86.6	Confident	83.1	Confident	86 Å²	86	49.4 Å²	49.4	44%	0.441	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	132.1	-166.4	-58.8	165.9	0	0	0	113.1	G182 H200 Y202 V216	I180-G182 PolarHBondContact O-N 3.46Å; I180-H200 HydrophobicContact CG1-CB 4.23Å; I180-H200 WeakPolarHBondContact CG1-O 2.97Å; I180-Y202 HydrophobicContact CD1-CE2 4.11Å; I180-Y202 HydrophobicContact CG1-CE2 4.44Å; I180-V216 HydrophobicContact CG2-CB 4.4Å; I180-V216 HydrophobicContact CG2-CG1 3.97Å
181	T	80.5	Confident	83.7	Confident	71 Å²	71	45.3 Å²	45.3	44%	0.436	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.3	5.3	178.2	-50.5	0	0	0	0	114.6	G179 E201	G179-T181 PolarHBondContact O-N 2.75Å; T181-E201 WeakPolarHBondContact CA-OE1 3.5Å; T181-E201 PolarHBondContact N-OE1 3.34Å; T181-E201 PolarHBondContact N-OE2 3.49Å
182	G	84.1	Confident	84.5	Confident	32 Å²	32	47.4 Å²	47.4	33%	0.33	26%	0.261	S	S	.	.	S	Bend	trans	-86.6	-124.5	175.5	0	0	0	0	0	112.3	D178 G179 I180 L184	D178-G182 VanDerWaalsContact OD1-CA 3.31Å; D178-G182 WeakPolarHBondContact OD1-CA 3.35Å; D178-G182 WeakPolarHBondContact OD2-CA 3.4Å; G179-G182 PolarHBondContact O-N 2.81Å; G179-G182 VanDerWaalsContact O-N 3.11Å; I180-G182 PolarHBondContact O-N 3.46Å; G182-L184 PolarHBondContact O-N 2.94Å
183	E	86.7	Confident	85.8	Confident	43 Å²	43	40.8 Å²	40.8	20%	0.201	24%	0.235	C	C	.	.			trans	-74	116.9	173.1	-177.7	172.8	-151.4	0	0	111	H175 F177 D178 H186	H175-E183 IonicContact CD2-OE2 3.47Å; H175-E183 PolarHBondContact CD2-OE2 2.88Å; H175-E183 VanDerWaalsContact CE1-CD 3.44Å; H175-E183 IonicContact CE1-OE1 2.92Å; H175-E183 PolarHBondContact CE1-OE1 2.78Å; H175-E183 IonicContact CE1-OE2 3.24Å; H175-E183 PolarHBondContact CE1-OE2 2.9Å; H175-E183 VanDerWaalsContact CE1-OE2 3.24Å; H175-E183 IonicContact CG-OE2 3.91Å; H175-E183 IonicContact ND1-OE1 3.94Å; H175-E183 IonicContact ND1-OE2 3.76Å; H175-E183 IonicContact NE2-OE1 3.21Å; H175-E183 PolarHBondContact NE2-OE1 2.75Å; H175-E183 IonicContact NE2-OE2 3.13Å; H175-E183 PolarHBondContact NE2-OE2 2.8Å; H175-E183 VanDerWaalsContact NE2-OE2 3.13Å; F177-E183 HydrophobicContact CD1-CB 4.3Å; F177-E183 HydrophobicContact CD1-CG 4.03Å; F177-E183 HydrophobicContact CE1-CG 4.22Å; D178-E183 PolarHBondContact OD1-N 2.85Å; E183-H186 IonicContact OE1-CG 3.96Å; E183-H186 IonicContact OE1-ND1 3.97Å
184	L	91.6	Very high	87.4	Confident	10 Å²	10	40.1 Å²	40.1	5%	0.052	23%	0.23	C	C	.	.			trans	-78.3	-36.5	-176.2	-52.7	-179.1	0	0	0	112.5	G182 D198 E201 W203 T219 V224	G182-L184 PolarHBondContact O-N 2.94Å; L184-D198 PolarHBondContact O-N 3.35Å; L184-E201 HydrophobicContact CD2-CG 3.83Å; L184-E201 WeakPolarHBondContact CD2-OE1 3.39Å; L184-W203 HydrophobicContact CB-CH2 4.12Å; L184-W203 VanDerWaalsContact O-CZ2 3.28Å; L184-W203 WeakPolarHBondContact O-CZ2 3.25Å; L184-T219 HydrophobicContact CD1-CG2 3.82Å; L184-T219 HydrophobicContact CD2-CG2 4.44Å; L184-V224 HydrophobicContact CB-CG1 4.17Å; L184-V224 HydrophobicContact CB-CG2 4.35Å; L184-V224 HydrophobicContact CD1-CG2 3.76Å
185	A	92.9	Very high	88.4	Confident	9 Å²	9	40.1 Å²	40.1	7%	0.074	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	163.7	-176.6	0	0	0	0	0	110	H196 F197 V224 E228	A185-H196 CarbonylContact C-O 3.47Å; A185-H196 WeakPolarHBondContact CA-O 3.45Å; A185-H196 VanDerWaalsContact CB-O 3.27Å; A185-H196 WeakPolarHBondContact CB-O 3.42Å; A185-F197 HydrophobicContact CB-CD1 3.71Å; A185-F197 HydrophobicContact CB-CE1 4.1Å; A185-F197 HydrophobicContact CB-CG 4.25Å; A185-V224 HydrophobicContact CB-CG1 3.63Å; A185-E228 HydrophobicContact CB-CG 3.63Å
186	H	91.2	Very high	89.2	Confident	19 Å²	19	36.1 Å²	36.1	9%	0.088	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	160.1	166.1	59.4	-176.6	0	0	0	110.9	H165 H174 H175 F177 E183 H196 E228	H165-H186 AromaticContact CE1-CE1 3.91Å; H165-H186 AromaticContact CE1-NE2 3.67Å; H165-H186 AromaticContact NE2-CE1 3.57Å; H165-H186 AromaticContact NE2-NE2 3.02Å; H165-H186 PolarHBondContact NE2-NE2 2.81Å; H174-H186 AromaticContact CD2-CE1 3.19Å; H174-H186 PolarHBondContact CD2-CE1 3Å; H174-H186 AromaticContact CD2-ND1 3.97Å; H174-H186 AromaticContact CD2-NE2 3.76Å; H174-H186 AromaticContact NE2-CE1 3.29Å; H174-H186 PolarHBondContact NE2-CE1 3.4Å; H174-H186 VanDerWaalsContact NE2-CE1 3.29Å; H174-H186 AromaticContact NE2-NE2 3.48Å; H174-H186 PolarHBondContact NE2-NE2 2.9Å; H175-H186 AromaticContact CE1-ND1 3.53Å; H175-H186 AromaticContact ND1-CE1 3.89Å; H175-H186 AromaticContact ND1-ND1 3.32Å; H175-H186 PolarHBondContact ND1-ND1 2.84Å; H175-H186 PolarHBondContact O-CE1 2.78Å; H175-H186 VanDerWaalsContact O-CE1 3.24Å; F177-H186 AromaticContact CE1-CD2 3.74Å; F177-H186 AromaticContact CE1-NE2 3.69Å; F177-H186 AromaticContact CZ-CD2 3.72Å; F177-H186 AromaticContact CZ-NE2 3.56Å; E183-H186 IonicContact OE1-CG 3.96Å; E183-H186 IonicContact OE1-ND1 3.97Å; H186-H196 PolarHBondContact N-O 2.85Å; H186-H196 WeakPolarHBondContact NE2-CB 3.4Å; H186-H196 AromaticContact NE2-CG 3.79Å; H186-H196 AromaticContact NE2-ND1 3.42Å; H186-H196 PolarHBondContact NE2-ND1 3.35Å; H186-H196 PolarHBondContact O-N 2.94Å; H186-E228 VanDerWaalsContact C-OE2 3.3Å; H186-E228 WeakPolarHBondContact CA-OE2 3.12Å
187	A	92.1	Very high	89.7	Confident	18 Å²	18	34.6 Å²	34.6	15%	0.149	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	152.2	-179.4	0	0	0	0	0	112.9	E194 I195 E228 H231 V232	A187-E194 CarbonylContact C-O 3.59Å; A187-E194 VanDerWaalsContact CA-O 3.24Å; A187-E194 WeakPolarHBondContact CA-O 3.44Å; A187-I195 HydrophobicContact CB-CG1 4.11Å; A187-E228 HydrophobicContact CB-CB 3.98Å; A187-E228 WeakPolarHBondContact CB-O 3.25Å; A187-E228 WeakPolarHBondContact CB-OE2 3.4Å; A187-E228 PolarHBondContact N-OE2 2.79Å; A187-H231 HydrophobicContact CB-CB 3.8Å; A187-V232 HydrophobicContact CB-CG2 3.96Å
188	F	87.3	Confident	89.9	Confident	48 Å²	48	34.2 Å²	34.2	21%	0.211	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-103	133.8	177.9	-63	-95.3	0	0	0	110.3	H174 T192 E194 H196	H174-F188 HydrophobicContact CB-CE1 4.16Å; H174-F188 HydrophobicContact CB-CZ 3.9Å; H174-F188 AromaticContact CD2-CZ 3.43Å; H174-F188 VanDerWaalsContact CD2-CZ 3.43Å; H174-F188 WeakPolarHBondContact CD2-CZ 3.35Å; H174-F188 AromaticContact CG-CZ 3.7Å; F188-T192 HydrophobicContact CB-CG2 3.78Å; F188-T192 HydrophobicContact CD1-CG2 4.49Å; F188-T192 HydrophobicContact CG-CG2 4.21Å; F188-E194 HydrophobicContact CB-CB 4.38Å; F188-E194 HydrophobicContact CD2-CB 3.72Å; F188-E194 HydrophobicContact CE2-CB 4.42Å; F188-E194 HydrophobicContact CG-CB 4.38Å; F188-E194 PolarHBondContact N-O 2.8Å; F188-H196 AromaticContact CE2-CE1 3.63Å; F188-H196 AromaticContact CE2-ND1 3.88Å
189	F	87.8	Confident	90.3	Very high	24 Å²	24	29.7 Å²	29.7	11%	0.105	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-61.5	160.7	177.4	-68.3	-71.3	0	0	0	112.4	T98 L102 T192 G193 H231 L235 M236 I379	T98-F189 HydrophobicContact CG2-CD1 3.83Å; T98-F189 HydrophobicContact CG2-CE1 3.58Å; T98-F189 HydrophobicContact CG2-CE2 4.45Å; T98-F189 HydrophobicContact CG2-CG 4.36Å; T98-F189 HydrophobicContact CG2-CZ 3.93Å; L102-F189 HydrophobicContact CB-CB 4.19Å; L102-F189 HydrophobicContact CD1-CB 4.19Å; L102-F189 HydrophobicContact CD1-CD2 4.37Å; L102-F189 HydrophobicContact CD1-CG 4.29Å; L102-F189 HydrophobicContact CD2-CB 4.29Å; L102-F189 HydrophobicContact CG-CB 4.47Å; F189-T192 WeakPolarHBondContact O-CB 3.45Å; F189-T192 PolarHBondContact O-N 2.89Å; F189-T192 VanDerWaalsContact O-N 3.08Å; F189-G193 PolarHBondContact O-N 2.93Å; F189-H231 WeakPolarHBondContact CD1-O 3.45Å; F189-H231 HydrophobicContact CE1-CB 4.24Å; F189-H231 AromaticContact CZ-ND1 3.98Å; F189-L235 WeakPolarHBondContact CE1-O 3.35Å; F189-M236 HydrophobicContact CZ-CG 4.2Å; F189-I379 HydrophobicContact CD2-CD1 3.72Å; F189-I379 HydrophobicContact CD2-CG1 4.04Å; F189-I379 HydrophobicContact CE2-CD1 3.51Å; F189-I379 HydrophobicContact CE2-CG1 4.1Å
190	P	89.9	Confident	90.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	148.7	169.2	-24.9	35.9	0	0	0	112.2	L102 W104 V232	L102-P190 WeakPolarHBondContact CA-O 3Å; L102-P190 VanDerWaalsContact CD2-O 3.25Å; L102-P190 WeakPolarHBondContact CD2-O 3.09Å; W104-P190 HydrophobicContact CD2-CB 3.87Å; W104-P190 HydrophobicContact CD2-CG 4.11Å; W104-P190 HydrophobicContact CE3-CB 4.31Å; W104-P190 HydrophobicContact CG-CB 4.18Å; W104-P190 HydrophobicContact CG-CG 4.13Å; W104-P190 HydrophobicContact CZ2-CB 4.09Å; W104-P190 HydrophobicContact CZ2-CG 4.17Å; P190-V232 WeakPolarHBondContact CD-O 3.4Å; P190-V232 WeakPolarHBondContact CG-O 3.46Å
191	P	87.9	Confident	91	Very high	96 Å²	96	28.7 Å²	28.7	62%	0.623	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	cis	-86.3	2.9	-0.4	35.6	-36.2	0	0	0	114	W104	W104-P191 WeakPolarHBondContact CH2-O 3.41Å; W104-P191 HydrophobicContact CZ3-CB 4.22Å
192	T	88.9	Confident	91.6	Very high	79 Å²	79	27.5 Å²	27.5	49%	0.485	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-48.9	-177.9	-55.1	0	0	0	0	111.4	F188 F189 E194	F188-T192 HydrophobicContact CB-CG2 3.78Å; F188-T192 HydrophobicContact CD1-CG2 4.49Å; F188-T192 HydrophobicContact CG-CG2 4.21Å; F189-T192 WeakPolarHBondContact O-CB 3.45Å; F189-T192 PolarHBondContact O-N 2.89Å; F189-T192 VanDerWaalsContact O-N 3.08Å; T192-E194 HydrophobicContact CG2-CG 4.09Å; T192-E194 PolarHBondContact O-N 2.83Å
193	G	91.4	Very high	92.1	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.			trans	61.2	46.3	167.7	0	0	0	0	0	114.6	I156 K157 F189	I156-G193 CarbonylContact C-O 3.4Å; I156-G193 WeakPolarHBondContact CA-O 3.24Å; K157-G193 PolarHBondContact N-O 3.2Å; F189-G193 PolarHBondContact O-N 2.93Å
194	E	94.2	Very high	92.5	Very high	50 Å²	50	25.1 Å²	25.1	23%	0.234	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	143.8	178.1	-59.7	-170.6	164.6	0	0	110.5	K157 A187 F188 T192 H196	K157-E194 HydrophobicContact CB-CG 4.24Å; K157-E194 IonicContact NZ-OE1 3.35Å; K157-E194 CarbonylContact O-C 3.54Å; K157-E194 WeakPolarHBondContact O-CA 3.24Å; A187-E194 CarbonylContact C-O 3.59Å; A187-E194 VanDerWaalsContact CA-O 3.24Å; A187-E194 WeakPolarHBondContact CA-O 3.44Å; F188-E194 HydrophobicContact CB-CB 4.38Å; F188-E194 HydrophobicContact CD2-CB 3.72Å; F188-E194 HydrophobicContact CE2-CB 4.42Å; F188-E194 HydrophobicContact CG-CB 4.38Å; F188-E194 PolarHBondContact N-O 2.8Å; T192-E194 HydrophobicContact CG2-CG 4.09Å; T192-E194 PolarHBondContact O-N 2.83Å; E194-H196 IonicContact OE2-NE2 2.7Å
195	I	96.1	Very high	92.7	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	121.2	172.8	-51.3	-179.5	0	0	0	108	I156 K157 I158 G159 A187 F197 E228 I229 V232	I156-I195 HydrophobicContact CG2-CD1 4.42Å; I156-I195 HydrophobicContact CG2-CG1 4.48Å; K157-I195 PolarHBondContact O-N 2.76Å; I158-I195 WeakPolarHBondContact CA-O 3.42Å; I158-I195 HydrophobicContact CD1-CD1 4.3Å; I158-I195 HydrophobicContact CG1-CB 4.2Å; I158-I195 HydrophobicContact CG1-CD1 4.21Å; I158-I195 HydrophobicContact CG1-CG1 4.36Å; I158-I195 HydrophobicContact CG2-CB 4.41Å; G159-I195 PolarHBondContact N-O 2.81Å; A187-I195 HydrophobicContact CB-CG1 4.11Å; I195-F197 HydrophobicContact CB-CE2 4.35Å; I195-F197 HydrophobicContact CG2-CD2 3.98Å; I195-F197 HydrophobicContact CG2-CE2 3.45Å; I195-F197 VanDerWaalsContact CG2-CE2 3.45Å; I195-F197 HydrophobicContact CG2-CZ 3.85Å; I195-E228 HydrophobicContact CD1-CB 4.2Å; I195-E228 HydrophobicContact CG1-CB 4.48Å; I195-E228 HydrophobicContact CG2-CB 3.65Å; I195-E228 HydrophobicContact CG2-CG 3.99Å; I195-I229 HydrophobicContact CD1-CG1 3.84Å; I195-V232 HydrophobicContact CD1-CG2 3.66Å; I195-V232 HydrophobicContact CG1-CG2 3.37Å
196	H	95.8	Very high	92.6	Very high	3 Å²	3	28.4 Å²	28.4	1%	0.014	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.7	172.3	-47.6	159.1	0	0	0	109.2	G159 Y161 H165 H174 F177 A185 H186 F188 E194	G159-H196 CarbonylContact O-C 3.51Å; G159-H196 WeakPolarHBondContact O-CA 3.03Å; Y161-H196 HydrophobicContact CD2-CB 3.77Å; Y161-H196 AromaticContact CD2-CG 3.92Å; Y161-H196 HydrophobicContact CE2-CB 4.04Å; Y161-H196 AromaticContact CE2-CD2 3.45Å; Y161-H196 VanDerWaalsContact CE2-CD2 3.45Å; Y161-H196 WeakPolarHBondContact CE2-CD2 3.19Å; Y161-H196 AromaticContact CE2-CG 3.77Å; H165-H196 AromaticContact CD2-CG 3.89Å; H165-H196 AromaticContact CD2-ND1 3.3Å; H165-H196 PolarHBondContact CD2-ND1 2.79Å; H165-H196 VanDerWaalsContact CD2-ND1 3.3Å; H165-H196 AromaticContact NE2-CG 3.83Å; H165-H196 AromaticContact NE2-ND1 3.26Å; H165-H196 PolarHBondContact NE2-ND1 3.22Å; H174-H196 AromaticContact NE2-CE1 3.76Å; H174-H196 AromaticContact NE2-ND1 3.34Å; H174-H196 PolarHBondContact NE2-ND1 2.7Å; F177-H196 HydrophobicContact CE2-CB 4.21Å; F177-H196 HydrophobicContact CZ-CB 3.79Å; F177-H196 WeakPolarHBondContact CZ-O 3.31Å; A185-H196 CarbonylContact C-O 3.47Å; A185-H196 WeakPolarHBondContact CA-O 3.45Å; A185-H196 VanDerWaalsContact CB-O 3.27Å; A185-H196 WeakPolarHBondContact CB-O 3.42Å; H186-H196 PolarHBondContact N-O 2.85Å; H186-H196 WeakPolarHBondContact NE2-CB 3.4Å; H186-H196 AromaticContact NE2-CG 3.79Å; H186-H196 AromaticContact NE2-ND1 3.42Å; H186-H196 PolarHBondContact NE2-ND1 3.35Å; H186-H196 PolarHBondContact O-N 2.94Å; F188-H196 AromaticContact CE2-CE1 3.63Å; F188-H196 AromaticContact CE2-ND1 3.88Å; E194-H196 IonicContact OE2-NE2 2.7Å
197	F	96.2	Very high	92.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	141.5	172.2	-69.1	-89.3	0	0	0	109.4	I130 I158 G159 F160 Y161 F177 A185 I195 D199 W203 V224 A225	I130-F197 HydrophobicContact CD1-CE2 4.08Å; I130-F197 HydrophobicContact CD1-CZ 3.98Å; I158-F197 HydrophobicContact CG2-CD2 3.92Å; I158-F197 HydrophobicContact CG2-CE2 3.58Å; G159-F197 PolarHBondContact O-N 2.97Å; F160-F197 WeakPolarHBondContact CA-O 3.29Å; F160-F197 HydrophobicContact CD1-CB 3.32Å; F160-F197 HydrophobicContact CD1-CD2 4.38Å; F160-F197 AromaticContact CD1-CG 4Å; F160-F197 HydrophobicContact CD1-CG 4Å; F160-F197 HydrophobicContact CE1-CB 3.4Å; F160-F197 VanDerWaalsContact CE1-CB 3.4Å; F160-F197 HydrophobicContact CE1-CD1 4.15Å; F160-F197 AromaticContact CE1-CD2 3.84Å; F160-F197 HydrophobicContact CE1-CD2 3.84Å; F160-F197 AromaticContact CE1-CG 3.54Å; F160-F197 HydrophobicContact CE1-CG 3.54Å; F160-F197 HydrophobicContact CE2-CD2 4.36Å; F160-F197 HydrophobicContact CG-CB 4.1Å; F160-F197 HydrophobicContact CZ-CB 4.25Å; F160-F197 AromaticContact CZ-CD2 3.82Å; F160-F197 HydrophobicContact CZ-CD2 3.82Å; F160-F197 HydrophobicContact CZ-CE2 4.36Å; F160-F197 HydrophobicContact CZ-CG 4.01Å; Y161-F197 PolarHBondContact N-O 3.46Å; F177-F197 WeakPolarHBondContact CE2-O 3.03Å; A185-F197 HydrophobicContact CB-CD1 3.71Å; A185-F197 HydrophobicContact CB-CE1 4.1Å; A185-F197 HydrophobicContact CB-CG 4.25Å; I195-F197 HydrophobicContact CB-CE2 4.35Å; I195-F197 HydrophobicContact CG2-CD2 3.98Å; I195-F197 HydrophobicContact CG2-CE2 3.45Å; I195-F197 VanDerWaalsContact CG2-CE2 3.45Å; I195-F197 HydrophobicContact CG2-CZ 3.85Å; F197-D199 PolarHBondContact O-N 3.33Å; F197-W203 HydrophobicContact CB-CZ2 3.95Å; F197-W203 AromaticContact CD1-CH2 3.55Å; F197-W203 HydrophobicContact CD1-CH2 3.55Å; F197-W203 AromaticContact CD1-CZ2 3.69Å; F197-W203 HydrophobicContact CD1-CZ2 3.69Å; F197-W203 HydrophobicContact CD1-CZ3 4.13Å; F197-W203 HydrophobicContact CE1-CH2 4.21Å; F197-W203 HydrophobicContact CE1-CZ3 4.46Å; F197-W203 HydrophobicContact CG-CZ2 4.31Å; F197-V224 HydrophobicContact CD1-CG1 4.37Å; F197-V224 HydrophobicContact CE1-CB 4.33Å; F197-V224 HydrophobicContact CE1-CG1 4.01Å; F197-A225 HydrophobicContact CE1-CB 4.2Å; F197-A225 HydrophobicContact CZ-CB 3.72Å
198	D	94.8	Very high	92.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	118.6	173.7	-171.9	0.9	0	0	0	110.1	F177 G179 L184 H200 E201 W203	F177-D198 HydrophobicContact CB-CB 3.99Å; F177-D198 WeakPolarHBondContact CB-OD2 3.45Å; F177-D198 HydrophobicContact CD1-CB 3.97Å; F177-D198 HydrophobicContact CD2-CB 3.65Å; F177-D198 HydrophobicContact CE1-CB 4.33Å; F177-D198 HydrophobicContact CE2-CB 4.03Å; F177-D198 HydrophobicContact CG-CB 3.62Å; F177-D198 HydrophobicContact CZ-CB 4.35Å; G179-D198 WeakPolarHBondContact CA-OD2 3.26Å; G179-D198 PolarHBondContact N-OD2 2.94Å; L184-D198 PolarHBondContact O-N 3.35Å; D198-H200 PolarHBondContact O-N 2.78Å; D198-H200 WeakPolarHBondContact OD1-CB 3.44Å; D198-H200 IonicContact OD1-CG 3.55Å; D198-H200 PolarHBondContact OD1-N 3.2Å; D198-H200 IonicContact OD1-ND1 2.96Å; D198-H200 PolarHBondContact OD1-ND1 2.91Å; D198-E201 HydrophobicContact CB-CG 4.09Å; D198-E201 WeakPolarHBondContact O-CB 3.47Å; D198-E201 PolarHBondContact O-N 3.37Å; D198-W203 PolarHBondContact O-NE1 2.71Å
199	D	94.9	Very high	92.6	Very high	23 Å²	23	38.7 Å²	38.7	12%	0.123	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-6.2	178.2	-162.3	36.7	0	0	0	112.8	P117 T118 N119 F160 Y161 F197	P117-D199 WeakPolarHBondContact CA-OD1 3.48Å; T118-D199 VanDerWaalsContact CG2-OD2 3.26Å; T118-D199 WeakPolarHBondContact CG2-OD2 3.31Å; T118-D199 PolarHBondContact N-OD1 3.18Å; T118-D199 PolarHBondContact OG1-OD1 3.14Å; T118-D199 PolarHBondContact OG1-OD2 3.45Å; N119-D199 PolarHBondContact ND2-O 2.67Å; F160-D199 HydrophobicContact CB-CB 4.22Å; Y161-D199 WeakPolarHBondContact O-CB 3.4Å; Y161-D199 PolarHBondContact O-N 3.19Å; F197-D199 PolarHBondContact O-N 3.33Å
200	H	92.9	Very high	92.8	Very high	76 Å²	76	40.6 Å²	40.6	35%	0.352	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-17.9	167.4	-65.9	92.4	0	0	0	112.6	A163 I180 D198	A163-H200 PolarHBondContact N-CE1 3.28Å; I180-H200 HydrophobicContact CG1-CB 4.23Å; I180-H200 WeakPolarHBondContact CG1-O 2.97Å; D198-H200 PolarHBondContact O-N 2.78Å; D198-H200 WeakPolarHBondContact OD1-CB 3.44Å; D198-H200 IonicContact OD1-CG 3.55Å; D198-H200 PolarHBondContact OD1-N 3.2Å; D198-H200 IonicContact OD1-ND1 2.96Å; D198-H200 PolarHBondContact OD1-ND1 2.91Å
201	E	93.3	Very high	92.9	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	22%	0.215	C	C	.	.	S	Bend	trans	-76.4	152.1	-179.8	-65.2	-62.1	167.8	0	0	113	N119 T181 L184 D198 W203	N119-E201 PolarHBondContact ND2-O 3.34Å; T181-E201 WeakPolarHBondContact CA-OE1 3.5Å; T181-E201 PolarHBondContact N-OE1 3.34Å; T181-E201 PolarHBondContact N-OE2 3.49Å; L184-E201 HydrophobicContact CD2-CG 3.83Å; L184-E201 WeakPolarHBondContact CD2-OE1 3.39Å; D198-E201 HydrophobicContact CB-CG 4.09Å; D198-E201 WeakPolarHBondContact O-CB 3.47Å; D198-E201 PolarHBondContact O-N 3.37Å; E201-W203 HydrophobicContact CB-CD2 4.48Å; E201-W203 HydrophobicContact CB-CZ2 3.94Å; E201-W203 HydrophobicContact CG-CZ2 4.35Å; E201-W203 PolarHBondContact O-N 3.02Å
202	Y	93.8	Very high	93.2	Very high	45 Å²	45	47.5 Å²	47.5	18%	0.176	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	78.5	179.3	-71.8	-92.3	0	0	0	110.5	N119 L120 I180 K214 V216 L218 T219	N119-Y202 HydrophobicContact CB-CD1 4.28Å; N119-Y202 HydrophobicContact CB-CE1 4.45Å; L120-Y202 HydrophobicContact CD1-CD1 3.71Å; L120-Y202 HydrophobicContact CD1-CG 4.39Å; L120-Y202 HydrophobicContact CG-CD1 3.99Å; I180-Y202 HydrophobicContact CD1-CE2 4.11Å; I180-Y202 HydrophobicContact CG1-CE2 4.44Å; Y202-K214 HydrophobicContact CD1-CD 4.29Å; Y202-K214 HydrophobicContact CE1-CD 4.15Å; Y202-V216 HydrophobicContact CD1-CG2 4.26Å; Y202-V216 HydrophobicContact CD2-CB 3.87Å; Y202-V216 HydrophobicContact CD2-CG1 4.12Å; Y202-V216 HydrophobicContact CD2-CG2 3.46Å; Y202-V216 VanDerWaalsContact CD2-CG2 3.46Å; Y202-V216 HydrophobicContact CE2-CB 4.08Å; Y202-V216 HydrophobicContact CE2-CG1 3.81Å; Y202-V216 HydrophobicContact CE2-CG2 3.77Å; Y202-V216 HydrophobicContact CG-CG2 3.71Å; Y202-L218 CarbonylContact O-C 3.52Å; Y202-L218 WeakPolarHBondContact O-CA 3.44Å; Y202-T219 PolarHBondContact O-N 3.33Å
203	W	95.4	Very high	93.3	Very high	1 Å²	1	53.6 Å²	53.6	0%	0.004	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	134	179.5	-61.3	103	0	0	0	112.9	P117 I121 F160 L184 F197 D198 E201 T219 I221 V224	P117-W203 HydrophobicContact CB-CB 4.36Å; P117-W203 HydrophobicContact CB-CG 4.46Å; P117-W203 HydrophobicContact CG-CB 4.26Å; P117-W203 HydrophobicContact CG-CG 4.26Å; I121-W203 HydrophobicContact CG2-CB 3.69Å; F160-W203 AromaticContact CD1-NE1 3.97Å; F160-W203 HydrophobicContact CE1-CD2 4.48Å; F160-W203 HydrophobicContact CE1-CG 4.48Å; L184-W203 HydrophobicContact CB-CH2 4.12Å; L184-W203 VanDerWaalsContact O-CZ2 3.28Å; L184-W203 WeakPolarHBondContact O-CZ2 3.25Å; F197-W203 HydrophobicContact CB-CZ2 3.95Å; F197-W203 AromaticContact CD1-CH2 3.55Å; F197-W203 HydrophobicContact CD1-CH2 3.55Å; F197-W203 AromaticContact CD1-CZ2 3.69Å; F197-W203 HydrophobicContact CD1-CZ2 3.69Å; F197-W203 HydrophobicContact CD1-CZ3 4.13Å; F197-W203 HydrophobicContact CE1-CH2 4.21Å; F197-W203 HydrophobicContact CE1-CZ3 4.46Å; F197-W203 HydrophobicContact CG-CZ2 4.31Å; D198-W203 PolarHBondContact O-NE1 2.71Å; E201-W203 HydrophobicContact CB-CD2 4.48Å; E201-W203 HydrophobicContact CB-CZ2 3.94Å; E201-W203 HydrophobicContact CG-CZ2 4.35Å; E201-W203 PolarHBondContact O-N 3.02Å; W203-T219 WeakPolarHBondContact CA-O 3.44Å; W203-T219 HydrophobicContact CE3-CG2 3.9Å; W203-T219 HydrophobicContact CH2-CG2 3.97Å; W203-T219 HydrophobicContact CZ3-CG2 3.41Å; W203-T219 VanDerWaalsContact CZ3-CG2 3.41Å; W203-I221 HydrophobicContact CE3-CB 4Å; W203-I221 HydrophobicContact CE3-CG1 4.22Å; W203-V224 HydrophobicContact CH2-CB 4.04Å; W203-V224 HydrophobicContact CH2-CG1 3.98Å; W203-V224 HydrophobicContact CH2-CG2 4.07Å; W203-V224 HydrophobicContact CZ3-CB 3.86Å; W203-V224 HydrophobicContact CZ3-CG1 4.32Å; W203-V224 HydrophobicContact CZ3-CG2 3.8Å
204	I	94.9	Very high	93.2	Very high	24 Å²	24	58.5 Å²	58.5	12%	0.123	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	155.7	172.5	58.6	162	0	0	0	110.4	L120 D207 L218 T219 I221	L120-I204 HydrophobicContact CD1-CG2 4.34Å; I204-D207 WeakPolarHBondContact CD1-O 3.39Å; I204-L218 HydrophobicContact CD1-CB 3.62Å; I204-L218 HydrophobicContact CG1-CB 3.96Å; I204-L218 HydrophobicContact CG2-CB 3.94Å; I204-L218 HydrophobicContact CG2-CD1 4.3Å; I204-L218 HydrophobicContact CG2-CD2 4.46Å; I204-L218 HydrophobicContact CG2-CG 4.47Å; I204-T219 WeakPolarHBondContact CG1-O 3.31Å; I204-T219 PolarHBondContact N-O 3.16Å; I204-I221 WeakPolarHBondContact O-CG2 3.32Å; I204-I221 PolarHBondContact O-N 2.9Å
205	L	94.8	Very high	93	Very high	61 Å²	61	58.4 Å²	58.4	32%	0.319	28%	0.279	S	S	.	.	S	Bend	trans	-98	96.3	163.5	-175.1	69.5	0	0	0	108.4	I121 D125 R128 I221 V222	I121-L205 HydrophobicContact CD1-CB 3.92Å; D125-L205 HydrophobicContact CB-CD2 4.37Å; R128-L205 HydrophobicContact CB-CD2 4.43Å; R128-L205 HydrophobicContact CG-CD2 4.33Å; R128-L205 VanDerWaalsContact NE-CD2 3.27Å; L205-I221 HydrophobicContact CD1-CG2 4.06Å; L205-V222 HydrophobicContact CD1-CG2 3.57Å
206	G	90.4	Very high	92.7	Very high	28 Å²	28	58.9 Å²	58.9	29%	0.289	28%	0.283	S	S	.	.	S	Bend	trans	165.6	-166.2	-173.3	0	0	0	0	0	112	D220 K255	G206-D220 WeakPolarHBondContact O-CB 3.31Å; G206-D220 VanDerWaalsContact O-OD1 3.12Å; G206-K255 PolarHBondContact O-NZ 3.31Å
207	D	90.4	Very high	92.5	Very high	118 Å²	118	63.9 Å²	63.9	63%	0.631	30%	0.301	S	S	*	.			trans	-82.7	135.5	177.8	-65	-28.4	0	0	0	111.4	I204 R209 K255	I204-D207 WeakPolarHBondContact CD1-O 3.39Å; D207-R209 PolarHBondContact O-N 3.25Å; D207-K255 WeakPolarHBondContact OD1-CE 3.48Å; D207-K255 IonicContact OD1-NZ 2.75Å; D207-K255 PolarHBondContact OD1-NZ 3.22Å
208	M	89.9	Confident	92.4	Very high	41 Å²	41	64.2 Å²	64.2	20%	0.202	30%	0.303	C	S	.	.			trans	-58	129.6	179.2	-172.6	-177.2	76	0	0	110.5	W217 L218 D220 L251	M208-W217 HydrophobicContact CG-CE3 4.37Å; M208-L218 WeakPolarHBondContact CA-O 3.48Å; M208-L218 WeakPolarHBondContact CG-O 3.37Å; M208-D220 HydrophobicContact CB-CB 4.44Å; M208-L251 WeakPolarHBondContact CE-O 3.2Å
209	R	91.7	Very high	92.3	Very high	142 Å²	142	64.4 Å²	64.4	54%	0.536	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	151.2	-175.3	63	-174.2	178.1	87	-1.2	112.7	D207 L218	D207-R209 PolarHBondContact O-N 3.25Å; R209-L218 HydrophobicContact CG-CB 4.28Å; R209-L218 HydrophobicContact CG-CD1 4.11Å; R209-L218 PolarHBondContact N-O 3.03Å; R209-L218 VanDerWaalsContact N-O 3.16Å; R209-L218 WeakPolarHBondContact O-CB 3.35Å; R209-L218 PolarHBondContact O-N 3.49Å
210	F	91.4	Very high	92.3	Very high	63 Å²	63	63.3 Å²	63.3	28%	0.276	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	135.5	173	-167.4	-103.6	0	0	0	111.3	W212 G215 W217	F210-W212 AromaticContact CD1-CD2 3.79Å; F210-W212 HydrophobicContact CD1-CD2 3.79Å; F210-W212 AromaticContact CD1-CE2 3.94Å; F210-W212 HydrophobicContact CD1-CE3 4.02Å; F210-W212 HydrophobicContact CD1-CG 4.17Å; F210-W212 HydrophobicContact CD1-CZ2 4.32Å; F210-W212 HydrophobicContact CD1-CZ3 4.37Å; F210-W212 AromaticContact CE1-CD2 3.95Å; F210-W212 HydrophobicContact CE1-CD2 3.95Å; F210-W212 AromaticContact CE1-CE3 3.74Å; F210-W212 HydrophobicContact CE1-CE3 3.74Å; F210-W212 HydrophobicContact CE1-CG 4.44Å; F210-W212 HydrophobicContact CE1-CZ3 4.1Å; F210-G215 VanDerWaalsContact CZ-C 3.44Å; F210-W217 HydrophobicContact CB-CD2 4.21Å; F210-W217 HydrophobicContact CB-CE3 4.09Å; F210-W217 HydrophobicContact CB-CH2 4.15Å; F210-W217 HydrophobicContact CB-CZ2 4.27Å; F210-W217 HydrophobicContact CB-CZ3 4.06Å; F210-W217 AromaticContact CD2-CD1 3.91Å; F210-W217 AromaticContact CD2-CD2 3.94Å; F210-W217 HydrophobicContact CD2-CD2 3.94Å; F210-W217 AromaticContact CD2-CE2 3.8Å; F210-W217 HydrophobicContact CD2-CG 4.01Å; F210-W217 HydrophobicContact CD2-CZ2 4.37Å; F210-W217 AromaticContact CD2-NE1 3.77Å
211	S	92.8	Very high	92.4	Very high	18 Å²	18	59.7 Å²	59.7	13%	0.126	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	98.4	174.7	175.5	0	0	0	0	110.4	K213 K214 G215 V216	S211-K213 PolarHBondContact O-N 3.35Å; S211-K214 CarbonylContact O-C 3.5Å; S211-K214 PolarHBondContact O-N 3.08Å; S211-G215 PolarHBondContact O-N 3.29Å; S211-V216 PolarHBondContact N-O 2.93Å
212	W	92.4	Very high	92.5	Very high	224 Å²	224	60 Å²	60	85%	0.848	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-34.5	177.7	-60.5	99.4	0	0	0	113.7	F210 K214	F210-W212 AromaticContact CD1-CD2 3.79Å; F210-W212 HydrophobicContact CD1-CD2 3.79Å; F210-W212 AromaticContact CD1-CE2 3.94Å; F210-W212 HydrophobicContact CD1-CE3 4.02Å; F210-W212 HydrophobicContact CD1-CG 4.17Å; F210-W212 HydrophobicContact CD1-CZ2 4.32Å; F210-W212 HydrophobicContact CD1-CZ3 4.37Å; F210-W212 AromaticContact CE1-CD2 3.95Å; F210-W212 HydrophobicContact CE1-CD2 3.95Å; F210-W212 AromaticContact CE1-CE3 3.74Å; F210-W212 HydrophobicContact CE1-CE3 3.74Å; F210-W212 HydrophobicContact CE1-CG 4.44Å; F210-W212 HydrophobicContact CE1-CZ3 4.1Å; W212-K214 VanDerWaalsContact C-N 3.28Å; W212-K214 PolarHBondContact O-N 3.15Å
213	K	91.9	Very high	92.6	Very high	206 Å²	206	57.9 Å²	57.9	90%	0.896	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-32	177.5	-177.2	177.1	179.1	-179.8	0	112.9	S211	S211-K213 PolarHBondContact O-N 3.35Å
214	K	88.2	Confident	92.6	Very high	103 Å²	103	57.8 Å²	57.8	45%	0.448	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-14.6	-177	-72.9	179.5	168.9	-80.5	0	112.9	Y202 S211 W212 V216	Y202-K214 HydrophobicContact CD1-CD 4.29Å; Y202-K214 HydrophobicContact CE1-CD 4.15Å; S211-K214 CarbonylContact O-C 3.5Å; S211-K214 PolarHBondContact O-N 3.08Å; W212-K214 VanDerWaalsContact C-N 3.28Å; W212-K214 PolarHBondContact O-N 3.15Å; K214-V216 VanDerWaalsContact C-N 3.26Å; K214-V216 HydrophobicContact CB-CG2 3.65Å; K214-V216 HydrophobicContact CD-CG2 4.46Å; K214-V216 PolarHBondContact O-N 3.44Å
215	G	91	Very high	92.7	Very high	48 Å²	48	56.7 Å²	56.7	50%	0.495	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	23	-175.6	0	0	0	0	0	113.9	F210 S211	F210-G215 VanDerWaalsContact CZ-C 3.44Å; S211-G215 PolarHBondContact O-N 3.29Å
216	V	90.6	Very high	92.8	Very high	12 Å²	12	53.8 Å²	53.8	7%	0.073	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	156.9	-173.6	-59.1	0	0	0	0	111.7	I180 Y202 S211 K214 L218	I180-V216 HydrophobicContact CG2-CB 4.4Å; I180-V216 HydrophobicContact CG2-CG1 3.97Å; Y202-V216 HydrophobicContact CD1-CG2 4.26Å; Y202-V216 HydrophobicContact CD2-CB 3.87Å; Y202-V216 HydrophobicContact CD2-CG1 4.12Å; Y202-V216 HydrophobicContact CD2-CG2 3.46Å; Y202-V216 VanDerWaalsContact CD2-CG2 3.46Å; Y202-V216 HydrophobicContact CE2-CB 4.08Å; Y202-V216 HydrophobicContact CE2-CG1 3.81Å; Y202-V216 HydrophobicContact CE2-CG2 3.77Å; Y202-V216 HydrophobicContact CG-CG2 3.71Å; S211-V216 PolarHBondContact N-O 2.93Å; K214-V216 VanDerWaalsContact C-N 3.26Å; K214-V216 HydrophobicContact CB-CG2 3.65Å; K214-V216 HydrophobicContact CD-CG2 4.46Å; K214-V216 PolarHBondContact O-N 3.44Å; V216-L218 HydrophobicContact CG2-CD2 4.49Å
217	W	90.6	Very high	93	Very high	107 Å²	107	52.6 Å²	52.6	41%	0.405	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	137.1	167.7	-74	96	0	0	0	110.6	M208 F210	M208-W217 HydrophobicContact CG-CE3 4.37Å; F210-W217 HydrophobicContact CB-CD2 4.21Å; F210-W217 HydrophobicContact CB-CE3 4.09Å; F210-W217 HydrophobicContact CB-CH2 4.15Å; F210-W217 HydrophobicContact CB-CZ2 4.27Å; F210-W217 HydrophobicContact CB-CZ3 4.06Å; F210-W217 AromaticContact CD2-CD1 3.91Å; F210-W217 AromaticContact CD2-CD2 3.94Å; F210-W217 HydrophobicContact CD2-CD2 3.94Å; F210-W217 AromaticContact CD2-CE2 3.8Å; F210-W217 HydrophobicContact CD2-CG 4.01Å; F210-W217 HydrophobicContact CD2-CZ2 4.37Å; F210-W217 AromaticContact CD2-NE1 3.77Å
218	L	93.4	Very high	93.3	Very high	8 Å²	8	47.2 Å²	47.2	4%	0.042	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	116.6	168.1	-55.2	-178.1	0	0	0	107.6	L120 Y202 I204 M208 R209 V216	L120-L218 HydrophobicContact CD1-CD2 3.79Å; Y202-L218 CarbonylContact O-C 3.52Å; Y202-L218 WeakPolarHBondContact O-CA 3.44Å; I204-L218 HydrophobicContact CD1-CB 3.62Å; I204-L218 HydrophobicContact CG1-CB 3.96Å; I204-L218 HydrophobicContact CG2-CB 3.94Å; I204-L218 HydrophobicContact CG2-CD1 4.3Å; I204-L218 HydrophobicContact CG2-CD2 4.46Å; I204-L218 HydrophobicContact CG2-CG 4.47Å; M208-L218 WeakPolarHBondContact CA-O 3.48Å; M208-L218 WeakPolarHBondContact CG-O 3.37Å; R209-L218 HydrophobicContact CG-CB 4.28Å; R209-L218 HydrophobicContact CG-CD1 4.11Å; R209-L218 PolarHBondContact N-O 3.03Å; R209-L218 VanDerWaalsContact N-O 3.16Å; R209-L218 WeakPolarHBondContact O-CB 3.35Å; R209-L218 PolarHBondContact O-N 3.49Å; V216-L218 HydrophobicContact CG2-CD2 4.49Å
219	T	93.4	Very high	93.7	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.018	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	125.9	-167.8	-57.5	0	0	0	0	110.2	L184 Y202 W203 I204 I221 V224	L184-T219 HydrophobicContact CD1-CG2 3.82Å; L184-T219 HydrophobicContact CD2-CG2 4.44Å; Y202-T219 PolarHBondContact O-N 3.33Å; W203-T219 WeakPolarHBondContact CA-O 3.44Å; W203-T219 HydrophobicContact CE3-CG2 3.9Å; W203-T219 HydrophobicContact CH2-CG2 3.97Å; W203-T219 HydrophobicContact CZ3-CG2 3.41Å; W203-T219 VanDerWaalsContact CZ3-CG2 3.41Å; I204-T219 WeakPolarHBondContact CG1-O 3.31Å; I204-T219 PolarHBondContact N-O 3.16Å; T219-I221 PolarHBondContact O-N 2.99Å; T219-V224 HydrophobicContact CG2-CG2 3.65Å
220	D	94.3	Very high	93.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	112.8	177.5	179.2	16.1	0	0	0	110.8	G206 M208 V222 H223 V224 K255	G206-D220 WeakPolarHBondContact O-CB 3.31Å; G206-D220 VanDerWaalsContact O-OD1 3.12Å; M208-D220 HydrophobicContact CB-CB 4.44Å; D220-V222 PolarHBondContact O-N 3.19Å; D220-V222 PolarHBondContact OD1-N 3.18Å; D220-H223 HydrophobicContact CB-CB 3.96Å; D220-H223 WeakPolarHBondContact O-CB 3.23Å; D220-H223 PolarHBondContact O-N 2.82Å; D220-V224 PolarHBondContact O-N 2.76Å; D220-K255 WeakPolarHBondContact OD2-CD 3.47Å; D220-K255 WeakPolarHBondContact OD2-CE 3.5Å; D220-K255 IonicContact OD2-NZ 3.66Å; D220-K255 PolarHBondContact OD2-NZ 3.06Å
221	I	95.7	Very high	93.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.6	-34.3	179.3	-167	172.1	0	0	0	112.3	I121 T126 I130 F160 W203 I204 L205 T219 H223 A225	I121-I221 HydrophobicContact CD1-CG2 4.15Å; T126-I221 HydrophobicContact CG2-CD1 3.8Å; I130-I221 HydrophobicContact CD1-CD1 4.07Å; I130-I221 HydrophobicContact CD1-CG1 4.14Å; I130-I221 HydrophobicContact CG1-CD1 4.3Å; F160-I221 HydrophobicContact CE1-CD1 4.25Å; F160-I221 HydrophobicContact CZ-CD1 3.84Å; W203-I221 HydrophobicContact CE3-CB 4Å; W203-I221 HydrophobicContact CE3-CG1 4.22Å; I204-I221 WeakPolarHBondContact O-CG2 3.32Å; I204-I221 PolarHBondContact O-N 2.9Å; L205-I221 HydrophobicContact CD1-CG2 4.06Å; T219-I221 PolarHBondContact O-N 2.99Å; I221-H223 VanDerWaalsContact C-N 3.34Å; I221-H223 PolarHBondContact O-N 2.85Å; I221-A225 WeakPolarHBondContact O-CB 3.27Å; I221-A225 PolarHBondContact O-N 3.17Å
222	V	96.5	Very high	94	Very high	8 Å²	8	35.4 Å²	35.4	5%	0.048	16%	0.161	C	C	.	.	H	α-helix	trans	-67.3	-41.8	-178.8	179.7	0	0	0	0	110	R132 L136 L205 D220 T226 K255	R132-V222 HydrophobicContact CB-CG1 4.45Å; R132-V222 HydrophobicContact CB-CG2 4.3Å; R132-V222 HydrophobicContact CG-CG1 3.95Å; R132-V222 HydrophobicContact CG-CG2 4.32Å; L136-V222 HydrophobicContact CD1-CG1 4.18Å; L205-V222 HydrophobicContact CD1-CG2 3.57Å; D220-V222 PolarHBondContact O-N 3.19Å; D220-V222 PolarHBondContact OD1-N 3.18Å; V222-T226 VanDerWaalsContact O-CB 3.31Å; V222-T226 WeakPolarHBondContact O-CB 3.45Å; V222-T226 PolarHBondContact O-N 2.78Å; V222-T226 PolarHBondContact O-OG1 3.17Å; V222-K255 HydrophobicContact CB-CD 4.38Å; V222-K255 HydrophobicContact CG1-CD 4.29Å; V222-K255 HydrophobicContact CG1-CG 4.44Å
223	H	94.9	Very high	94.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-60.8	-55.2	179.5	172.1	54.7	0	0	0	111.8	D220 I221 T226 H227 I244 A249 T250 G253 R254 K255	D220-H223 HydrophobicContact CB-CB 3.96Å; D220-H223 WeakPolarHBondContact O-CB 3.23Å; D220-H223 PolarHBondContact O-N 2.82Å; I221-H223 VanDerWaalsContact C-N 3.34Å; I221-H223 PolarHBondContact O-N 2.85Å; H223-T226 PolarHBondContact O-N 2.82Å; H223-H227 PolarHBondContact O-N 3.1Å; H223-I244 WeakPolarHBondContact ND1-CD1 3.47Å; H223-A249 PolarHBondContact CE1-O 2.78Å; H223-A249 PolarHBondContact NE2-O 3.27Å; H223-T250 PolarHBondContact CD2-O 2.88Å; H223-T250 VanDerWaalsContact NE2-C 3.3Å; H223-T250 VanDerWaalsContact NE2-CA 3.29Å; H223-T250 WeakPolarHBondContact NE2-CA 3.4Å; H223-T250 PolarHBondContact NE2-O 2.84Å; H223-G253 PolarHBondContact NE2-N 3.35Å; H223-R254 PolarHBondContact CE1-N 3.2Å; H223-R254 PolarHBondContact CE1-O 2.9Å; H223-R254 PolarHBondContact ND1-N 2.87Å; H223-R254 PolarHBondContact ND1-O 3.27Å; H223-K255 HydrophobicContact CB-CG 4.44Å
224	V	95.3	Very high	94	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-67	-45.4	-177.9	-176.5	0	0	0	0	110.7	L184 A185 F197 W203 T219 D220 T226 H227 E228	L184-V224 HydrophobicContact CB-CG1 4.17Å; L184-V224 HydrophobicContact CB-CG2 4.35Å; L184-V224 HydrophobicContact CD1-CG2 3.76Å; A185-V224 HydrophobicContact CB-CG1 3.63Å; F197-V224 HydrophobicContact CD1-CG1 4.37Å; F197-V224 HydrophobicContact CE1-CB 4.33Å; F197-V224 HydrophobicContact CE1-CG1 4.01Å; W203-V224 HydrophobicContact CH2-CB 4.04Å; W203-V224 HydrophobicContact CH2-CG1 3.98Å; W203-V224 HydrophobicContact CH2-CG2 4.07Å; W203-V224 HydrophobicContact CZ3-CB 3.86Å; W203-V224 HydrophobicContact CZ3-CG1 4.32Å; W203-V224 HydrophobicContact CZ3-CG2 3.8Å; T219-V224 HydrophobicContact CG2-CG2 3.65Å; D220-V224 PolarHBondContact O-N 2.76Å; V224-T226 PolarHBondContact O-N 3.29Å; V224-H227 WeakPolarHBondContact O-CA 3.11Å; V224-H227 VanDerWaalsContact O-CB 3.32Å; V224-H227 WeakPolarHBondContact O-CB 3.26Å; V224-H227 PolarHBondContact O-N 3.41Å; V224-E228 HydrophobicContact CG1-CG 4.26Å; V224-E228 PolarHBondContact O-N 3.1Å
225	A	96.9	Very high	93.9	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-59.4	-35.9	176.7	0	0	0	0	0	112.5	I130 A133 F197 I221 H227 E228 I229	I130-A225 HydrophobicContact CD1-CB 3.72Å; A133-A225 HydrophobicContact CB-CB 3.69Å; F197-A225 HydrophobicContact CE1-CB 4.2Å; F197-A225 HydrophobicContact CZ-CB 3.72Å; I221-A225 WeakPolarHBondContact O-CB 3.27Å; I221-A225 PolarHBondContact O-N 3.17Å; A225-H227 VanDerWaalsContact C-N 3.3Å; A225-H227 PolarHBondContact O-N 3.17Å; A225-E228 PolarHBondContact O-N 3.47Å; A225-I229 WeakPolarHBondContact O-CB 3.46Å; A225-I229 VanDerWaalsContact O-CD1 3.29Å; A225-I229 WeakPolarHBondContact O-CD1 3.28Å; A225-I229 WeakPolarHBondContact O-CG1 3.29Å; A225-I229 PolarHBondContact O-N 2.75Å
226	T	97.1	Very high	93.5	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-63.8	-38.7	176.2	-56.4	0	0	0	0	111.1	L136 W137 V222 H223 V224 G230 I244 I257	L136-T226 HydrophobicContact CD1-CG2 4.1Å; L136-T226 WeakPolarHBondContact CD1-OG1 2.99Å; W137-T226 HydrophobicContact CZ2-CG2 4.47Å; W137-T226 VanDerWaalsContact CZ2-O 3.3Å; W137-T226 WeakPolarHBondContact CZ2-O 3.48Å; W137-T226 PolarHBondContact NE1-O 3.07Å; V222-T226 VanDerWaalsContact O-CB 3.31Å; V222-T226 WeakPolarHBondContact O-CB 3.45Å; V222-T226 PolarHBondContact O-N 2.78Å; V222-T226 PolarHBondContact O-OG1 3.17Å; H223-T226 PolarHBondContact O-N 2.82Å; V224-T226 PolarHBondContact O-N 3.29Å; T226-G230 PolarHBondContact O-N 3.08Å; T226-I244 HydrophobicContact CG2-CG1 3.88Å; T226-I244 HydrophobicContact CG2-CG2 4.46Å; T226-I257 HydrophobicContact CG2-CD1 4.48Å; T226-I257 HydrophobicContact CG2-CG1 4.09Å
227	H	95.3	Very high	93.1	Very high	3 Å²	3	10.4 Å²	10.4	1%	0.014	5%	0.045	C	C	.	.	H	α-helix	trans	-63.2	-54.7	174.3	-174.7	101.9	0	0	0	111.2	H223 V224 A225 I229 G230 H231 H237 I244 M245 H246	H223-H227 PolarHBondContact O-N 3.1Å; V224-H227 WeakPolarHBondContact O-CA 3.11Å; V224-H227 VanDerWaalsContact O-CB 3.32Å; V224-H227 WeakPolarHBondContact O-CB 3.26Å; V224-H227 PolarHBondContact O-N 3.41Å; A225-H227 VanDerWaalsContact C-N 3.3Å; A225-H227 PolarHBondContact O-N 3.17Å; H227-I229 VanDerWaalsContact C-N 3.31Å; H227-I229 PolarHBondContact O-N 3.41Å; H227-G230 WeakPolarHBondContact O-CA 3.21Å; H227-G230 PolarHBondContact O-N 3.07Å; H227-H231 AromaticContact CD2-CD2 3.92Å; H227-H231 AromaticContact CD2-NE2 3.68Å; H227-H231 AromaticContact NE2-CD2 3.98Å; H227-H231 AromaticContact NE2-NE2 3.26Å; H227-H231 PolarHBondContact NE2-NE2 3.23Å; H227-H231 PolarHBondContact O-N 3.12Å; H227-H237 AromaticContact CE1-CD2 3.55Å; H227-H237 AromaticContact CE1-NE2 3.68Å; H227-H237 AromaticContact NE2-CD2 3.47Å; H227-H237 PolarHBondContact NE2-CD2 3.06Å; H227-H237 AromaticContact NE2-NE2 3.23Å; H227-H237 PolarHBondContact NE2-NE2 2.85Å; H227-I244 PolarHBondContact ND1-O 3.21Å; H227-M245 WeakPolarHBondContact O-CE 3.18Å; H227-H246 PolarHBondContact CE1-O 3.44Å
228	E	96	Very high	92.5	Very high	6 Å²	6	5.3 Å²	5.3	3%	0.028	3%	0.026	C	C	.	.	H	α-helix	trans	-62.6	-36.9	-176.7	-61.7	-41.2	130.9	0	0	113	A185 H186 A187 I195 V224 A225 G230 H231 V232	A185-E228 HydrophobicContact CB-CG 3.63Å; H186-E228 VanDerWaalsContact C-OE2 3.3Å; H186-E228 WeakPolarHBondContact CA-OE2 3.12Å; A187-E228 HydrophobicContact CB-CB 3.98Å; A187-E228 WeakPolarHBondContact CB-O 3.25Å; A187-E228 WeakPolarHBondContact CB-OE2 3.4Å; A187-E228 PolarHBondContact N-OE2 2.79Å; I195-E228 HydrophobicContact CD1-CB 4.2Å; I195-E228 HydrophobicContact CG1-CB 4.48Å; I195-E228 HydrophobicContact CG2-CB 3.65Å; I195-E228 HydrophobicContact CG2-CG 3.99Å; V224-E228 HydrophobicContact CG1-CG 4.26Å; V224-E228 PolarHBondContact O-N 3.1Å; A225-E228 PolarHBondContact O-N 3.47Å; E228-G230 PolarHBondContact O-N 2.87Å; E228-H231 WeakPolarHBondContact O-CB 3.48Å; E228-H231 PolarHBondContact O-N 1.98Å; E228-H231 IonicContact OE2-CD2 3.98Å; E228-V232 PolarHBondContact O-N 3.04Å
229	I	97.6	Very high	91.5	Very high	1 Å²	1	8.4 Å²	8.4	1%	0.005	4%	0.041	C	C	.	.	H	α-helix	trans	-62	-31.2	174.2	-68.2	162.2	0	0	0	110.7	A133 F134 W137 I195 A225 H227 H231 V232 L233	A133-I229 HydrophobicContact CB-CD1 3.66Å; F134-I229 HydrophobicContact CD1-CD1 3.71Å; F134-I229 HydrophobicContact CD1-CG1 4.18Å; F134-I229 HydrophobicContact CD1-CG2 3.96Å; F134-I229 HydrophobicContact CD2-CD1 4.04Å; F134-I229 HydrophobicContact CE1-CD1 3.79Å; F134-I229 HydrophobicContact CE1-CG1 3.8Å; F134-I229 HydrophobicContact CE1-CG2 3.87Å; F134-I229 HydrophobicContact CE2-CD1 4.11Å; F134-I229 HydrophobicContact CG-CD1 3.85Å; F134-I229 HydrophobicContact CZ-CD1 3.99Å; F134-I229 HydrophobicContact CZ-CG1 4.03Å; W137-I229 HydrophobicContact CB-CG2 4.42Å; W137-I229 HydrophobicContact CD2-CG2 4.45Å; W137-I229 HydrophobicContact CG-CG2 3.8Å; I195-I229 HydrophobicContact CD1-CG1 3.84Å; A225-I229 WeakPolarHBondContact O-CB 3.46Å; A225-I229 VanDerWaalsContact O-CD1 3.29Å; A225-I229 WeakPolarHBondContact O-CD1 3.28Å; A225-I229 WeakPolarHBondContact O-CG1 3.29Å; A225-I229 PolarHBondContact O-N 2.75Å; H227-I229 VanDerWaalsContact C-N 3.31Å; H227-I229 PolarHBondContact O-N 3.41Å; I229-H231 VanDerWaalsContact C-N 3.31Å; I229-H231 PolarHBondContact O-N 3.1Å; I229-V232 CarbonylContact O-C 3.53Å; I229-V232 PolarHBondContact O-N 2.93Å; I229-L233 HydrophobicContact CG2-CD1 4.13Å; I229-L233 HydrophobicContact CG2-CG 4.2Å; I229-L233 VanDerWaalsContact O-CG 3.29Å; I229-L233 WeakPolarHBondContact O-CG 3.34Å; I229-L233 PolarHBondContact O-N 3.03Å
230	G	95.1	Very high	90.6	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-60.3	-41.4	173.4	0	0	0	0	0	112.4	W137 T226 H227 E228 L233 G234 L235	W137-G230 VanDerWaalsContact CZ2-CA 3.41Å; T226-G230 PolarHBondContact O-N 3.08Å; H227-G230 WeakPolarHBondContact O-CA 3.21Å; H227-G230 PolarHBondContact O-N 3.07Å; E228-G230 PolarHBondContact O-N 2.87Å; G230-L233 CarbonylContact O-C 3.55Å; G230-L233 PolarHBondContact O-N 2.96Å; G230-L233 VanDerWaalsContact O-N 3.17Å; G230-G234 PolarHBondContact O-N 2.98Å; G230-L235 VanDerWaalsContact O-CB 3.26Å; G230-L235 WeakPolarHBondContact O-CB 3.41Å; G230-L235 PolarHBondContact O-N 3.26Å
231	H	92.7	Very high	89.9	Confident	14 Å²	14	13.5 Å²	13.5	7%	0.065	7%	0.073	C	C	.	.	H	α-helix	trans	-64.4	-43.1	172	-67.3	-41.1	0	0	0	112.2	A187 F189 H227 E228 I229 L233 G234 L235 H237 M245	A187-H231 HydrophobicContact CB-CB 3.8Å; F189-H231 WeakPolarHBondContact CD1-O 3.45Å; F189-H231 HydrophobicContact CE1-CB 4.24Å; F189-H231 AromaticContact CZ-ND1 3.98Å; H227-H231 AromaticContact CD2-CD2 3.92Å; H227-H231 AromaticContact CD2-NE2 3.68Å; H227-H231 AromaticContact NE2-CD2 3.98Å; H227-H231 AromaticContact NE2-NE2 3.26Å; H227-H231 PolarHBondContact NE2-NE2 3.23Å; H227-H231 PolarHBondContact O-N 3.12Å; E228-H231 WeakPolarHBondContact O-CB 3.48Å; E228-H231 PolarHBondContact O-N 1.98Å; E228-H231 IonicContact OE2-CD2 3.98Å; I229-H231 VanDerWaalsContact C-N 3.31Å; I229-H231 PolarHBondContact O-N 3.1Å; H231-L233 PolarHBondContact O-N 2.8Å; H231-G234 WeakPolarHBondContact O-CA 3.46Å; H231-G234 PolarHBondContact O-N 3.29Å; H231-L235 WeakPolarHBondContact CA-O 3.12Å; H231-L235 PolarHBondContact ND1-O 3.38Å; H231-H237 AromaticContact CE1-CD2 3.79Å; H231-H237 AromaticContact CE1-NE2 3.87Å; H231-H237 AromaticContact NE2-CD2 3.81Å; H231-H237 AromaticContact NE2-NE2 3.49Å; H231-H237 PolarHBondContact NE2-NE2 3.1Å; H231-M245 WeakPolarHBondContact CE1-CE 3.32Å; H231-M245 WeakPolarHBondContact ND1-CE 3.45Å
232	V	95.2	Very high	89.3	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-62.9	-22.3	173.5	175.2	0	0	0	0	112.5	W104 I156 A187 P190 I195 E228 I229 G234	W104-V232 HydrophobicContact CZ2-CG1 4.43Å; W104-V232 PolarHBondContact NE1-O 2.81Å; I156-V232 HydrophobicContact CB-CG1 4.39Å; I156-V232 HydrophobicContact CD1-CG1 3.53Å; I156-V232 HydrophobicContact CG1-CG1 3.59Å; I156-V232 HydrophobicContact CG2-CG1 3.93Å; A187-V232 HydrophobicContact CB-CG2 3.96Å; P190-V232 WeakPolarHBondContact CD-O 3.4Å; P190-V232 WeakPolarHBondContact CG-O 3.46Å; I195-V232 HydrophobicContact CD1-CG2 3.66Å; I195-V232 HydrophobicContact CG1-CG2 3.37Å; E228-V232 PolarHBondContact O-N 3.04Å; I229-V232 CarbonylContact O-C 3.53Å; I229-V232 PolarHBondContact O-N 2.93Å; V232-G234 VanDerWaalsContact C-N 3.34Å
233	L	94.6	Very high	88.8	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	4.2	171.2	-64.5	179.6	0	0	0	113.2	L109 W137 F143 F145 I229 G230 H231 L265 Y269	L109-L233 HydrophobicContact CD1-CD2 4.09Å; W137-L233 HydrophobicContact CB-CD1 3.99Å; W137-L233 HydrophobicContact CD2-CD1 3.79Å; W137-L233 HydrophobicContact CE3-CD1 3.81Å; W137-L233 HydrophobicContact CG-CD1 3.9Å; F143-L233 HydrophobicContact CD1-CD2 4.04Å; F143-L233 HydrophobicContact CD2-CD1 4.38Å; F143-L233 HydrophobicContact CD2-CD2 3.89Å; F143-L233 HydrophobicContact CE1-CD2 4.06Å; F143-L233 HydrophobicContact CE2-CD2 3.92Å; F143-L233 HydrophobicContact CG-CD2 3.97Å; F143-L233 HydrophobicContact CZ-CD2 4Å; F145-L233 HydrophobicContact CE1-CD2 4.07Å; F145-L233 HydrophobicContact CZ-CD1 4.22Å; F145-L233 HydrophobicContact CZ-CD2 3.94Å; I229-L233 HydrophobicContact CG2-CD1 4.13Å; I229-L233 HydrophobicContact CG2-CG 4.2Å; I229-L233 VanDerWaalsContact O-CG 3.29Å; I229-L233 WeakPolarHBondContact O-CG 3.34Å; I229-L233 PolarHBondContact O-N 3.03Å; G230-L233 CarbonylContact O-C 3.55Å; G230-L233 PolarHBondContact O-N 2.96Å; G230-L233 VanDerWaalsContact O-N 3.17Å; H231-L233 PolarHBondContact O-N 2.8Å; L233-L265 HydrophobicContact CB-CD2 4.1Å; L233-L265 HydrophobicContact CD1-CD2 4.32Å; L233-Y269 WeakPolarHBondContact O-CE2 3.34Å; L233-Y269 VanDerWaalsContact O-CZ 3.27Å; L233-Y269 PolarHBondContact O-OH 3.1Å
234	G	89.3	Confident	88.7	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.3	0.1	176.7	0	0	0	0	0	114.9	T98 G230 H231 V232 L268	T98-G234 VanDerWaalsContact CG2-O 3.25Å; T98-G234 WeakPolarHBondContact CG2-O 3.4Å; T98-G234 PolarHBondContact OG1-O 3.15Å; G230-G234 PolarHBondContact O-N 2.98Å; H231-G234 WeakPolarHBondContact O-CA 3.46Å; H231-G234 PolarHBondContact O-N 3.29Å; V232-G234 VanDerWaalsContact C-N 3.34Å; G234-L268 WeakPolarHBondContact O-CD1 3.06Å
235	L	86.9	Confident	88.4	Confident	5 Å²	5	20.3 Å²	20.3	3%	0.026	10%	0.102	C	C	.	.			trans	-80.2	133.2	-178.9	-57.8	176.3	0	0	0	111.2	W137 F189 G230 H231 M245 E261 G264 L265 L268	W137-L235 HydrophobicContact CH2-CD1 3.39Å; W137-L235 HydrophobicContact CZ2-CD1 4.43Å; W137-L235 HydrophobicContact CZ3-CD1 3.63Å; F189-L235 WeakPolarHBondContact CE1-O 3.35Å; G230-L235 VanDerWaalsContact O-CB 3.26Å; G230-L235 WeakPolarHBondContact O-CB 3.41Å; G230-L235 PolarHBondContact O-N 3.26Å; H231-L235 WeakPolarHBondContact CA-O 3.12Å; H231-L235 PolarHBondContact ND1-O 3.38Å; L235-M245 HydrophobicContact CB-CE 4.28Å; L235-M245 HydrophobicContact CB-CG 4.46Å; L235-M245 HydrophobicContact CD1-CG 4.23Å; L235-E261 HydrophobicContact CD1-CB 4.27Å; L235-E261 HydrophobicContact CD1-CG 4.44Å; L235-G264 VanDerWaalsContact CD2-C 3.46Å; L235-L265 HydrophobicContact CD1-CD2 4.38Å; L235-L265 HydrophobicContact CD1-CG 4.17Å; L235-L265 HydrophobicContact CD2-CD2 4.32Å; L235-L265 HydrophobicContact CD2-CG 4.25Å; L235-L265 HydrophobicContact CG-CD2 4.37Å; L235-L268 HydrophobicContact CD2-CD1 3.87Å
236	M	82.5	Confident	87.8	Confident	13 Å²	13	21.9 Å²	21.9	6%	0.064	11%	0.109	C	C	.	.			trans	-83.6	175	166.7	-59.8	-161.1	71.6	0	0	111.4	T96 T98 F189 S238 I379	T96-M236 HydrophobicContact CG2-SD 3.65Å; T96-M236 VanDerWaalsContact O-CB 3.28Å; T96-M236 WeakPolarHBondContact O-CB 3.45Å; T96-M236 WeakPolarHBondContact O-CG 3.27Å; T96-M236 VanDerWaalsContact O-SD 3.33Å; T98-M236 HydrophobicContact CG2-CG 3.49Å; T98-M236 VanDerWaalsContact CG2-CG 3.49Å; T98-M236 HydrophobicContact CG2-SD 4.13Å; F189-M236 HydrophobicContact CZ-CG 4.2Å; M236-S238 PolarHBondContact O-N 3.45Å; M236-I379 HydrophobicContact CE-CG2 3.8Å; M236-I379 HydrophobicContact SD-CG2 3.95Å
237	H	81.6	Confident	87	Confident	50 Å²	50	25.8 Å²	25.8	23%	0.231	13%	0.13	C	C	.	.			trans	-55.8	135.7	171.2	-70.2	131.2	0	0	0	112.4	H227 H231 M245 L247	H227-H237 AromaticContact CE1-CD2 3.55Å; H227-H237 AromaticContact CE1-NE2 3.68Å; H227-H237 AromaticContact NE2-CD2 3.47Å; H227-H237 PolarHBondContact NE2-CD2 3.06Å; H227-H237 AromaticContact NE2-NE2 3.23Å; H227-H237 PolarHBondContact NE2-NE2 2.85Å; H231-H237 AromaticContact CE1-CD2 3.79Å; H231-H237 AromaticContact CE1-NE2 3.87Å; H231-H237 AromaticContact NE2-CD2 3.81Å; H231-H237 AromaticContact NE2-NE2 3.49Å; H231-H237 PolarHBondContact NE2-NE2 3.1Å; H237-M245 CarbonylContact C-O 3.57Å; H237-M245 WeakPolarHBondContact CA-O 3.4Å; H237-M245 PolarHBondContact CD2-O 2.54Å; H237-L247 WeakPolarHBondContact CE1-CD1 3.42Å
238	S	78.9	Confident	86.1	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.007	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-84.7	149	170.6	172.1	0	0	0	0	111.1	M236 D240 A243 M245 H246 D260	M236-S238 PolarHBondContact O-N 3.45Å; S238-D240 WeakPolarHBondContact OG-CB 3.37Å; S238-D240 PolarHBondContact OG-N 2.91Å; S238-A243 WeakPolarHBondContact OG-CB 3.48Å; S238-M245 PolarHBondContact N-O 3.05Å; S238-H246 WeakPolarHBondContact O-CA 2.86Å; S238-H246 PolarHBondContact O-CD2 3.02Å; S238-D260 WeakPolarHBondContact CB-OD2 3.49Å; S238-D260 PolarHBondContact OG-OD2 3.28Å
239	M	71.5	Confident	85	Confident	73 Å²	73	30.5 Å²	30.5	36%	0.36	16%	0.155	S	C	.	.	S	Bend	trans	-87.7	-6.6	168.9	-62.8	-60.7	-59.8	0	0	113.2	R94 P241 H359	R94-M239 PolarHBondContact O-N 3.42Å; M239-P241 WeakPolarHBondContact O-CD 3.42Å; M239-H359 HydrophobicContact CE-CB 4.1Å; M239-H359 HydrophobicContact SD-CB 4.29Å
240	D	74.6	Confident	83.4	Confident	27 Å²	27	31.8 Å²	31.8	14%	0.144	16%	0.163	C	C	.	.			trans	-75.1	116.3	175.5	-170.9	-30.4	0	0	0	109.3	R94 S238 K242 A243 H246	R94-D240 IonicContact NH1-OD2 3.07Å; R94-D240 PolarHBondContact NH1-OD2 3.22Å; S238-D240 WeakPolarHBondContact OG-CB 3.37Å; S238-D240 PolarHBondContact OG-N 2.91Å; D240-K242 PolarHBondContact O-N 3.1Å; D240-K242 WeakPolarHBondContact OD1-CB 3.25Å; D240-K242 PolarHBondContact OD1-N 3.35Å; D240-A243 HydrophobicContact CB-CB 4.02Å; D240-A243 VanDerWaalsContact O-CB 3.24Å; D240-A243 WeakPolarHBondContact O-CB 3.32Å; D240-A243 PolarHBondContact O-N 3.39Å; D240-H246 WeakPolarHBondContact O-CB 3.01Å; D240-H246 PolarHBondContact O-CD2 2.79Å
241	P	79.1	Confident	82.2	Confident	83 Å²	83	37.2 Å²	37.2	54%	0.539	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-7.8	-178.4	29	-37.1	0	0	0	113.3	M239 R254	M239-P241 WeakPolarHBondContact O-CD 3.42Å; P241-R254 PolarHBondContact O-NH1 3.43Å
242	K	83.2	Confident	81.4	Confident	149 Å²	149	39 Å²	39	65%	0.648	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-15.8	175.1	-63.3	-178.5	-179.2	176.5	0	113.5	D240 R254 T258	D240-K242 PolarHBondContact O-N 3.1Å; D240-K242 WeakPolarHBondContact OD1-CB 3.25Å; D240-K242 PolarHBondContact OD1-N 3.35Å; K242-R254 VanDerWaalsContact CA-NH1 3.34Å; K242-T258 VanDerWaalsContact O-CG2 3.27Å; K242-T258 WeakPolarHBondContact O-CG2 3.41Å
243	A	87.4	Confident	80.5	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	-62.6	145.7	179.6	0	0	0	0	0	111.7	S238 D240 H246 E261	S238-A243 WeakPolarHBondContact OG-CB 3.48Å; D240-A243 HydrophobicContact CB-CB 4.02Å; D240-A243 VanDerWaalsContact O-CB 3.24Å; D240-A243 WeakPolarHBondContact O-CB 3.32Å; D240-A243 PolarHBondContact O-N 3.39Å; A243-H246 HydrophobicContact CB-CB 4.33Å; A243-H246 WeakPolarHBondContact O-CB 3.48Å; A243-H246 PolarHBondContact O-N 2.75Å; A243-E261 VanDerWaalsContact C-OE1 3.3Å; A243-E261 WeakPolarHBondContact CA-OE1 3.44Å; A243-E261 WeakPolarHBondContact CB-OE1 3.21Å
244	I	91.8	Very high	79.9	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-29.7	167	-168.5	57.1	0	0	0	110.2	W137 H223 T226 H227 H246 A249 R254 I257 E261	W137-I244 HydrophobicContact CZ2-CG2 4.33Å; H223-I244 WeakPolarHBondContact ND1-CD1 3.47Å; T226-I244 HydrophobicContact CG2-CG1 3.88Å; T226-I244 HydrophobicContact CG2-CG2 4.46Å; H227-I244 PolarHBondContact ND1-O 3.21Å; I244-H246 VanDerWaalsContact C-N 3.25Å; I244-H246 PolarHBondContact O-N 3.41Å; I244-A249 WeakPolarHBondContact O-CB 3.34Å; I244-R254 WeakPolarHBondContact CD1-O 3.22Å; I244-I257 HydrophobicContact CG2-CG1 4.41Å; I244-E261 HydrophobicContact CG2-CG 3.8Å; I244-E261 WeakPolarHBondContact CG2-OE1 3.32Å; I244-E261 PolarHBondContact N-OE1 3.23Å
245	M	89.3	Confident	79.5	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	9.2	175.8	-62.7	-51.9	-60.8	0	0	113.8	W137 H227 H231 L235 H237 S238 E261	W137-M245 HydrophobicContact CH2-CG 4.43Å; W137-M245 HydrophobicContact CH2-SD 4.39Å; W137-M245 HydrophobicContact CZ2-SD 4.16Å; H227-M245 WeakPolarHBondContact O-CE 3.18Å; H231-M245 WeakPolarHBondContact CE1-CE 3.32Å; H231-M245 WeakPolarHBondContact ND1-CE 3.45Å; L235-M245 HydrophobicContact CB-CE 4.28Å; L235-M245 HydrophobicContact CB-CG 4.46Å; L235-M245 HydrophobicContact CD1-CG 4.23Å; H237-M245 CarbonylContact C-O 3.57Å; H237-M245 WeakPolarHBondContact CA-O 3.4Å; H237-M245 PolarHBondContact CD2-O 2.54Å; S238-M245 PolarHBondContact N-O 3.05Å; M245-E261 HydrophobicContact CB-CG 4.27Å; M245-E261 HydrophobicContact CG-CG 3.57Å; M245-E261 PolarHBondContact N-OE1 2.92Å
246	H	84.6	Confident	79.6	Confident	34 Å²	34	57 Å²	57	16%	0.157	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-68.3	143.8	176.7	-175.8	-95.3	0	0	0	111.1	H227 S238 D240 A243 I244 N248 A249	H227-H246 PolarHBondContact CE1-O 3.44Å; S238-H246 WeakPolarHBondContact O-CA 2.86Å; S238-H246 PolarHBondContact O-CD2 3.02Å; D240-H246 WeakPolarHBondContact O-CB 3.01Å; D240-H246 PolarHBondContact O-CD2 2.79Å; A243-H246 HydrophobicContact CB-CB 4.33Å; A243-H246 WeakPolarHBondContact O-CB 3.48Å; A243-H246 PolarHBondContact O-N 2.75Å; I244-H246 VanDerWaalsContact C-N 3.25Å; I244-H246 PolarHBondContact O-N 3.41Å; H246-N248 PolarHBondContact ND1-N 3.02Å; H246-N248 PolarHBondContact O-N 2.99Å; H246-N248 VanDerWaalsContact O-N 3.14Å; H246-A249 HydrophobicContact CB-CB 4.02Å; H246-A249 WeakPolarHBondContact O-CA 3.48Å; H246-A249 WeakPolarHBondContact O-CB 3.42Å; H246-A249 PolarHBondContact O-N 3.1Å
247	L	79.4	Confident	79.9	Confident	82 Å²	82	57.4 Å²	57.4	43%	0.429	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-37.1	-178.8	179.5	65.9	0	0	0	113.1	H237	H237-L247 WeakPolarHBondContact CE1-CD1 3.42Å
248	N	76.8	Confident	80.2	Confident	106 Å²	106	56.1 Å²	56.1	57%	0.567	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	13.8	177.6	-55.7	-13.3	0	0	0	112.7	H246 T250	H246-N248 PolarHBondContact ND1-N 3.02Å; H246-N248 PolarHBondContact O-N 2.99Å; H246-N248 VanDerWaalsContact O-N 3.14Å; N248-T250 VanDerWaalsContact C-N 3.27Å; N248-T250 PolarHBondContact O-N 3.27Å
249	A	72.9	Confident	80.3	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.008	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-65	-35.1	-177.1	0	0	0	0	0	111.6	H223 I244 H246 L251 T252	H223-A249 PolarHBondContact CE1-O 2.78Å; H223-A249 PolarHBondContact NE2-O 3.27Å; I244-A249 WeakPolarHBondContact O-CB 3.34Å; H246-A249 HydrophobicContact CB-CB 4.02Å; H246-A249 WeakPolarHBondContact O-CA 3.48Å; H246-A249 WeakPolarHBondContact O-CB 3.42Å; H246-A249 PolarHBondContact O-N 3.1Å; A249-L251 PolarHBondContact O-N 2.8Å; A249-T252 VanDerWaalsContact O-CB 3.29Å; A249-T252 WeakPolarHBondContact O-CB 3.35Å; A249-T252 WeakPolarHBondContact O-CG2 3.28Å; A249-T252 PolarHBondContact O-N 2.53Å; A249-T252 PolarHBondContact O-OG1 2.89Å
250	T	64.9	Low	80.8	Confident	29 Å²	29	55.7 Å²	55.7	18%	0.178	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-54.1	-17	-174.7	49.2	0	0	0	0	114.8	H223 N248	H223-T250 PolarHBondContact CD2-O 2.88Å; H223-T250 VanDerWaalsContact NE2-C 3.3Å; H223-T250 VanDerWaalsContact NE2-CA 3.29Å; H223-T250 WeakPolarHBondContact NE2-CA 3.4Å; H223-T250 PolarHBondContact NE2-O 2.84Å; N248-T250 VanDerWaalsContact C-N 3.27Å; N248-T250 PolarHBondContact O-N 3.27Å
251	L	68.8	Low	81.3	Confident	113 Å²	113	54.4 Å²	54.4	59%	0.592	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-108.1	14.7	177.3	-58.2	176.8	0	0	0	113.6	M208 A249	M208-L251 WeakPolarHBondContact CE-O 3.2Å; A249-L251 PolarHBondContact O-N 2.8Å
252	T	76.5	Confident	81.6	Confident	53 Å²	53	51.4 Å²	51.4	33%	0.325	25%	0.247	S	C	.	.	S	Bend	trans	-103.9	-17.3	-176.7	67.1	0	0	0	0	113.6	A249 R254	A249-T252 VanDerWaalsContact O-CB 3.29Å; A249-T252 WeakPolarHBondContact O-CB 3.35Å; A249-T252 WeakPolarHBondContact O-CG2 3.28Å; A249-T252 PolarHBondContact O-N 2.53Å; A249-T252 PolarHBondContact O-OG1 2.89Å; T252-R254 PolarHBondContact O-N 3.02Å; T252-R254 WeakPolarHBondContact OG1-CD 3.24Å; T252-R254 WeakPolarHBondContact OG1-CG 3.4Å
253	G	75.2	Confident	81.5	Confident	19 Å²	19	46.4 Å²	46.4	20%	0.196	22%	0.224	C	C	.	.			trans	66.3	15.8	-177.1	0	0	0	0	0	114.3	H223	H223-G253 PolarHBondContact NE2-N 3.35Å
254	R	82.1	Confident	81.1	Confident	101 Å²	101	46.5 Å²	46.5	38%	0.381	23%	0.225	S	C	.	.			trans	-80.6	133	-175.9	-68.1	174.7	-171.2	154	0.5	111.7	H223 P241 K242 I244 T252	H223-R254 PolarHBondContact CE1-N 3.2Å; H223-R254 PolarHBondContact CE1-O 2.9Å; H223-R254 PolarHBondContact ND1-N 2.87Å; H223-R254 PolarHBondContact ND1-O 3.27Å; P241-R254 PolarHBondContact O-NH1 3.43Å; K242-R254 VanDerWaalsContact CA-NH1 3.34Å; I244-R254 WeakPolarHBondContact CD1-O 3.22Å; T252-R254 PolarHBondContact O-N 3.02Å; T252-R254 WeakPolarHBondContact OG1-CD 3.24Å; T252-R254 WeakPolarHBondContact OG1-CG 3.4Å
255	K	82.3	Confident	80.8	Confident	64 Å²	64	46.7 Å²	46.7	28%	0.278	23%	0.226	S	C	.	.			trans	-114	14.8	-178.1	-56.3	174.3	-132.2	-153.1	0	113.1	L136 G206 D207 D220 V222 H223	L136-K255 VanDerWaalsContact CD1-O 3.29Å; L136-K255 WeakPolarHBondContact CD1-O 3.17Å; G206-K255 PolarHBondContact O-NZ 3.31Å; D207-K255 WeakPolarHBondContact OD1-CE 3.48Å; D207-K255 IonicContact OD1-NZ 2.75Å; D207-K255 PolarHBondContact OD1-NZ 3.22Å; D220-K255 WeakPolarHBondContact OD2-CD 3.47Å; D220-K255 WeakPolarHBondContact OD2-CE 3.5Å; D220-K255 IonicContact OD2-NZ 3.66Å; D220-K255 PolarHBondContact OD2-NZ 3.06Å; V222-K255 HydrophobicContact CB-CD 4.38Å; V222-K255 HydrophobicContact CG1-CD 4.29Å; V222-K255 HydrophobicContact CG1-CG 4.44Å; H223-K255 HydrophobicContact CB-CG 4.44Å
256	R	87.3	Confident	80.4	Confident	197 Å²	197	47.9 Å²	47.9	74%	0.743	23%	0.232	S	C	*	.			trans	-109.5	119.6	-173.6	-172.3	173.6	69.3	-166.2	1.6	110.1	T258	R256-T258 PolarHBondContact O-N 2.76Å
257	I	90.3	Very high	80.1	Confident	22 Å²	22	54 Å²	54	11%	0.113	25%	0.253	C	S	.	.			trans	-66.8	127.3	166.7	-57.4	176.1	0	0	0	107.9	L136 W137 V140 T226 I244 E261 V262	L136-I257 VanDerWaalsContact C-CD1 3.42Å; L136-I257 HydrophobicContact CB-CD1 3.89Å; L136-I257 HydrophobicContact CB-CG1 4.39Å; L136-I257 VanDerWaalsContact O-CD1 3.29Å; L136-I257 WeakPolarHBondContact O-CD1 3.41Å; W137-I257 HydrophobicContact CB-CD1 4.45Å; W137-I257 HydrophobicContact CD2-CD1 3.56Å; W137-I257 HydrophobicContact CE3-CD1 3.64Å; W137-I257 HydrophobicContact CG-CD1 3.93Å; W137-I257 HydrophobicContact CH2-CD1 4.45Å; W137-I257 HydrophobicContact CH2-CG2 4.46Å; W137-I257 HydrophobicContact CZ2-CD1 4.39Å; W137-I257 HydrophobicContact CZ3-CD1 4.1Å; W137-I257 HydrophobicContact CZ3-CG2 4.21Å; V140-I257 HydrophobicContact CG2-CD1 3.73Å; V140-I257 HydrophobicContact CG2-CG2 4.12Å; T226-I257 HydrophobicContact CG2-CD1 4.48Å; T226-I257 HydrophobicContact CG2-CG1 4.09Å; I244-I257 HydrophobicContact CG2-CG1 4.41Å; I257-E261 HydrophobicContact CG2-CB 3.57Å; I257-E261 HydrophobicContact CG2-CG 4.14Å; I257-V262 HydrophobicContact CG2-CG2 4.46Å
258	T	87.3	Confident	80.1	Confident	24 Å²	24	50.9 Å²	50.9	15%	0.147	24%	0.237	C	C	.	.			trans	-90.6	172	-179.3	79.4	0	0	0	0	110.6	K242 R256 D260 E261	K242-T258 VanDerWaalsContact O-CG2 3.27Å; K242-T258 WeakPolarHBondContact O-CG2 3.41Å; R256-T258 PolarHBondContact O-N 2.76Å; T258-D260 PolarHBondContact O-N 3.5Å; T258-D260 VanDerWaalsContact OG1-CB 3.32Å; T258-D260 WeakPolarHBondContact OG1-CB 3.35Å; T258-D260 PolarHBondContact OG1-N 3.44Å; T258-E261 WeakPolarHBondContact CA-OE2 3.27Å; T258-E261 VanDerWaalsContact CB-OE2 3.23Å; T258-E261 WeakPolarHBondContact CB-OE2 3.21Å; T258-E261 PolarHBondContact N-OE2 2.84Å; T258-E261 PolarHBondContact O-N 2.94Å; T258-E261 PolarHBondContact OG1-OE2 2.8Å
259	Q	81.1	Confident	80.5	Confident	63 Å²	63	47 Å²	47	29%	0.294	22%	0.215	S	C	.	.	H	α-helix	trans	-62.5	-26	175	-172.4	61.4	55.8	0	0	111.7	E261 V262 W263	Q259-E261 PolarHBondContact O-N 3.47Å; Q259-V262 PolarHBondContact O-N 3.09Å; Q259-W263 HydrophobicContact CB-CH2 3.99Å; Q259-W263 HydrophobicContact CB-CZ2 4.23Å; Q259-W263 HydrophobicContact CB-CZ3 4.31Å; Q259-W263 HydrophobicContact CG-CD2 4.08Å; Q259-W263 VanDerWaalsContact CG-CE2 3.46Å; Q259-W263 HydrophobicContact CG-CE3 4.36Å; Q259-W263 HydrophobicContact CG-CH2 3.39Å; Q259-W263 HydrophobicContact CG-CZ2 3.15Å; Q259-W263 HydrophobicContact CG-CZ3 3.99Å; Q259-W263 VanDerWaalsContact O-CD2 3.3Å; Q259-W263 PolarHBondContact O-N 2.75Å; Q259-W263 VanDerWaalsContact O-N 3.14Å
260	D	81.4	Confident	80.8	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.011	23%	0.23	C	C	.	.	H	α-helix	trans	-57.2	-53.5	177.3	-149.8	46.8	0	0	0	109.3	Y95 S238 T258 V262 W263 G264	Y95-D260 HydrophobicContact CE2-CB 4.15Å; Y95-D260 WeakPolarHBondContact CE2-O 3.45Å; Y95-D260 WeakPolarHBondContact CE2-OD1 3.29Å; Y95-D260 WeakPolarHBondContact CE2-OD2 3.49Å; Y95-D260 VanDerWaalsContact CZ-O 3.25Å; Y95-D260 WeakPolarHBondContact OH-CA 3.49Å; Y95-D260 WeakPolarHBondContact OH-CB 3.28Å; Y95-D260 PolarHBondContact OH-O 2.81Å; Y95-D260 PolarHBondContact OH-OD2 3.1Å; S238-D260 WeakPolarHBondContact CB-OD2 3.49Å; S238-D260 PolarHBondContact OG-OD2 3.28Å; T258-D260 PolarHBondContact O-N 3.5Å; T258-D260 VanDerWaalsContact OG1-CB 3.32Å; T258-D260 WeakPolarHBondContact OG1-CB 3.35Å; T258-D260 PolarHBondContact OG1-N 3.44Å; D260-V262 VanDerWaalsContact C-N 3.26Å; D260-V262 PolarHBondContact O-N 2.92Å; D260-W263 PolarHBondContact O-N 2.93Å; D260-G264 PolarHBondContact O-N 3.13Å; D260-G264 VanDerWaalsContact O-N 3.16Å
261	E	86.9	Confident	81.7	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.1	-33.9	-175.8	-71.3	80.5	-171.9	0	0	112.3	Y95 W137 L235 A243 I244 M245 I257 T258 Q259 W263 G264 L265	Y95-E261 WeakPolarHBondContact OH-CA 3.23Å; Y95-E261 PolarHBondContact OH-N 2.95Å; W137-E261 HydrophobicContact CH2-CB 3.93Å; W137-E261 HydrophobicContact CH2-CG 3.91Å; W137-E261 HydrophobicContact CZ3-CB 4.05Å; L235-E261 HydrophobicContact CD1-CB 4.27Å; L235-E261 HydrophobicContact CD1-CG 4.44Å; A243-E261 VanDerWaalsContact C-OE1 3.3Å; A243-E261 WeakPolarHBondContact CA-OE1 3.44Å; A243-E261 WeakPolarHBondContact CB-OE1 3.21Å; I244-E261 HydrophobicContact CG2-CG 3.8Å; I244-E261 WeakPolarHBondContact CG2-OE1 3.32Å; I244-E261 PolarHBondContact N-OE1 3.23Å; M245-E261 HydrophobicContact CB-CG 4.27Å; M245-E261 HydrophobicContact CG-CG 3.57Å; M245-E261 PolarHBondContact N-OE1 2.92Å; I257-E261 HydrophobicContact CG2-CB 3.57Å; I257-E261 HydrophobicContact CG2-CG 4.14Å; T258-E261 WeakPolarHBondContact CA-OE2 3.27Å; T258-E261 VanDerWaalsContact CB-OE2 3.23Å; T258-E261 WeakPolarHBondContact CB-OE2 3.21Å; T258-E261 PolarHBondContact N-OE2 2.84Å; T258-E261 PolarHBondContact O-N 2.94Å; T258-E261 PolarHBondContact OG1-OE2 2.8Å; Q259-E261 PolarHBondContact O-N 3.47Å; E261-W263 VanDerWaalsContact C-N 3.3Å; E261-W263 PolarHBondContact O-N 2.82Å; E261-G264 PolarHBondContact O-N 2.81Å; E261-G264 VanDerWaalsContact O-N 3.15Å; E261-L265 PolarHBondContact O-N 3.28Å
262	V	85.3	Confident	82.4	Confident	20 Å²	20	48.4 Å²	48.4	12%	0.121	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-41.8	176.4	176.5	0	0	0	0	110.4	V140 I257 Q259 D260 L265 H266	V140-V262 HydrophobicContact CB-CG2 4.06Å; V140-V262 HydrophobicContact CG2-CG2 4.39Å; I257-V262 HydrophobicContact CG2-CG2 4.46Å; Q259-V262 PolarHBondContact O-N 3.09Å; D260-V262 VanDerWaalsContact C-N 3.26Å; D260-V262 PolarHBondContact O-N 2.92Å; V262-L265 PolarHBondContact O-N 2.95Å; V262-H266 WeakPolarHBondContact CG1-NE2 3.29Å; V262-H266 WeakPolarHBondContact O-CB 3.42Å; V262-H266 PolarHBondContact O-CD2 2.81Å; V262-H266 VanDerWaalsContact O-CD2 3.28Å; V262-H266 VanDerWaalsContact O-CG 3.29Å; V262-H266 PolarHBondContact O-N 3.19Å
263	W	79.3	Confident	83	Confident	44 Å²	44	48.2 Å²	48.2	17%	0.167	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-40.2	173.6	-64.1	-42.5	0	0	0	112.5	Q259 D260 E261 L265 H266 R267 E307 F308	Q259-W263 HydrophobicContact CB-CH2 3.99Å; Q259-W263 HydrophobicContact CB-CZ2 4.23Å; Q259-W263 HydrophobicContact CB-CZ3 4.31Å; Q259-W263 HydrophobicContact CG-CD2 4.08Å; Q259-W263 VanDerWaalsContact CG-CE2 3.46Å; Q259-W263 HydrophobicContact CG-CE3 4.36Å; Q259-W263 HydrophobicContact CG-CH2 3.39Å; Q259-W263 HydrophobicContact CG-CZ2 3.15Å; Q259-W263 HydrophobicContact CG-CZ3 3.99Å; Q259-W263 VanDerWaalsContact O-CD2 3.3Å; Q259-W263 PolarHBondContact O-N 2.75Å; Q259-W263 VanDerWaalsContact O-N 3.14Å; D260-W263 PolarHBondContact O-N 2.93Å; E261-W263 VanDerWaalsContact C-N 3.3Å; E261-W263 PolarHBondContact O-N 2.82Å; W263-L265 VanDerWaalsContact C-N 3.33Å; W263-L265 PolarHBondContact O-N 3.45Å; W263-H266 PolarHBondContact O-N 2.78Å; W263-R267 WeakPolarHBondContact O-CB 3.43Å; W263-R267 PolarHBondContact O-N 2.73Å; W263-E307 WeakPolarHBondContact CZ2-O 3.49Å; W263-F308 HydrophobicContact CD2-CB 4.19Å; W263-F308 AromaticContact CD2-CD2 3.82Å; W263-F308 HydrophobicContact CD2-CD2 3.82Å; W263-F308 HydrophobicContact CD2-CE2 4.23Å; W263-F308 AromaticContact CD2-CG 3.98Å; W263-F308 HydrophobicContact CD2-CG 3.98Å; W263-F308 AromaticContact CE2-CD2 3.68Å; W263-F308 HydrophobicContact CE3-CD1 4.34Å; W263-F308 AromaticContact CE3-CD2 3.48Å; W263-F308 HydrophobicContact CE3-CD2 3.48Å; W263-F308 VanDerWaalsContact CE3-CD2 3.48Å; W263-F308 HydrophobicContact CE3-CE1 4.24Å; W263-F308 AromaticContact CE3-CE2 3.41Å; W263-F308 HydrophobicContact CE3-CE2 3.41Å; W263-F308 VanDerWaalsContact CE3-CE2 3.41Å; W263-F308 AromaticContact CE3-CG 3.91Å; W263-F308 HydrophobicContact CE3-CG 3.91Å; W263-F308 AromaticContact CE3-CZ 3.72Å; W263-F308 HydrophobicContact CE3-CZ 3.72Å; W263-F308 AromaticContact CH2-CD2 3.02Å; W263-F308 HydrophobicContact CH2-CD2 3.02Å; W263-F308 AromaticContact CH2-CE2 3.1Å; W263-F308 HydrophobicContact CH2-CE2 3.1Å; W263-F308 HydrophobicContact CH2-CG 4.11Å; W263-F308 HydrophobicContact CH2-CZ 4.18Å; W263-F308 HydrophobicContact CZ2-CB 4.15Å; W263-F308 AromaticContact CZ2-CD2 3.26Å; W263-F308 HydrophobicContact CZ2-CD2 3.26Å; W263-F308 AromaticContact CZ2-CE2 3.86Å; W263-F308 HydrophobicContact CZ2-CE2 3.86Å; W263-F308 HydrophobicContact CZ2-CG 4.04Å; W263-F308 AromaticContact CZ3-CD2 3.16Å; W263-F308 HydrophobicContact CZ3-CD2 3.16Å; W263-F308 HydrophobicContact CZ3-CE1 4.41Å; W263-F308 AromaticContact CZ3-CE2 2.84Å; W263-F308 HydrophobicContact CZ3-CE2 2.84Å; W263-F308 HydrophobicContact CZ3-CG 4.06Å; W263-F308 AromaticContact CZ3-CZ 3.5Å; W263-F308 HydrophobicContact CZ3-CZ 3.5Å
264	G	80	Confident	83.5	Confident	2 Å²	2	51.2 Å²	51.2	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-56.8	-46.4	174.8	0	0	0	0	0	112	L235 D260 E261 R267 L268	L235-G264 VanDerWaalsContact CD2-C 3.46Å; D260-G264 PolarHBondContact O-N 3.13Å; D260-G264 VanDerWaalsContact O-N 3.16Å; E261-G264 PolarHBondContact O-N 2.81Å; E261-G264 VanDerWaalsContact O-N 3.15Å; G264-R267 WeakPolarHBondContact O-CB 3.3Å; G264-R267 PolarHBondContact O-N 3.2Å; G264-L268 WeakPolarHBondContact O-CG 3.12Å; G264-L268 PolarHBondContact O-N 3.18Å
265	L	85.1	Confident	83.8	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-64.9	-44.4	176.4	-76.6	172.7	0	0	0	112.5	W137 F143 L233 L235 E261 V262 W263 R267 L268 Y269	W137-L265 HydrophobicContact CE3-CD1 3.76Å; W137-L265 HydrophobicContact CZ3-CD1 3.68Å; W137-L265 HydrophobicContact CZ3-CG 4.3Å; F143-L265 HydrophobicContact CE2-CD2 4.4Å; L233-L265 HydrophobicContact CB-CD2 4.1Å; L233-L265 HydrophobicContact CD1-CD2 4.32Å; L235-L265 HydrophobicContact CD1-CD2 4.38Å; L235-L265 HydrophobicContact CD1-CG 4.17Å; L235-L265 HydrophobicContact CD2-CD2 4.32Å; L235-L265 HydrophobicContact CD2-CG 4.25Å; L235-L265 HydrophobicContact CG-CD2 4.37Å; E261-L265 PolarHBondContact O-N 3.28Å; V262-L265 PolarHBondContact O-N 2.95Å; W263-L265 VanDerWaalsContact C-N 3.33Å; W263-L265 PolarHBondContact O-N 3.45Å; L265-R267 PolarHBondContact O-N 2.77Å; L265-L268 PolarHBondContact O-N 2.83Å; L265-L268 VanDerWaalsContact O-N 3.15Å; L265-Y269 HydrophobicContact CD2-CD2 3.82Å; L265-Y269 HydrophobicContact CD2-CE2 3.78Å; L265-Y269 PolarHBondContact O-N 3.31Å
266	H	82.2	Confident	84.3	Confident	25 Å²	25	55.8 Å²	55.8	12%	0.116	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-31.2	177.1	-72.5	-28.6	0	0	0	112.7	V262 W263 G270 C271	V262-H266 WeakPolarHBondContact CG1-NE2 3.29Å; V262-H266 WeakPolarHBondContact O-CB 3.42Å; V262-H266 PolarHBondContact O-CD2 2.81Å; V262-H266 VanDerWaalsContact O-CD2 3.28Å; V262-H266 VanDerWaalsContact O-CG 3.29Å; V262-H266 PolarHBondContact O-N 3.19Å; W263-H266 PolarHBondContact O-N 2.78Å; H266-G270 WeakPolarHBondContact CA-O 3.42Å; H266-G270 PolarHBondContact ND1-O 3.07Å; H266-G270 CarbonylContact O-C 3.58Å; H266-G270 VanDerWaalsContact O-C 3.27Å; H266-G270 WeakPolarHBondContact O-CA 3.46Å; H266-G270 PolarHBondContact O-N 3.02Å; H266-C271 HydrophobicContact CB-CB 4.01Å
267	R	78.1	Confident	84.7	Confident	162 Å²	162	49.2 Å²	49.2	61%	0.611	24%	0.237	S	C	*	.	H	α-helix	trans	-70.2	-38.3	175.3	-175.7	60.9	167	169.2	0.6	112.3	L97 W263 G264 L265 E355	L97-R267 HydrophobicContact CD1-CG 3.43Å; L97-R267 VanDerWaalsContact CD1-CG 3.43Å; L97-R267 VanDerWaalsContact CD1-NE 3.29Å; L97-R267 HydrophobicContact CD2-CB 4.23Å; L97-R267 HydrophobicContact CD2-CG 3.59Å; L97-R267 HydrophobicContact CG-CG 4.17Å; W263-R267 WeakPolarHBondContact O-CB 3.43Å; W263-R267 PolarHBondContact O-N 2.73Å; G264-R267 WeakPolarHBondContact O-CB 3.3Å; G264-R267 PolarHBondContact O-N 3.2Å; L265-R267 PolarHBondContact O-N 2.77Å; R267-E355 IonicContact CZ-OE1 3.68Å; R267-E355 IonicContact NE-OE1 3.7Å; R267-E355 IonicContact NH2-OE1 2.8Å; R267-E355 PolarHBondContact NH2-OE1 3.47Å
268	L	79.4	Confident	84.9	Confident	18 Å²	18	48.1 Å²	48.1	9%	0.094	23%	0.232	C	C	.	.	H	α-helix	trans	-80	-42.5	-179	-68.9	174.3	0	0	0	113.4	K103 G234 L235 G264 L265	K103-L268 PolarHBondContact NZ-O 2.99Å; G234-L268 WeakPolarHBondContact O-CD1 3.06Å; L235-L268 HydrophobicContact CD2-CD1 3.87Å; G264-L268 WeakPolarHBondContact O-CG 3.12Å; G264-L268 PolarHBondContact O-N 3.18Å; L265-L268 PolarHBondContact O-N 2.83Å; L265-L268 VanDerWaalsContact O-N 3.15Å
269	Y	83.9	Confident	85.2	Confident	24 Å²	24	50.2 Å²	50.2	9%	0.094	25%	0.245	C	C	.	.	H	α-helix	trans	-112.7	-3	-168.8	-61.5	-70.7	0	0	0	114.1	K103 W104 F107 F143 L233 L265	K103-Y269 HydrophobicContact CB-CE1 3.77Å; K103-Y269 HydrophobicContact CD-CE1 4.44Å; K103-Y269 HydrophobicContact CG-CE1 4.4Å; W104-Y269 HydrophobicContact CB-CE1 4.35Å; W104-Y269 PolarHBondContact N-OH 3.24Å; W104-Y269 WeakPolarHBondContact O-CE1 3.33Å; F107-Y269 AromaticContact CE1-CD1 3.8Å; F107-Y269 HydrophobicContact CE1-CD1 3.8Å; F107-Y269 AromaticContact CE1-CG 3.96Å; F107-Y269 HydrophobicContact CE1-CG 3.96Å; F107-Y269 HydrophobicContact CZ-CD1 4.37Å; F143-Y269 HydrophobicContact CE2-CD1 4.28Å; F143-Y269 AromaticContact CE2-CD2 3.73Å; F143-Y269 HydrophobicContact CE2-CD2 3.73Å; F143-Y269 HydrophobicContact CE2-CE1 4.2Å; F143-Y269 AromaticContact CE2-CE2 3.64Å; F143-Y269 HydrophobicContact CE2-CE2 3.64Å; F143-Y269 HydrophobicContact CE2-CG 4.05Å; F143-Y269 AromaticContact CE2-CZ 3.89Å; F143-Y269 AromaticContact CZ-CD1 3.87Å; F143-Y269 HydrophobicContact CZ-CD1 3.87Å; F143-Y269 HydrophobicContact CZ-CD2 4.06Å; F143-Y269 AromaticContact CZ-CE1 3.53Å; F143-Y269 HydrophobicContact CZ-CE1 3.53Å; F143-Y269 AromaticContact CZ-CE2 3.73Å; F143-Y269 HydrophobicContact CZ-CE2 3.73Å; F143-Y269 HydrophobicContact CZ-CG 4.12Å; F143-Y269 AromaticContact CZ-CZ 3.45Å; F143-Y269 VanDerWaalsContact CZ-CZ 3.45Å; L233-Y269 WeakPolarHBondContact O-CE2 3.34Å; L233-Y269 VanDerWaalsContact O-CZ 3.27Å; L233-Y269 PolarHBondContact O-OH 3.1Å; L265-Y269 HydrophobicContact CD2-CD2 3.82Å; L265-Y269 HydrophobicContact CD2-CE2 3.78Å; L265-Y269 PolarHBondContact O-N 3.31Å
270	G	80.6	Confident	86	Confident	32 Å²	32	49 Å²	49	33%	0.33	24%	0.244	S	C	.	.			trans	84.6	165.1	-173.4	0	0	0	0	0	112.8	H266	H266-G270 WeakPolarHBondContact CA-O 3.42Å; H266-G270 PolarHBondContact ND1-O 3.07Å; H266-G270 CarbonylContact O-C 3.58Å; H266-G270 VanDerWaalsContact O-C 3.27Å; H266-G270 WeakPolarHBondContact O-CA 3.46Å; H266-G270 PolarHBondContact O-N 3.02Å
271	C	83.3	Confident	86.7	Confident	19 Å²	19	51.6 Å²	51.6	13%	0.128	25%	0.254	C	S	.	.			trans	-114.1	98.1	175.9	-166.3	0	0	0	0	109.1	H266 C305	H266-C271 HydrophobicContact CB-CB 4.01Å; C271-C305 HydrophobicContact CB-CB 3.47Å; C271-C305 VanDerWaalsContact CB-CB 3.47Å; C271-C305 WeakPolarHBondContact CB-SG 3.21Å; C271-C305 WeakPolarHBondContact SG-CB 3.45Å; C271-C305 CovalentContact SG-SG 1.99Å; C271-C305 PolarHBondContact SG-SG 2.64Å
272	L	83.5	Confident	87.1	Confident	121 Å²	121	52.7 Å²	52.7	63%	0.634	26%	0.263	S	S	*	.			trans	-123.2	144.7	-172.8	-60.5	176.2	0	0	0	110.6	P299	L272-P299 WeakPolarHBondContact O-CG 3.42Å
273	D	88.3	Confident	87.6	Confident	50 Å²	50	61.7 Å²	61.7	27%	0.267	29%	0.294	S	S	.	.			trans	-69.8	133.8	168.9	-69.8	-20.5	0	0	0	110.2	C278 C298 S300 S301	D273-C278 HydrophobicContact CB-CB 3.9Å; D273-C278 WeakPolarHBondContact OD2-CB 3.49Å; D273-C298 WeakPolarHBondContact OD1-CA 3.06Å; D273-S300 WeakPolarHBondContact OD1-CA 3.2Å; D273-S300 VanDerWaalsContact OD1-CB 3.3Å; D273-S300 WeakPolarHBondContact OD1-CB 3.33Å; D273-S300 PolarHBondContact OD1-N 2.7Å; D273-S301 PolarHBondContact OD1-N 2.65Å; D273-S301 WeakPolarHBondContact OD2-CB 3.38Å; D273-S301 PolarHBondContact OD2-N 3.02Å; D273-S301 VanDerWaalsContact OD2-N 3.17Å; D273-S301 PolarHBondContact OD2-OG 2.73Å
274	R	85.3	Confident	88.4	Confident	82 Å²	82	66.3 Å²	66.3	31%	0.309	32%	0.316	S	S	.	.	S	Bend	trans	-86	-19.9	178.8	-52.9	-168.7	-163.3	177.7	13.3	112.8	S138 V140 S141 R296 H297	S138-R274 PolarHBondContact O-NH1 2.98Å; V140-R274 PolarHBondContact O-NH2 2.95Å; S141-R274 VanDerWaalsContact CA-NH2 3.3Å; S141-R274 PolarHBondContact O-NH1 2.85Å; S141-R274 PolarHBondContact O-NH2 2.86Å; R274-R296 PolarHBondContact NE-O 3.41Å; R274-R296 PolarHBondContact NH2-O 2.74Å; R274-H297 WeakPolarHBondContact CB-O 3.29Å; R274-H297 PolarHBondContact N-O 3.31Å
275	L	89.6	Confident	89	Confident	65 Å²	65	67.7 Å²	67.7	34%	0.34	33%	0.33	S	S	.	.	S	Bend	trans	-124.5	136.7	-176.1	-57.6	175.1	0	0	0	110.6	I277 C278 W281 H297	L275-I277 HydrophobicContact CB-CG2 4.08Å; L275-I277 PolarHBondContact O-N 2.94Å; L275-I277 VanDerWaalsContact O-N 3.13Å; L275-C278 WeakPolarHBondContact O-CB 3.39Å; L275-C278 PolarHBondContact O-N 3.43Å; L275-C278 PolarHBondContact O-SG 2.6Å; L275-W281 HydrophobicContact CD1-CH2 3.75Å; L275-W281 HydrophobicContact CD1-CZ3 3.63Å; L275-H297 HydrophobicContact CD1-CB 3.76Å; L275-H297 HydrophobicContact CG-CB 4.1Å
276	F	92.5	Very high	89.6	Confident	196 Å²	196	70.1 Å²	70.1	86%	0.86	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.7	177.8	75.4	-89.6	0	0	0	113.2	C278 P279	F276-C278 VanDerWaalsContact C-N 3.28Å; F276-C278 PolarHBondContact O-N 3.41Å; F276-P279 WeakPolarHBondContact O-CD 3.28Å
277	I	94.9	Very high	90	Very high	58 Å²	58	69.9 Å²	69.9	30%	0.297	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-7.4	-178.4	-163.1	161.2	0	0	0	113.4	L275 S280 W281	L275-I277 HydrophobicContact CB-CG2 4.08Å; L275-I277 PolarHBondContact O-N 2.94Å; L275-I277 VanDerWaalsContact O-N 3.13Å; I277-S280 WeakPolarHBondContact O-CA 3.38Å; I277-S280 WeakPolarHBondContact O-CB 3.41Å; I277-S280 PolarHBondContact O-N 3.23Å; I277-W281 HydrophobicContact CD1-CZ2 4.38Å; I277-W281 HydrophobicContact CG1-CD2 4.46Å; I277-W281 HydrophobicContact CG1-CG 4.41Å; I277-W281 HydrophobicContact CG2-CD2 3.75Å; I277-W281 VanDerWaalsContact CG2-CE2 3.49Å; I277-W281 HydrophobicContact CG2-CE3 3.94Å; I277-W281 HydrophobicContact CG2-CG 4.45Å; I277-W281 HydrophobicContact CG2-CH2 3.72Å; I277-W281 HydrophobicContact CG2-CZ2 3.5Å; I277-W281 VanDerWaalsContact CG2-CZ2 3.5Å; I277-W281 HydrophobicContact CG2-CZ3 3.93Å; I277-W281 PolarHBondContact O-N 2.9Å
278	C	94.4	Very high	90.7	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-51.6	-44.9	-176.6	-70	0	0	0	0	114.3	D273 L275 F276 S280 W281 A282 H297 C298 S301	D273-C278 HydrophobicContact CB-CB 3.9Å; D273-C278 WeakPolarHBondContact OD2-CB 3.49Å; L275-C278 WeakPolarHBondContact O-CB 3.39Å; L275-C278 PolarHBondContact O-N 3.43Å; L275-C278 PolarHBondContact O-SG 2.6Å; F276-C278 VanDerWaalsContact C-N 3.28Å; F276-C278 PolarHBondContact O-N 3.41Å; C278-S280 VanDerWaalsContact C-N 3.26Å; C278-S280 PolarHBondContact O-N 3.44Å; C278-W281 PolarHBondContact O-N 3.45Å; C278-W281 VanDerWaalsContact O-N 3.17Å; C278-A282 WeakPolarHBondContact O-CB 3.05Å; C278-A282 PolarHBondContact O-N 3.36Å; C278-H297 PolarHBondContact SG-O 3.41Å; C278-C298 WeakPolarHBondContact CA-SG 3.15Å; C278-C298 HydrophobicContact CB-CB 3.45Å; C278-C298 VanDerWaalsContact CB-CB 3.45Å; C278-C298 WeakPolarHBondContact CB-SG 3.36Å; C278-C298 WeakPolarHBondContact SG-CA 3.41Å; C278-C298 WeakPolarHBondContact SG-CB 3.47Å; C278-C298 CovalentContact SG-SG 2.01Å; C278-C298 PolarHBondContact SG-SG 2.96Å; C278-S301 WeakPolarHBondContact CB-OG 3.41Å
279	P	95.2	Very high	91.4	Very high	67 Å²	67	71.7 Å²	71.7	44%	0.435	37%	0.369	S	S	.	.	H	α-helix	trans	-64.3	-29.6	176.5	-23.9	35.1	0	0	0	113.4	F276 R283	F276-P279 WeakPolarHBondContact O-CD 3.28Å; P279-R283 WeakPolarHBondContact O-CG 3.32Å; P279-R283 PolarHBondContact O-N 3.3Å; P279-R283 PolarHBondContact O-NE 3Å
280	S	96.1	Very high	91.8	Very high	38 Å²	38	75 Å²	75	27%	0.266	38%	0.383	S	S	.	.	H	α-helix	trans	-73.9	-39.3	175.1	-177.5	0	0	0	0	111.8	I277 C278 K284	I277-S280 WeakPolarHBondContact O-CA 3.38Å; I277-S280 WeakPolarHBondContact O-CB 3.41Å; I277-S280 PolarHBondContact O-N 3.23Å; C278-S280 VanDerWaalsContact C-N 3.26Å; C278-S280 PolarHBondContact O-N 3.44Å; S280-K284 WeakPolarHBondContact O-CG 3.24Å; S280-K284 PolarHBondContact O-N 2.83Å
281	W	96.4	Very high	92.2	Very high	56 Å²	56	78 Å²	78	21%	0.212	39%	0.385	C	S	.	.	H	α-helix	trans	-69	-41.5	177.4	-74	-8.8	0	0	0	111.8	L275 I277 C278 R283 K284 G285 Y286 L293 M294	L275-W281 HydrophobicContact CD1-CH2 3.75Å; L275-W281 HydrophobicContact CD1-CZ3 3.63Å; I277-W281 HydrophobicContact CD1-CZ2 4.38Å; I277-W281 HydrophobicContact CG1-CD2 4.46Å; I277-W281 HydrophobicContact CG1-CG 4.41Å; I277-W281 HydrophobicContact CG2-CD2 3.75Å; I277-W281 VanDerWaalsContact CG2-CE2 3.49Å; I277-W281 HydrophobicContact CG2-CE3 3.94Å; I277-W281 HydrophobicContact CG2-CG 4.45Å; I277-W281 HydrophobicContact CG2-CH2 3.72Å; I277-W281 HydrophobicContact CG2-CZ2 3.5Å; I277-W281 VanDerWaalsContact CG2-CZ2 3.5Å; I277-W281 HydrophobicContact CG2-CZ3 3.93Å; I277-W281 PolarHBondContact O-N 2.9Å; C278-W281 PolarHBondContact O-N 3.45Å; C278-W281 VanDerWaalsContact O-N 3.17Å; W281-R283 PolarHBondContact O-N 3.27Å; W281-K284 CarbonylContact O-C 3.53Å; W281-K284 WeakPolarHBondContact O-CA 3.16Å; W281-K284 PolarHBondContact O-N 3.14Å; W281-G285 PolarHBondContact O-N 3.38Å; W281-Y286 HydrophobicContact CB-CD2 3.65Å; W281-Y286 HydrophobicContact CB-CE2 4.44Å; W281-Y286 HydrophobicContact CB-CG 4.06Å; W281-Y286 AromaticContact CD1-CD2 3.91Å; W281-Y286 AromaticContact CD1-CE2 3.83Å; W281-Y286 HydrophobicContact CD2-CD2 4.08Å; W281-Y286 HydrophobicContact CD2-CE2 4.39Å; W281-Y286 AromaticContact CG-CD2 3.6Å; W281-Y286 HydrophobicContact CG-CD2 3.6Å; W281-Y286 AromaticContact CG-CE2 3.98Å; W281-Y286 HydrophobicContact CG-CE2 3.98Å; W281-Y286 HydrophobicContact CG-CG 4.46Å; W281-Y286 VanDerWaalsContact O-CB 3.27Å; W281-Y286 WeakPolarHBondContact O-CB 3.12Å; W281-Y286 PolarHBondContact O-N 2.7Å; W281-Y286 VanDerWaalsContact O-N 3.1Å; W281-L293 HydrophobicContact CE3-CD2 3.66Å; W281-L293 HydrophobicContact CH2-CD2 4.38Å; W281-L293 HydrophobicContact CZ3-CD2 3.57Å; W281-L293 HydrophobicContact CZ3-CG 4.5Å; W281-M294 HydrophobicContact CB-CE 3.79Å; W281-M294 HydrophobicContact CB-SD 3.74Å; W281-M294 HydrophobicContact CD2-SD 4.48Å; W281-M294 HydrophobicContact CE3-SD 3.86Å
282	A	94.8	Very high	92.1	Very high	23 Å²	23	87.5 Å²	87.5	19%	0.19	42%	0.418	C	S	.	.	H	α-helix	trans	-57.2	-47.9	174.8	0	0	0	0	0	111.6	C278 K284 G285 M294	C278-A282 WeakPolarHBondContact O-CB 3.05Å; C278-A282 PolarHBondContact O-N 3.36Å; A282-K284 PolarHBondContact O-N 3.33Å; A282-G285 PolarHBondContact O-N 3.37Å; A282-M294 HydrophobicContact CB-CE 4.13Å
283	R	95.9	Very high	92.4	Very high	209 Å²	209	84.9 Å²	84.9	79%	0.789	41%	0.405	S	S	*	.	H	α-helix	trans	-61	-25.3	174.9	-75.5	-174.2	-69	159.9	-3.9	114.4	P279 W281 G285	P279-R283 WeakPolarHBondContact O-CG 3.32Å; P279-R283 PolarHBondContact O-N 3.3Å; P279-R283 PolarHBondContact O-NE 3Å; W281-R283 PolarHBondContact O-N 3.27Å; R283-G285 PolarHBondContact O-N 3.36Å
284	K	96.1	Very high	92.4	Very high	141 Å²	141	82.5 Å²	82.5	61%	0.613	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	7	174.5	-73.2	-178.8	178	-176.3	0	113.2	S280 W281 A282 Y286	S280-K284 WeakPolarHBondContact O-CG 3.24Å; S280-K284 PolarHBondContact O-N 2.83Å; W281-K284 CarbonylContact O-C 3.53Å; W281-K284 WeakPolarHBondContact O-CA 3.16Å; W281-K284 PolarHBondContact O-N 3.14Å; A282-K284 PolarHBondContact O-N 3.33Å; K284-Y286 HydrophobicContact CB-CD1 4Å; K284-Y286 HydrophobicContact CB-CE1 4.03Å
285	G	94.3	Very high	92.2	Very high	31 Å²	31	81.5 Å²	81.5	32%	0.32	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	15.3	179.8	0	0	0	0	0	114.3	W281 A282 R283 C287 D288 S289	W281-G285 PolarHBondContact O-N 3.38Å; A282-G285 PolarHBondContact O-N 3.37Å; R283-G285 PolarHBondContact O-N 3.36Å; G285-C287 PolarHBondContact O-N 3.06Å; G285-D288 PolarHBondContact O-N 3Å; G285-S289 PolarHBondContact O-N 3.26Å; G285-S289 VanDerWaalsContact O-N 3.08Å; G285-S289 PolarHBondContact O-OG 3.49Å
286	Y	96.2	Very high	91.7	Very high	55 Å²	55	83 Å²	83	22%	0.216	39%	0.392	C	S	.	.	H	α-helix	trans	-69.6	-18.2	-176.6	-76.1	16.9	0	0	0	112.9	W281 K284 D288 K290 R291 M294	W281-Y286 HydrophobicContact CB-CD2 3.65Å; W281-Y286 HydrophobicContact CB-CE2 4.44Å; W281-Y286 HydrophobicContact CB-CG 4.06Å; W281-Y286 AromaticContact CD1-CD2 3.91Å; W281-Y286 AromaticContact CD1-CE2 3.83Å; W281-Y286 HydrophobicContact CD2-CD2 4.08Å; W281-Y286 HydrophobicContact CD2-CE2 4.39Å; W281-Y286 AromaticContact CG-CD2 3.6Å; W281-Y286 HydrophobicContact CG-CD2 3.6Å; W281-Y286 AromaticContact CG-CE2 3.98Å; W281-Y286 HydrophobicContact CG-CE2 3.98Å; W281-Y286 HydrophobicContact CG-CG 4.46Å; W281-Y286 VanDerWaalsContact O-CB 3.27Å; W281-Y286 WeakPolarHBondContact O-CB 3.12Å; W281-Y286 PolarHBondContact O-N 2.7Å; W281-Y286 VanDerWaalsContact O-N 3.1Å; K284-Y286 HydrophobicContact CB-CD1 4Å; K284-Y286 HydrophobicContact CB-CE1 4.03Å; Y286-D288 PolarHBondContact O-N 3.23Å; Y286-K290 HydrophobicContact CD1-CD 4.45Å; Y286-K290 HydrophobicContact CD2-CD 3.75Å; Y286-K290 HydrophobicContact CD2-CG 4.41Å; Y286-K290 HydrophobicContact CE1-CD 4.47Å; Y286-K290 HydrophobicContact CE2-CD 3.77Å; Y286-K290 HydrophobicContact CG-CB 4.41Å; Y286-K290 HydrophobicContact CG-CD 4.09Å; Y286-K290 HydrophobicContact CG-CG 4.29Å; Y286-K290 CarbonylContact O-C 3.59Å; Y286-K290 VanDerWaalsContact O-CA 3.25Å; Y286-K290 WeakPolarHBondContact O-CA 3.03Å; Y286-K290 PolarHBondContact O-N 3.47Å; Y286-K290 PolarHBondContact OH-NZ 2.78Å; Y286-R291 PolarHBondContact O-N 3.38Å; Y286-M294 VanDerWaalsContact C-CG 3.48Å; Y286-M294 WeakPolarHBondContact O-CG 3.3Å
287	C	91.3	Very high	91.5	Very high	20 Å²	20	76 Å²	76	14%	0.135	36%	0.362	C	S	.	.	H	α-helix	trans	-56.6	-39	173.5	-58.2	0	0	0	0	111.4	G285 R291 C302 F304	G285-C287 PolarHBondContact O-N 3.06Å; C287-R291 VanDerWaalsContact O-CA 3.31Å; C287-R291 WeakPolarHBondContact O-CA 3.35Å; C287-R291 WeakPolarHBondContact O-CB 3.21Å; C287-C302 WeakPolarHBondContact CA-SG 3.38Å; C287-C302 HydrophobicContact CB-CB 3.69Å; C287-C302 WeakPolarHBondContact CB-SG 3.4Å; C287-C302 WeakPolarHBondContact SG-CA 3.49Å; C287-C302 WeakPolarHBondContact SG-CB 3.46Å; C287-C302 CovalentContact SG-SG 2.03Å; C287-C302 PolarHBondContact SG-SG 2.96Å; C287-F304 HydrophobicContact CB-CZ 4.34Å
288	D	91.8	Very high	91.3	Very high	134 Å²	134	73.3 Å²	73.3	72%	0.717	35%	0.348	S	S	*	.	H	α-helix	trans	-91.8	-51.8	178.4	-56.3	-52.5	0	0	0	111.1	G285 Y286 K290	G285-D288 PolarHBondContact O-N 3Å; Y286-D288 PolarHBondContact O-N 3.23Å; D288-K290 VanDerWaalsContact C-N 3.32Å; D288-K290 PolarHBondContact O-N 2.91Å
289	S	95.1	Very high	91	Very high	85 Å²	85	73.5 Å²	73.5	59%	0.594	35%	0.349	S	S	*	.	H	α-helix	trans	-72.9	-24.5	-172.1	76.9	0	0	0	0	113.5	G285	G285-S289 PolarHBondContact O-N 3.26Å; G285-S289 VanDerWaalsContact O-N 3.08Å; G285-S289 PolarHBondContact O-OG 3.49Å
290	K	93.1	Very high	90.7	Very high	92 Å²	92	73 Å²	73	40%	0.4	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.4	42.6	-179.2	-58.1	-167.2	-177.2	179.2	0	111.4	Y286 D288 R292 L293 M294	Y286-K290 HydrophobicContact CD1-CD 4.45Å; Y286-K290 HydrophobicContact CD2-CD 3.75Å; Y286-K290 HydrophobicContact CD2-CG 4.41Å; Y286-K290 HydrophobicContact CE1-CD 4.47Å; Y286-K290 HydrophobicContact CE2-CD 3.77Å; Y286-K290 HydrophobicContact CG-CB 4.41Å; Y286-K290 HydrophobicContact CG-CD 4.09Å; Y286-K290 HydrophobicContact CG-CG 4.29Å; Y286-K290 CarbonylContact O-C 3.59Å; Y286-K290 VanDerWaalsContact O-CA 3.25Å; Y286-K290 WeakPolarHBondContact O-CA 3.03Å; Y286-K290 PolarHBondContact O-N 3.47Å; Y286-K290 PolarHBondContact OH-NZ 2.78Å; D288-K290 VanDerWaalsContact C-N 3.32Å; D288-K290 PolarHBondContact O-N 2.91Å; K290-R292 VanDerWaalsContact C-N 3.32Å; K290-R292 PolarHBondContact O-N 3.19Å; K290-R292 VanDerWaalsContact O-N 3.14Å; K290-L293 HydrophobicContact CB-CB 4.3Å; K290-L293 PolarHBondContact O-N 2.73Å; K290-M294 PolarHBondContact O-N 3.42Å
291	R	87.3	Confident	90.4	Very high	95 Å²	95	73 Å²	73	36%	0.358	35%	0.347	S	S	.	.	H	α-helix	trans	-46.2	-47.9	-175	-172.5	170.6	177.9	123.9	-0.9	114	Y286 C287 L293 M294 Q295 F304 E307	Y286-R291 PolarHBondContact O-N 3.38Å; C287-R291 VanDerWaalsContact O-CA 3.31Å; C287-R291 WeakPolarHBondContact O-CA 3.35Å; C287-R291 WeakPolarHBondContact O-CB 3.21Å; R291-L293 PolarHBondContact O-N 2.95Å; R291-M294 PolarHBondContact O-N 3.14Å; R291-Q295 HydrophobicContact CG-CG 4.15Å; R291-Q295 WeakPolarHBondContact O-CB 3.02Å; R291-Q295 VanDerWaalsContact O-CG 3.29Å; R291-Q295 WeakPolarHBondContact O-CG 3.27Å; R291-Q295 PolarHBondContact O-N 3.23Å; R291-F304 HydrophobicContact CG-CE1 4.18Å; R291-F304 HydrophobicContact CG-CZ 3.8Å; R291-E307 IonicContact CZ-OE2 3.77Å; R291-E307 IonicContact NH1-OE2 3.77Å; R291-E307 IonicContact NH2-OE2 2.82Å; R291-E307 PolarHBondContact NH2-OE2 3.26Å
292	R	83.1	Confident	90	Very high	220 Å²	220	71 Å²	71	83%	0.83	34%	0.341	S	S	*	.	H	α-helix	trans	-60.8	-42.9	-179.7	-69.8	-174.3	-178.6	178.4	2.1	113.4	K290 Q295 R296	K290-R292 VanDerWaalsContact C-N 3.32Å; K290-R292 PolarHBondContact O-N 3.19Å; K290-R292 VanDerWaalsContact O-N 3.14Å; R292-Q295 PolarHBondContact O-N 3.34Å; R292-R296 WeakPolarHBondContact O-CB 3.39Å; R292-R296 PolarHBondContact O-N 3.3Å; R292-R296 VanDerWaalsContact O-N 3.1Å
293	L	88.4	Confident	89.4	Confident	66 Å²	66	74.5 Å²	74.5	35%	0.346	36%	0.357	S	S	.	.	H	α-helix	trans	-66.3	-42.4	178.4	173.9	148.2	0	0	0	110.4	W281 K290 R291 R296 H297	W281-L293 HydrophobicContact CE3-CD2 3.66Å; W281-L293 HydrophobicContact CH2-CD2 4.38Å; W281-L293 HydrophobicContact CZ3-CD2 3.57Å; W281-L293 HydrophobicContact CZ3-CG 4.5Å; K290-L293 HydrophobicContact CB-CB 4.3Å; K290-L293 PolarHBondContact O-N 2.73Å; R291-L293 PolarHBondContact O-N 2.95Å; L293-R296 PolarHBondContact O-N 3.12Å; L293-H297 PolarHBondContact O-CD2 2.98Å; L293-H297 PolarHBondContact O-N 3.42Å
294	M	89.1	Confident	88.6	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-70.2	-36.8	177.7	-63.9	-57.5	-75.8	0	0	112.2	W281 A282 Y286 K290 R291 R296 C298 C302 F304	W281-M294 HydrophobicContact CB-CE 3.79Å; W281-M294 HydrophobicContact CB-SD 3.74Å; W281-M294 HydrophobicContact CD2-SD 4.48Å; W281-M294 HydrophobicContact CE3-SD 3.86Å; A282-M294 HydrophobicContact CB-CE 4.13Å; Y286-M294 VanDerWaalsContact C-CG 3.48Å; Y286-M294 WeakPolarHBondContact O-CG 3.3Å; K290-M294 PolarHBondContact O-N 3.42Å; R291-M294 PolarHBondContact O-N 3.14Å; M294-R296 VanDerWaalsContact C-N 3.3Å; M294-R296 PolarHBondContact O-N 3.23Å; M294-C298 HydrophobicContact CB-CB 4.35Å; M294-C298 HydrophobicContact CE-CB 3.37Å; M294-C298 CarbonylContact O-C 3.1Å; M294-C298 WeakPolarHBondContact O-CA 3.21Å; M294-C298 PolarHBondContact O-N 2.79Å; M294-C298 HydrophobicContact SD-CB 3.82Å; M294-C302 WeakPolarHBondContact CE-SG 3.37Å; M294-F304 HydrophobicContact CB-CE2 3.62Å; M294-F304 HydrophobicContact CB-CZ 4.3Å
295	Q	80.5	Confident	87.5	Confident	60 Å²	60	59.3 Å²	59.3	28%	0.28	30%	0.298	S	S	.	.	H	α-helix	trans	-61.8	-39.9	173.9	-77.6	177.8	-36.8	0	0	111.7	R291 R292 F304	R291-Q295 HydrophobicContact CG-CG 4.15Å; R291-Q295 WeakPolarHBondContact O-CB 3.02Å; R291-Q295 VanDerWaalsContact O-CG 3.29Å; R291-Q295 WeakPolarHBondContact O-CG 3.27Å; R291-Q295 PolarHBondContact O-N 3.23Å; R292-Q295 PolarHBondContact O-N 3.34Å; Q295-F304 HydrophobicContact CB-CD2 4.12Å; Q295-F304 HydrophobicContact CB-CE2 4.27Å; Q295-F304 HydrophobicContact CG-CD1 4.43Å; Q295-F304 HydrophobicContact CG-CD2 3.4Å; Q295-F304 HydrophobicContact CG-CE2 3.49Å; Q295-F304 VanDerWaalsContact CG-CE2 3.49Å; Q295-F304 HydrophobicContact CG-CG 3.9Å; Q295-F304 HydrophobicContact CG-CZ 4.09Å
296	R	80.4	Confident	85.8	Confident	97 Å²	97	66.3 Å²	66.3	37%	0.366	32%	0.317	S	S	.	.	H	α-helix	trans	-69.2	-50.4	177.8	178.6	169.7	-172.2	171	13.6	112.3	D139 R274 R292 L293 M294	D139-R296 VanDerWaalsContact O-CG 3.25Å; D139-R296 WeakPolarHBondContact O-CG 3.44Å; D139-R296 IonicContact OD1-CZ 2.91Å; D139-R296 IonicContact OD1-NE 2.7Å; D139-R296 IonicContact OD1-NH1 3.15Å; D139-R296 PolarHBondContact OD1-NH1 3.46Å; D139-R296 IonicContact OD1-NH2 2.65Å; D139-R296 PolarHBondContact OD1-NH2 3.04Å; R274-R296 PolarHBondContact NE-O 3.41Å; R274-R296 PolarHBondContact NH2-O 2.74Å; R292-R296 WeakPolarHBondContact O-CB 3.39Å; R292-R296 PolarHBondContact O-N 3.3Å; R292-R296 VanDerWaalsContact O-N 3.1Å; L293-R296 PolarHBondContact O-N 3.12Å; M294-R296 VanDerWaalsContact C-N 3.3Å; M294-R296 PolarHBondContact O-N 3.23Å
297	H	87.1	Confident	83.6	Confident	50 Å²	50	69.5 Å²	69.5	23%	0.231	33%	0.333	C	S	.	.	H	α-helix	trans	-107.3	-22.5	-166.8	-64.4	-70.4	0	0	0	114.8	R274 L275 C278 L293 P299	R274-H297 WeakPolarHBondContact CB-O 3.29Å; R274-H297 PolarHBondContact N-O 3.31Å; L275-H297 HydrophobicContact CD1-CB 3.76Å; L275-H297 HydrophobicContact CG-CB 4.1Å; C278-H297 PolarHBondContact SG-O 3.41Å; L293-H297 PolarHBondContact O-CD2 2.98Å; L293-H297 PolarHBondContact O-N 3.42Å; H297-P299 VanDerWaalsContact C-CD 3.47Å
298	C	90.9	Very high	81.4	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	34%	0.335	C	S	.	.			trans	-136.3	46.2	-168.8	-56.6	0	0	0	0	113.2	D273 C278 M294 S300 C302	D273-C298 WeakPolarHBondContact OD1-CA 3.06Å; C278-C298 WeakPolarHBondContact CA-SG 3.15Å; C278-C298 HydrophobicContact CB-CB 3.45Å; C278-C298 VanDerWaalsContact CB-CB 3.45Å; C278-C298 WeakPolarHBondContact CB-SG 3.36Å; C278-C298 WeakPolarHBondContact SG-CA 3.41Å; C278-C298 WeakPolarHBondContact SG-CB 3.47Å; C278-C298 CovalentContact SG-SG 2.01Å; C278-C298 PolarHBondContact SG-SG 2.96Å; M294-C298 HydrophobicContact CB-CB 4.35Å; M294-C298 HydrophobicContact CE-CB 3.37Å; M294-C298 CarbonylContact O-C 3.1Å; M294-C298 WeakPolarHBondContact O-CA 3.21Å; M294-C298 PolarHBondContact O-N 2.79Å; M294-C298 HydrophobicContact SD-CB 3.82Å; C298-S300 VanDerWaalsContact C-N 3.26Å; C298-S300 PolarHBondContact O-N 2.95Å; C298-C302 PolarHBondContact O-N 2.7Å
299	P	87.3	Confident	79.2	Confident	5 Å²	5	66.3 Å²	66.3	3%	0.032	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-27.7	-172.9	30.3	-37.4	0	0	0	113	L272 H297 D303 F304 C305	L272-P299 WeakPolarHBondContact O-CG 3.42Å; H297-P299 VanDerWaalsContact C-CD 3.47Å; P299-D303 PolarHBondContact O-N 2.64Å; P299-F304 HydrophobicContact CB-CB 4.42Å; P299-F304 PolarHBondContact O-N 3.31Å; P299-C305 VanDerWaalsContact C-SG 3.57Å; P299-C305 PolarHBondContact O-SG 2.86Å
300	S	88.8	Confident	76.6	Confident	56 Å²	56	65.4 Å²	65.4	39%	0.392	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-48.3	179.3	-172.7	0	0	0	0	111.5	D273 C298 C302 D303 C305	D273-S300 WeakPolarHBondContact OD1-CA 3.2Å; D273-S300 VanDerWaalsContact OD1-CB 3.3Å; D273-S300 WeakPolarHBondContact OD1-CB 3.33Å; D273-S300 PolarHBondContact OD1-N 2.7Å; C298-S300 VanDerWaalsContact C-N 3.26Å; C298-S300 PolarHBondContact O-N 2.95Å; S300-C302 PolarHBondContact O-N 3.03Å; S300-C302 VanDerWaalsContact O-N 3.12Å; S300-D303 PolarHBondContact O-N 3.26Å; S300-D303 VanDerWaalsContact O-N 3.08Å; S300-C305 VanDerWaalsContact CA-SG 3.59Å
301	S	90.8	Very high	73.9	Confident	37 Å²	37	65.5 Å²	65.5	26%	0.259	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-25.2	177.9	-81.4	0	0	0	0	114.1	D273 C278	D273-S301 PolarHBondContact OD1-N 2.65Å; D273-S301 WeakPolarHBondContact OD2-CB 3.38Å; D273-S301 PolarHBondContact OD2-N 3.02Å; D273-S301 VanDerWaalsContact OD2-N 3.17Å; D273-S301 PolarHBondContact OD2-OG 2.73Å; C278-S301 WeakPolarHBondContact CB-OG 3.41Å
302	C	86.9	Confident	71.6	Confident	14 Å²	14	67.7 Å²	67.7	10%	0.095	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	10.4	179.2	-70.7	0	0	0	0	114.3	C287 M294 C298 S300 F304	C287-C302 WeakPolarHBondContact CA-SG 3.38Å; C287-C302 HydrophobicContact CB-CB 3.69Å; C287-C302 WeakPolarHBondContact CB-SG 3.4Å; C287-C302 WeakPolarHBondContact SG-CA 3.49Å; C287-C302 WeakPolarHBondContact SG-CB 3.46Å; C287-C302 CovalentContact SG-SG 2.03Å; C287-C302 PolarHBondContact SG-SG 2.96Å; M294-C302 WeakPolarHBondContact CE-SG 3.37Å; C298-C302 PolarHBondContact O-N 2.7Å; S300-C302 PolarHBondContact O-N 3.03Å; S300-C302 VanDerWaalsContact O-N 3.12Å; C302-F304 HydrophobicContact CB-CD1 4.25Å; C302-F304 HydrophobicContact CB-CD2 3.62Å; C302-F304 HydrophobicContact CB-CE1 3.98Å; C302-F304 HydrophobicContact CB-CE2 3.32Å; C302-F304 HydrophobicContact CB-CG 4.08Å; C302-F304 HydrophobicContact CB-CZ 3.52Å; C302-F304 PolarHBondContact O-N 3.44Å
303	D	83.1	Confident	69.8	Low	98 Å²	98	62.2 Å²	62.2	52%	0.524	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	21.2	178.1	-154.9	33.4	0	0	0	114.4	P299 S300 C305 Y306	P299-D303 PolarHBondContact O-N 2.64Å; S300-D303 PolarHBondContact O-N 3.26Å; S300-D303 VanDerWaalsContact O-N 3.08Å; D303-C305 PolarHBondContact O-N 2.67Å; D303-C305 VanDerWaalsContact O-N 3.16Å; D303-Y306 PolarHBondContact O-N 3.47Å; D303-Y306 VanDerWaalsContact O-N 3.13Å; D303-Y306 WeakPolarHBondContact OD1-CD2 3.06Å
304	F	78.7	Confident	67.4	Low	13 Å²	13	62.5 Å²	62.5	6%	0.057	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.2	178.5	-63.3	-38.2	0	0	0	112.8	C287 R291 M294 Q295 P299 C302 Y306	C287-F304 HydrophobicContact CB-CZ 4.34Å; R291-F304 HydrophobicContact CG-CE1 4.18Å; R291-F304 HydrophobicContact CG-CZ 3.8Å; M294-F304 HydrophobicContact CB-CE2 3.62Å; M294-F304 HydrophobicContact CB-CZ 4.3Å; Q295-F304 HydrophobicContact CB-CD2 4.12Å; Q295-F304 HydrophobicContact CB-CE2 4.27Å; Q295-F304 HydrophobicContact CG-CD1 4.43Å; Q295-F304 HydrophobicContact CG-CD2 3.4Å; Q295-F304 HydrophobicContact CG-CE2 3.49Å; Q295-F304 VanDerWaalsContact CG-CE2 3.49Å; Q295-F304 HydrophobicContact CG-CG 3.9Å; Q295-F304 HydrophobicContact CG-CZ 4.09Å; P299-F304 HydrophobicContact CB-CB 4.42Å; P299-F304 PolarHBondContact O-N 3.31Å; C302-F304 HydrophobicContact CB-CD1 4.25Å; C302-F304 HydrophobicContact CB-CD2 3.62Å; C302-F304 HydrophobicContact CB-CE1 3.98Å; C302-F304 HydrophobicContact CB-CE2 3.32Å; C302-F304 HydrophobicContact CB-CG 4.08Å; C302-F304 HydrophobicContact CB-CZ 3.52Å; C302-F304 PolarHBondContact O-N 3.44Å; F304-Y306 PolarHBondContact O-N 3.14Å
305	C	73.4	Confident	65.3	Low	17 Å²	17	68 Å²	68	12%	0.115	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-27.5	174.2	-40.8	0	0	0	0	112.7	C271 P299 S300 D303	C271-C305 HydrophobicContact CB-CB 3.47Å; C271-C305 VanDerWaalsContact CB-CB 3.47Å; C271-C305 WeakPolarHBondContact CB-SG 3.21Å; C271-C305 WeakPolarHBondContact SG-CB 3.45Å; C271-C305 CovalentContact SG-SG 1.99Å; C271-C305 PolarHBondContact SG-SG 2.64Å; P299-C305 VanDerWaalsContact C-SG 3.57Å; P299-C305 PolarHBondContact O-SG 2.86Å; S300-C305 VanDerWaalsContact CA-SG 3.59Å; D303-C305 PolarHBondContact O-N 2.67Å; D303-C305 VanDerWaalsContact O-N 3.16Å
306	Y	59.3	Low	63.9	Low	179 Å²	179	68.8 Å²	68.8	70%	0.702	38%	0.383	S	S	*	.	S	Bend	trans	-120.9	6.1	-164.4	-61.6	-79.7	0	0	0	114.8	D303 F304 F308	D303-Y306 PolarHBondContact O-N 3.47Å; D303-Y306 VanDerWaalsContact O-N 3.13Å; D303-Y306 WeakPolarHBondContact OD1-CD2 3.06Å; F304-Y306 PolarHBondContact O-N 3.14Å; Y306-F308 PolarHBondContact O-N 2.96Å
307	E	50.1	Low	62.5	Low	121 Å²	121	69.3 Å²	69.3	57%	0.565	40%	0.399	S	S	*	.			trans	-70.8	53.2	163.9	-96.4	-170.9	156.8	0	0	111	W263 R291	W263-E307 WeakPolarHBondContact CZ2-O 3.49Å; R291-E307 IonicContact CZ-OE2 3.77Å; R291-E307 IonicContact NH1-OE2 3.77Å; R291-E307 IonicContact NH2-OE2 2.82Å; R291-E307 PolarHBondContact NH2-OE2 3.26Å
308	F	44	Very low	61	Low	40 Å²	40	71.7 Å²	71.7	18%	0.175	42%	0.417	C	S	.	.	S	Bend	trans	-139	135.2	164	-146.7	-120.2	0	0	0	112.7	W263 Y306 F310	W263-F308 HydrophobicContact CD2-CB 4.19Å; W263-F308 AromaticContact CD2-CD2 3.82Å; W263-F308 HydrophobicContact CD2-CD2 3.82Å; W263-F308 HydrophobicContact CD2-CE2 4.23Å; W263-F308 AromaticContact CD2-CG 3.98Å; W263-F308 HydrophobicContact CD2-CG 3.98Å; W263-F308 AromaticContact CE2-CD2 3.68Å; W263-F308 HydrophobicContact CE3-CD1 4.34Å; W263-F308 AromaticContact CE3-CD2 3.48Å; W263-F308 HydrophobicContact CE3-CD2 3.48Å; W263-F308 VanDerWaalsContact CE3-CD2 3.48Å; W263-F308 HydrophobicContact CE3-CE1 4.24Å; W263-F308 AromaticContact CE3-CE2 3.41Å; W263-F308 HydrophobicContact CE3-CE2 3.41Å; W263-F308 VanDerWaalsContact CE3-CE2 3.41Å; W263-F308 AromaticContact CE3-CG 3.91Å; W263-F308 HydrophobicContact CE3-CG 3.91Å; W263-F308 AromaticContact CE3-CZ 3.72Å; W263-F308 HydrophobicContact CE3-CZ 3.72Å; W263-F308 AromaticContact CH2-CD2 3.02Å; W263-F308 HydrophobicContact CH2-CD2 3.02Å; W263-F308 AromaticContact CH2-CE2 3.1Å; W263-F308 HydrophobicContact CH2-CE2 3.1Å; W263-F308 HydrophobicContact CH2-CG 4.11Å; W263-F308 HydrophobicContact CH2-CZ 4.18Å; W263-F308 HydrophobicContact CZ2-CB 4.15Å; W263-F308 AromaticContact CZ2-CD2 3.26Å; W263-F308 HydrophobicContact CZ2-CD2 3.26Å; W263-F308 AromaticContact CZ2-CE2 3.86Å; W263-F308 HydrophobicContact CZ2-CE2 3.86Å; W263-F308 HydrophobicContact CZ2-CG 4.04Å; W263-F308 AromaticContact CZ3-CD2 3.16Å; W263-F308 HydrophobicContact CZ3-CD2 3.16Å; W263-F308 HydrophobicContact CZ3-CE1 4.41Å; W263-F308 AromaticContact CZ3-CE2 2.84Å; W263-F308 HydrophobicContact CZ3-CE2 2.84Å; W263-F308 HydrophobicContact CZ3-CG 4.06Å; W263-F308 AromaticContact CZ3-CZ 3.5Å; W263-F308 HydrophobicContact CZ3-CZ 3.5Å; Y306-F308 PolarHBondContact O-N 2.96Å; F308-F310 VanDerWaalsContact C-N 3.34Å; F308-F310 AromaticContact CD1-CD2 3.77Å; F308-F310 HydrophobicContact CD1-CD2 3.77Å; F308-F310 HydrophobicContact CD1-CE1 4.41Å; F308-F310 AromaticContact CD1-CE2 3.34Å; F308-F310 HydrophobicContact CD1-CE2 3.34Å; F308-F310 AromaticContact CD1-CZ 3.69Å; F308-F310 HydrophobicContact CD1-CZ 3.69Å; F308-F310 HydrophobicContact CE1-CD2 4.31Å; F308-F310 HydrophobicContact CE1-CE1 4.2Å; F308-F310 AromaticContact CE1-CE2 3.45Å; F308-F310 HydrophobicContact CE1-CE2 3.45Å; F308-F310 VanDerWaalsContact CE1-CE2 3.45Å; F308-F310 AromaticContact CE1-CZ 3.37Å; F308-F310 HydrophobicContact CE1-CZ 3.37Å; F308-F310 PolarHBondContact O-N 3.38Å
309	P	44.9	Very low	59.5	Low	47 Å²	47	72.2 Å²	72.2	31%	0.305	42%	0.421	S	S	.	.			trans	-85	82	-175.1	34.7	-27.4	0	0	0	108.1
310	F	42	Very low	58.1	Low	66 Å²	66	78.6 Å²	78.6	29%	0.289	46%	0.462	S	S	.	.			trans	-112.3	123.8	149.8	-64.4	-49.7	0	0	0	108.6	K93 F308 T312	K93-F310 HydrophobicContact CB-CD1 4.49Å; K93-F310 HydrophobicContact CB-CE1 3.7Å; K93-F310 HydrophobicContact CB-CZ 3.72Å; K93-F310 HydrophobicContact CD-CD1 3.58Å; K93-F310 HydrophobicContact CD-CD2 4.33Å; K93-F310 HydrophobicContact CD-CE1 3.67Å; K93-F310 HydrophobicContact CD-CE2 4.34Å; K93-F310 HydrophobicContact CD-CG 3.96Å; K93-F310 HydrophobicContact CD-CZ 4.04Å; K93-F310 HydrophobicContact CG-CD1 3.64Å; K93-F310 HydrophobicContact CG-CE1 3.28Å; K93-F310 HydrophobicContact CG-CG 4.48Å; K93-F310 HydrophobicContact CG-CZ 3.79Å; F308-F310 VanDerWaalsContact C-N 3.34Å; F308-F310 AromaticContact CD1-CD2 3.77Å; F308-F310 HydrophobicContact CD1-CD2 3.77Å; F308-F310 HydrophobicContact CD1-CE1 4.41Å; F308-F310 AromaticContact CD1-CE2 3.34Å; F308-F310 HydrophobicContact CD1-CE2 3.34Å; F308-F310 AromaticContact CD1-CZ 3.69Å; F308-F310 HydrophobicContact CD1-CZ 3.69Å; F308-F310 HydrophobicContact CE1-CD2 4.31Å; F308-F310 HydrophobicContact CE1-CE1 4.2Å; F308-F310 AromaticContact CE1-CE2 3.45Å; F308-F310 HydrophobicContact CE1-CE2 3.45Å; F308-F310 VanDerWaalsContact CE1-CE2 3.45Å; F308-F310 AromaticContact CE1-CZ 3.37Å; F308-F310 HydrophobicContact CE1-CZ 3.37Å; F308-F310 PolarHBondContact O-N 3.38Å; F310-T312 PolarHBondContact O-N 3.07Å
311	P	35.7	Very low	57.1	Low	95 Å²	95	86.9 Å²	86.9	62%	0.617	48%	0.484	S	S	*	.			trans	-55.3	118.8	151.8	24	-28.6	0	0	0	105.7	V313	P311-V313 HydrophobicContact CB-CG2 4.25Å; P311-V313 HydrophobicContact CG-CG2 4.29Å; P311-V313 PolarHBondContact O-N 3.05Å
312	T	38.8	Very low	56.7	Low	141 Å²	141	86.5 Å²	86.5	87%	0.865	48%	0.481	S	S	*	.			trans	-59.8	75.8	157.3	-10.2	0	0	0	0	105.7	F310 A314	F310-T312 PolarHBondContact O-N 3.07Å; T312-A314 PolarHBondContact O-N 3.17Å
313	V	45.2	Very low	56.7	Low	104 Å²	104	92.5 Å²	92.5	63%	0.63	51%	0.505	S	S	*	.			trans	-61.3	114.6	163.9	-177.2	0	0	0	0	103.2	P311	P311-V313 HydrophobicContact CB-CG2 4.25Å; P311-V313 HydrophobicContact CG-CG2 4.29Å; P311-V313 PolarHBondContact O-N 3.05Å
314	A	38.8	Very low	56.9	Low	73 Å²	73	94 Å²	94	60%	0.603	51%	0.509	S	S	*	.			trans	-45.4	134.8	177.7	0	0	0	0	0	108.5	T312 T316	T312-A314 PolarHBondContact O-N 3.17Å; A314-T316 PolarHBondContact O-N 3.11Å
315	P	44.8	Very low	57.2	Low	114 Å²	114	97.1 Å²	97.1	74%	0.74	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-49.5	118.1	177.9	18	-29	0	0	0	107.4	P317	P315-P317 WeakPolarHBondContact O-CD 3.1Å; P315-P317 VanDerWaalsContact O-N 3.15Å
316	T	51	Low	57.9	Low	77 Å²	77	102.2 Å²	102.2	47%	0.472	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-59.6	124.9	179.5	-60	0	0	0	0	106	A314 T318	A314-T316 PolarHBondContact O-N 3.11Å; T316-T318 PolarHBondContact O-N 2.86Å
317	P	51.4	Low	59.3	Low	109 Å²	109	94.3 Å²	94.3	71%	0.708	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-52.7	133.7	-176.7	16.1	-28.4	0	0	0	109.6	P315 P319	P315-P317 WeakPolarHBondContact O-CD 3.1Å; P315-P317 VanDerWaalsContact O-N 3.15Å; P317-P319 WeakPolarHBondContact O-CD 3.31Å
318	T	54.8	Low	60.9	Low	100 Å²	100	91.7 Å²	91.7	61%	0.613	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-55.3	123.2	-177.5	-18.2	0	0	0	0	107.9	T316 T383	T316-T318 PolarHBondContact O-N 2.86Å; T318-T383 HydrophobicContact CG2-CG2 4.17Å
319	P	58.8	Low	62.4	Low	11 Å²	11	93.7 Å²	93.7	7%	0.071	52%	0.521	C	S	.	.	P	Polyproline II helix	trans	-59.5	144.4	-175	-26.6	35.5	0	0	0	111.5	P317 R321 T322 T385 N397 S399	P317-P319 WeakPolarHBondContact O-CD 3.31Å; P319-R321 PolarHBondContact O-N 3.33Å; P319-T322 PolarHBondContact O-N 2.93Å; P319-T322 PolarHBondContact O-OG1 3.32Å; P319-T385 HydrophobicContact CG-CG2 4.47Å; P319-N397 HydrophobicContact CG-CB 4.38Å; P319-S399 WeakPolarHBondContact CD-OG 3.34Å; P319-S399 VanDerWaalsContact CG-OG 3.26Å; P319-S399 WeakPolarHBondContact CG-OG 3.4Å
320	P	59	Low	63.7	Low	139 Å²	139	92.7 Å²	92.7	90%	0.903	52%	0.518	S	S	*	.	S	Bend	trans	-62.3	-12.8	-176.7	20.8	-30.9	0	0	0	114.2
321	R	67.1	Low	65.8	Low	229 Å²	229	95.3 Å²	95.3	86%	0.864	53%	0.53	S	S	*	.			trans	-114.6	69.8	174.1	-75.1	-178.1	173.2	168.7	-1.6	111.2	P319	P319-R321 PolarHBondContact O-N 3.33Å
322	T	82	Confident	68.3	Low	30 Å²	30	96.7 Å²	96.7	18%	0.184	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	121.6	171.1	-61.6	0	0	0	0	109.9	P319 H324 T383 S399 R401	P319-T322 PolarHBondContact O-N 2.93Å; P319-T322 PolarHBondContact O-OG1 3.32Å; T322-H324 PolarHBondContact O-CD2 3.26Å; T322-T383 HydrophobicContact CG2-CG2 4.46Å; T322-S399 WeakPolarHBondContact CA-O 3.47Å; T322-S399 WeakPolarHBondContact OG1-CB 3.39Å; T322-R401 HydrophobicContact CG2-CB 3.78Å
323	K	87.3	Confident	70.7	Confident	140 Å²	140	90.7 Å²	90.7	61%	0.609	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	122.8	176.5	-70.5	-173.2	178.2	-173.5	0	110	S399 W400 R401	K323-S399 PolarHBondContact N-O 3.29Å; K323-W400 CarbonylContact O-C 3.5Å; K323-W400 VanDerWaalsContact O-CA 3.25Å; K323-W400 WeakPolarHBondContact O-CA 3.39Å; K323-R401 PolarHBondContact O-N 3.27Å
324	H	87.1	Confident	72.9	Confident	128 Å²	128	89.1 Å²	89.1	59%	0.593	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	134.6	175.1	-67.5	-107.5	0	0	0	110.5	T322 R401	T322-H324 PolarHBondContact O-CD2 3.26Å; H324-R401 CarbonylContact C-O 3.53Å; H324-R401 WeakPolarHBondContact CA-O 3.32Å
325	K	86.2	Confident	75.3	Confident	79 Å²	79	85.9 Å²	85.9	34%	0.343	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	106.1	176.7	-75	-178.7	170.2	-73.9	0	108.6	V327 F335 R401 V402 R403	K325-V327 HydrophobicContact CB-CG2 3.94Å; K325-F335 HydrophobicContact CD-CD1 4.38Å; K325-F335 HydrophobicContact CD-CE1 3.41Å; K325-F335 VanDerWaalsContact CD-CE1 3.41Å; K325-F335 HydrophobicContact CD-CZ 4.03Å; K325-R401 PolarHBondContact N-O 2.84Å; K325-V402 WeakPolarHBondContact O-CA 3.39Å; K325-R403 PolarHBondContact O-N 3.38Å
326	L	88.1	Confident	77.4	Confident	125 Å²	125	86.9 Å²	86.9	65%	0.654	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	123.7	165.3	-174	64.9	0	0	0	108	R403 R405	L326-R403 WeakPolarHBondContact CA-O 3.41Å; L326-R403 HydrophobicContact CD1-CB 3.92Å; L326-R405 HydrophobicContact CD1-CB 4.13Å; L326-R405 HydrophobicContact CG-CB 4.35Å
327	V	87.4	Confident	79	Confident	12 Å²	12	83.2 Å²	83.2	7%	0.073	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	138.7	-168.9	-167.9	0	0	0	0	109.4	K325 K331 L333 A376 R403 V404 R405	K325-V327 HydrophobicContact CB-CG2 3.94Å; V327-K331 HydrophobicContact CG1-CB 3.69Å; V327-K331 HydrophobicContact CG1-CD 3.75Å; V327-K331 HydrophobicContact CG1-CG 3.94Å; V327-L333 HydrophobicContact CB-CD1 4.17Å; V327-L333 HydrophobicContact CB-CD2 4.48Å; V327-L333 HydrophobicContact CG1-CD1 4.1Å; V327-L333 HydrophobicContact CG1-CD2 3.82Å; V327-L333 HydrophobicContact CG1-CG 4.15Å; V327-L333 HydrophobicContact CG2-CD1 3.7Å; V327-L333 HydrophobicContact CG2-CD2 3.87Å; V327-L333 HydrophobicContact CG2-CG 4.34Å; V327-A376 HydrophobicContact CB-CB 4.11Å; V327-A376 HydrophobicContact CG1-CB 3.85Å; V327-R403 PolarHBondContact N-O 3Å; V327-V404 CarbonylContact O-C 3.51Å; V327-V404 VanDerWaalsContact O-CA 3.31Å; V327-V404 WeakPolarHBondContact O-CA 3.46Å; V327-R405 PolarHBondContact O-N 3.19Å
328	T	83.9	Confident	79.9	Confident	66 Å²	66	78.5 Å²	78.5	41%	0.405	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	144.3	172.6	51.7	0	0	0	0	111	K331 A376	T328-K331 WeakPolarHBondContact O-CB 3.39Å; T328-K331 PolarHBondContact O-N 2.92Å; T328-A376 WeakPolarHBondContact O-CB 3.1Å
329	E	76.9	Confident	80.5	Confident	83 Å²	83	79.2 Å²	79.2	39%	0.388	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	147.5	175.2	-171.9	166.6	-137.7	0	0	112.5	L173 K331 A376 V404 R405 F406	L173-E329 HydrophobicContact CD1-CG 3.99Å; L173-E329 WeakPolarHBondContact CD1-OE1 3.49Å; E329-K331 PolarHBondContact O-N 3.03Å; E329-A376 CarbonylContact C-O 3.49Å; E329-A376 WeakPolarHBondContact CA-O 3.32Å; E329-V404 HydrophobicContact CB-CG1 3.84Å; E329-V404 HydrophobicContact CG-CG1 4.4Å; E329-R405 PolarHBondContact N-O 3.49Å; E329-F406 WeakPolarHBondContact OE1-CE1 3.31Å
330	G	72.1	Confident	80.7	Confident	25 Å²	25	87.2 Å²	87.2	26%	0.258	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	-12.8	-178	0	0	0	0	0	115.4	K332 A376	G330-K332 PolarHBondContact O-N 3.25Å; G330-A376 PolarHBondContact N-O 2.86Å
331	K	85.6	Confident	80.9	Confident	121 Å²	121	83.2 Å²	83.2	53%	0.526	39%	0.388	S	S	.	.			trans	-74.4	128.9	-175.6	-174.1	164.3	178.7	175.1	0	112.5	V327 T328 E329 A376	V327-K331 HydrophobicContact CG1-CB 3.69Å; V327-K331 HydrophobicContact CG1-CD 3.75Å; V327-K331 HydrophobicContact CG1-CG 3.94Å; T328-K331 WeakPolarHBondContact O-CB 3.39Å; T328-K331 PolarHBondContact O-N 2.92Å; E329-K331 PolarHBondContact O-N 3.03Å; K331-A376 HydrophobicContact CB-CB 4.44Å; K331-A376 VanDerWaalsContact O-CB 3.28Å; K331-A376 WeakPolarHBondContact O-CB 3.27Å; K331-A376 PolarHBondContact O-N 3.05Å
332	K	88.1	Confident	80.5	Confident	124 Å²	124	73.4 Å²	73.4	54%	0.539	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	129.1	174.5	-62.3	-172.9	-179.4	178.7	0	111.4	Y172 G330 I374 V375	Y172-K332 VanDerWaalsContact OH-CE 3.24Å; Y172-K332 WeakPolarHBondContact OH-CE 3.04Å; Y172-K332 PolarHBondContact OH-NZ 3.27Å; G330-K332 PolarHBondContact O-N 3.25Å; K332-I374 CarbonylContact C-O 3.54Å; K332-I374 WeakPolarHBondContact CA-O 3.45Å; K332-V375 HydrophobicContact CG-CG2 4.22Å
333	L	89.4	Confident	79.5	Confident	16 Å²	16	76.3 Å²	76.3	8%	0.084	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.2	179.1	-62.5	169.9	0	0	0	109.7	V327 F335 T373 I374 A376 V402	V327-L333 HydrophobicContact CB-CD1 4.17Å; V327-L333 HydrophobicContact CB-CD2 4.48Å; V327-L333 HydrophobicContact CG1-CD1 4.1Å; V327-L333 HydrophobicContact CG1-CD2 3.82Å; V327-L333 HydrophobicContact CG1-CG 4.15Å; V327-L333 HydrophobicContact CG2-CD1 3.7Å; V327-L333 HydrophobicContact CG2-CD2 3.87Å; V327-L333 HydrophobicContact CG2-CG 4.34Å; L333-F335 HydrophobicContact CB-CE1 4.12Å; L333-F335 HydrophobicContact CB-CZ 3.89Å; L333-F335 HydrophobicContact CD1-CZ 4.09Å; L333-T373 CarbonylContact O-C 3.54Å; L333-T373 WeakPolarHBondContact O-CA 3.37Å; L333-I374 HydrophobicContact CB-CD1 4.46Å; L333-I374 HydrophobicContact CB-CG1 3.81Å; L333-I374 HydrophobicContact CD1-CD1 4.14Å; L333-I374 HydrophobicContact CD1-CG1 4.22Å; L333-I374 PolarHBondContact N-O 3.41Å; L333-I374 PolarHBondContact O-N 2.92Å; L333-A376 HydrophobicContact CD1-CB 4.25Å; L333-V402 HydrophobicContact CD1-CG1 3.79Å; L333-V402 HydrophobicContact CD1-CG2 4.42Å
334	T	90.9	Very high	78.3	Confident	71 Å²	71	77.6 Å²	77.6	44%	0.436	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.3	173.9	-58.5	0	0	0	0	110.3	R336 H371 I372 T373	T334-R336 HydrophobicContact CG2-CG 4.44Å; T334-H371 HydrophobicContact CG2-CB 4.03Å; T334-I372 CarbonylContact C-O 3.51Å; T334-I372 VanDerWaalsContact CA-O 3.3Å; T334-I372 WeakPolarHBondContact CA-O 3.33Å; T334-T373 PolarHBondContact OG1-OG1 2.75Å; T334-T373 VanDerWaalsContact OG1-OG1 3.07Å
335	F	90.3	Very high	77.3	Confident	5 Å²	5	81.3 Å²	81.3	2%	0.022	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.2	172	-48	-49.5	0	0	0	109.4	K325 L333 W350 H371 I372 I374 Y384 W400 V402	K325-F335 HydrophobicContact CD-CD1 4.38Å; K325-F335 HydrophobicContact CD-CE1 3.41Å; K325-F335 VanDerWaalsContact CD-CE1 3.41Å; K325-F335 HydrophobicContact CD-CZ 4.03Å; L333-F335 HydrophobicContact CB-CE1 4.12Å; L333-F335 HydrophobicContact CB-CZ 3.89Å; L333-F335 HydrophobicContact CD1-CZ 4.09Å; F335-W350 HydrophobicContact CB-CH2 3.83Å; F335-W350 HydrophobicContact CB-CZ3 4.1Å; F335-W350 WeakPolarHBondContact O-CH2 3.43Å; F335-H371 CarbonylContact O-C 3.54Å; F335-H371 WeakPolarHBondContact O-CA 3.5Å; F335-H371 VanDerWaalsContact O-CB 3.24Å; F335-H371 WeakPolarHBondContact O-CB 3.47Å; F335-I372 HydrophobicContact CB-CG2 3.79Å; F335-I372 HydrophobicContact CD2-CG2 3.77Å; F335-I372 HydrophobicContact CG-CG2 4.26Å; F335-I372 PolarHBondContact N-O 3.2Å; F335-I372 PolarHBondContact O-N 3.31Å; F335-I374 HydrophobicContact CE2-CD1 3.64Å; F335-I374 HydrophobicContact CE2-CG1 4.1Å; F335-I374 HydrophobicContact CZ-CD1 4.03Å; F335-I374 HydrophobicContact CZ-CG1 4.47Å; F335-Y384 HydrophobicContact CD2-CG 4.42Å; F335-Y384 HydrophobicContact CE2-CD2 4.11Å; F335-Y384 HydrophobicContact CE2-CG 4.19Å; F335-W400 HydrophobicContact CB-CD2 4.12Å; F335-W400 HydrophobicContact CB-CE3 4.14Å; F335-W400 HydrophobicContact CB-CH2 4.25Å; F335-W400 HydrophobicContact CB-CZ2 4.24Å; F335-W400 HydrophobicContact CB-CZ3 4.21Å; F335-W400 HydrophobicContact CD1-CB 4.48Å; F335-W400 AromaticContact CD1-CD1 3.96Å; F335-W400 HydrophobicContact CD1-CD2 4.18Å; F335-W400 AromaticContact CD1-CG 3.97Å; F335-W400 HydrophobicContact CD1-CG 3.97Å; F335-W400 HydrophobicContact CE1-CB 4.41Å; F335-W400 HydrophobicContact CE1-CG 4.29Å; F335-W400 HydrophobicContact CG-CD2 4.04Å; F335-W400 HydrophobicContact CG-CE3 4.31Å; F335-W400 HydrophobicContact CG-CG 4.19Å; F335-W400 HydrophobicContact CZ-CB 4.42Å; F335-V402 HydrophobicContact CE2-CG2 3.85Å; F335-V402 HydrophobicContact CZ-CG2 3.49Å; F335-V402 VanDerWaalsContact CZ-CG2 3.49Å
336	R	87.8	Confident	76.7	Confident	134 Å²	134	78 Å²	78	51%	0.506	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	134.9	177.1	-61.8	-175	178.5	-95.9	4.5	109.1	T334 K339 D370 H371	T334-R336 HydrophobicContact CG2-CG 4.44Å; R336-K339 VanDerWaalsContact NH1-NZ 3.17Å; R336-D370 IonicContact NH1-OD2 2.65Å; R336-H371 HydrophobicContact CB-CB 4.46Å; R336-H371 HydrophobicContact CG-CB 3.94Å
337	C	84.6	Confident	76.4	Confident	0 Å²	0	77 Å²	77	0%	0	38%	0.376	C	S	.	.			trans	-107.5	118.5	178.5	-172.3	0	0	0	0	111.9	K339 I348 W350 D370 C386	C337-K339 VanDerWaalsContact C-N 3.29Å; C337-K339 PolarHBondContact O-N 3.45Å; C337-I348 HydrophobicContact CB-CG2 4.32Å; C337-W350 HydrophobicContact CB-CH2 3.82Å; C337-W350 HydrophobicContact CB-CZ2 3.48Å; C337-W350 VanDerWaalsContact CB-CZ2 3.48Å; C337-D370 PolarHBondContact N-O 2.75Å; C337-C386 HydrophobicContact CB-CB 3.51Å; C337-C386 WeakPolarHBondContact CB-SG 3.4Å; C337-C386 WeakPolarHBondContact SG-CB 3.5Å; C337-C386 CovalentContact SG-SG 1.98Å; C337-C386 PolarHBondContact SG-SG 3.34Å
338	G	70.4	Confident	76.3	Confident	10 Å²	10	78.2 Å²	78.2	10%	0.103	38%	0.381	C	S	.	.			trans	50.2	37.3	157.1	0	0	0	0	0	116.8	K340 I341 A342	G338-K340 PolarHBondContact O-N 3Å; G338-I341 WeakPolarHBondContact O-CA 3.4Å; G338-I341 PolarHBondContact O-N 3.45Å; G338-A342 PolarHBondContact O-N 2.78Å
339	K	67.1	Low	76.3	Confident	115 Å²	115	79 Å²	79	50%	0.5	38%	0.378	S	S	.	.	H	α-helix	trans	-44.3	-39.8	-175.8	-98.4	-171.2	170.1	-171.7	0	114.8	R336 C337 S343 D370	R336-K339 VanDerWaalsContact NH1-NZ 3.17Å; C337-K339 VanDerWaalsContact C-N 3.29Å; C337-K339 PolarHBondContact O-N 3.45Å; K339-S343 WeakPolarHBondContact O-CB 3.49Å; K339-S343 PolarHBondContact O-N 2.94Å; K339-S343 PolarHBondContact O-OG 2.82Å; K339-D370 WeakPolarHBondContact CE-OD2 3.45Å; K339-D370 IonicContact NZ-OD2 3.88Å
340	K	63.6	Low	76.6	Confident	179 Å²	179	75.5 Å²	75.5	78%	0.778	36%	0.361	S	S	*	.	H	α-helix	trans	-78.6	-18.7	-180	-66.1	-174	178.3	-177.1	0	114.5	G338 S343 K344	G338-K340 PolarHBondContact O-N 3Å; K340-S343 PolarHBondContact O-OG 2.93Å; K340-K344 WeakPolarHBondContact O-CG 3.24Å
341	I	62.5	Low	77	Confident	56 Å²	56	76 Å²	76	29%	0.287	36%	0.355	S	S	.	.	H	α-helix	trans	-100.8	-41.1	-175.7	-60.8	168.2	0	0	0	109.7	G338 S343 K344 V388 L395 T396	G338-I341 WeakPolarHBondContact O-CA 3.4Å; G338-I341 PolarHBondContact O-N 3.45Å; I341-S343 VanDerWaalsContact C-N 3.35Å; I341-K344 PolarHBondContact O-N 3.05Å; I341-K344 VanDerWaalsContact O-N 3.12Å; I341-V388 HydrophobicContact CG2-CG1 4.26Å; I341-L395 HydrophobicContact CG2-CB 4.09Å; I341-L395 HydrophobicContact CG2-CD1 4.17Å; I341-T396 HydrophobicContact CD1-CG2 3.76Å; I341-T396 HydrophobicContact CG2-CG2 4.22Å
342	A	58.6	Low	76.6	Confident	23 Å²	23	70.7 Å²	70.7	19%	0.19	33%	0.332	C	S	.	.	H	α-helix	trans	-60.7	-42.9	173.2	0	0	0	0	0	111.8	G338 K344 R345 G346 I348	G338-A342 PolarHBondContact O-N 2.78Å; A342-K344 PolarHBondContact O-N 2.75Å; A342-R345 PolarHBondContact O-N 3.34Å; A342-R345 VanDerWaalsContact O-N 3.1Å; A342-G346 PolarHBondContact O-N 2.85Å; A342-I348 HydrophobicContact CB-CD1 3.52Å; A342-I348 HydrophobicContact CB-CG1 3.97Å
343	S	61	Low	75.7	Confident	91 Å²	91	68.7 Å²	68.7	64%	0.636	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-17.7	175.6	64.7	0	0	0	0	114.1	K339 K340 I341	K339-S343 WeakPolarHBondContact O-CB 3.49Å; K339-S343 PolarHBondContact O-N 2.94Å; K339-S343 PolarHBondContact O-OG 2.82Å; K340-S343 PolarHBondContact O-OG 2.93Å; I341-S343 VanDerWaalsContact C-N 3.35Å
344	K	63	Low	74.6	Confident	167 Å²	167	70 Å²	70	73%	0.726	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	13.9	178.5	-68.1	-173.2	176.9	-171.3	0	114.1	K340 I341 A342	K340-K344 WeakPolarHBondContact O-CG 3.24Å; I341-K344 PolarHBondContact O-N 3.05Å; I341-K344 VanDerWaalsContact O-N 3.12Å; A342-K344 PolarHBondContact O-N 2.75Å
345	R	65.4	Low	73.4	Confident	205 Å²	205	69 Å²	69	77%	0.774	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.1	46.8	175.5	-50.6	174.8	-179.5	-173	1.3	116.5	A342 K390	A342-R345 PolarHBondContact O-N 3.34Å; A342-R345 VanDerWaalsContact O-N 3.1Å; R345-K390 WeakPolarHBondContact O-CD 3.48Å
346	G	73.6	Confident	72.6	Confident	10 Å²	10	71 Å²	71	10%	0.103	35%	0.346	C	S	.	.			trans	-117.1	139.2	170.4	0	0	0	0	0	111.9	A342 K389	A342-G346 PolarHBondContact O-N 2.85Å; G346-K389 CarbonylContact C-O 3.54Å; G346-K389 WeakPolarHBondContact CA-O 3.28Å
347	N	81.5	Confident	71.8	Confident	104 Å²	104	65.3 Å²	65.3	56%	0.556	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.3	132.3	172.9	-67.9	-4.9	0	0	0	109.1	Y349 V388 K389	N347-Y349 HydrophobicContact CB-CD2 4.48Å; N347-Y349 HydrophobicContact CB-CE2 3.59Å; N347-Y349 WeakPolarHBondContact O-CD2 3.39Å; N347-V388 CarbonylContact O-C 3.5Å; N347-V388 WeakPolarHBondContact O-CA 3.44Å; N347-K389 PolarHBondContact N-O 2.89Å; N347-K389 PolarHBondContact O-N 3.16Å
348	I	85.1	Confident	70.8	Confident	38 Å²	38	68 Å²	68	20%	0.195	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	131.1	178.7	-68.4	169.5	0	0	0	108.8	C337 A342 D369 V388	C337-I348 HydrophobicContact CB-CG2 4.32Å; A342-I348 HydrophobicContact CB-CD1 3.52Å; A342-I348 HydrophobicContact CB-CG1 3.97Å; I348-D369 WeakPolarHBondContact CB-O 3.35Å; I348-D369 WeakPolarHBondContact CD1-O 3.4Å; I348-V388 HydrophobicContact CG1-CG2 4.18Å
349	Y	84.7	Confident	70.3	Confident	83 Å²	83	70.5 Å²	70.5	33%	0.325	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	130.1	172.8	-59.1	-86.8	0	0	0	108.8	N347 L356 C386 I387 K389	N347-Y349 HydrophobicContact CB-CD2 4.48Å; N347-Y349 HydrophobicContact CB-CE2 3.59Å; N347-Y349 WeakPolarHBondContact O-CD2 3.39Å; Y349-L356 HydrophobicContact CD1-CD1 4.1Å; Y349-L356 HydrophobicContact CG-CD1 4.47Å; Y349-C386 CarbonylContact O-C 3.38Å; Y349-C386 WeakPolarHBondContact O-CA 3.4Å; Y349-I387 PolarHBondContact N-O 2.79Å; Y349-I387 PolarHBondContact O-N 2.95Å; Y349-K389 HydrophobicContact CD2-CB 4.27Å; Y349-K389 HydrophobicContact CD2-CD 4.15Å; Y349-K389 HydrophobicContact CD2-CG 4.06Å; Y349-K389 HydrophobicContact CE2-CB 3.92Å; Y349-K389 HydrophobicContact CE2-CD 4.14Å; Y349-K389 HydrophobicContact CE2-CG 4.15Å
350	W	83.3	Confident	70.1	Confident	8 Å²	8	67.7 Å²	67.7	3%	0.03	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	141.9	177.2	-74.6	100.5	0	0	0	110.1	F335 C337 L356 L357 L367 I372 T385 C386 W400	F335-W350 HydrophobicContact CB-CH2 3.83Å; F335-W350 HydrophobicContact CB-CZ3 4.1Å; F335-W350 WeakPolarHBondContact O-CH2 3.43Å; C337-W350 HydrophobicContact CB-CH2 3.82Å; C337-W350 HydrophobicContact CB-CZ2 3.48Å; C337-W350 VanDerWaalsContact CB-CZ2 3.48Å; W350-L356 WeakPolarHBondContact O-CD1 2.86Å; W350-L357 HydrophobicContact CB-CB 4.1Å; W350-L357 HydrophobicContact CB-CD1 4.27Å; W350-L357 PolarHBondContact O-N 3.24Å; W350-L367 HydrophobicContact CB-CD2 3.8Å; W350-L367 HydrophobicContact CG-CD2 4.06Å; W350-I372 HydrophobicContact CD2-CB 4.06Å; W350-I372 HydrophobicContact CD2-CG2 3.95Å; W350-I372 HydrophobicContact CE3-CB 4.23Å; W350-I372 HydrophobicContact CE3-CG2 3.62Å; W350-I372 HydrophobicContact CH2-CB 4.4Å; W350-I372 HydrophobicContact CH2-CG2 3.55Å; W350-I372 HydrophobicContact CZ2-CB 4.24Å; W350-I372 HydrophobicContact CZ2-CG2 3.88Å; W350-I372 HydrophobicContact CZ3-CB 4.38Å; W350-I372 HydrophobicContact CZ3-CG2 3.4Å; W350-I372 VanDerWaalsContact CZ3-CG2 3.4Å; W350-T385 CarbonylContact C-O 3.47Å; W350-C386 HydrophobicContact CD2-CB 4.17Å; W350-C386 HydrophobicContact CE3-CB 3.81Å; W350-C386 HydrophobicContact CH2-CB 3.83Å; W350-C386 HydrophobicContact CZ2-CB 4.18Å; W350-C386 HydrophobicContact CZ3-CB 3.65Å; W350-W400 HydrophobicContact CH2-CH2 4.1Å; W350-W400 AromaticContact CH2-CZ3 3.81Å; W350-W400 HydrophobicContact CH2-CZ3 3.81Å; W350-W400 HydrophobicContact CZ3-CE3 4.15Å; W350-W400 HydrophobicContact CZ3-CH2 4.31Å; W350-W400 AromaticContact CZ3-CZ3 3.56Å; W350-W400 HydrophobicContact CZ3-CZ3 3.56Å
351	Y	80.9	Confident	69.8	Low	35 Å²	35	60 Å²	60	14%	0.137	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	144.7	176.9	-60.3	-103.9	0	0	0	109.5	E355 L356 Y384 T385 I387	Y351-E355 CarbonylContact C-O 3.27Å; Y351-E355 WeakPolarHBondContact CA-O 3.11Å; Y351-E355 WeakPolarHBondContact CB-O 3.47Å; Y351-L356 HydrophobicContact CD1-CB 4.04Å; Y351-L356 HydrophobicContact CD1-CD1 4.28Å; Y351-L356 HydrophobicContact CD2-CD1 4.42Å; Y351-L356 HydrophobicContact CE1-CB 3.82Å; Y351-L356 HydrophobicContact CE1-CD1 3.78Å; Y351-L356 HydrophobicContact CE1-CG 4.4Å; Y351-L356 HydrophobicContact CE2-CD1 3.9Å; Y351-Y384 CarbonylContact O-C 3.51Å; Y351-Y384 VanDerWaalsContact O-CA 3.26Å; Y351-Y384 WeakPolarHBondContact O-CA 3.32Å; Y351-T385 PolarHBondContact N-O 2.97Å; Y351-T385 PolarHBondContact O-N 3.12Å; Y351-I387 HydrophobicContact CD2-CD1 3.99Å; Y351-I387 HydrophobicContact CD2-CG1 4.02Å; Y351-I387 HydrophobicContact CE2-CB 4.15Å; Y351-I387 HydrophobicContact CE2-CD1 3.65Å; Y351-I387 HydrophobicContact CE2-CG1 3.85Å
352	K	76.1	Confident	69.4	Low	11 Å²	11	61.3 Å²	61.3	5%	0.048	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.1	166.4	-179.4	-178.6	-173.9	-66.4	0	107.8	G354 E355 L357 I379 E381 T383 Y384	K352-G354 PolarHBondContact O-N 3.02Å; K352-E355 PolarHBondContact N-O 3.29Å; K352-E355 WeakPolarHBondContact O-CB 3.43Å; K352-E355 PolarHBondContact O-N 3.48Å; K352-L357 HydrophobicContact CB-CD1 4.02Å; K352-L357 HydrophobicContact CB-CD2 3.95Å; K352-L357 HydrophobicContact CB-CG 4.08Å; K352-I379 WeakPolarHBondContact CE-O 3.49Å; K352-I379 PolarHBondContact NZ-O 3.21Å; K352-E381 WeakPolarHBondContact CE-O 3.1Å; K352-E381 PolarHBondContact NZ-O 2.89Å; K352-T383 CarbonylContact C-O 3.45Å; K352-T383 WeakPolarHBondContact CA-O 3.23Å; K352-Y384 HydrophobicContact CB-CD1 4.24Å; K352-Y384 HydrophobicContact CB-CE1 4.07Å; K352-Y384 HydrophobicContact CD-CE1 3.96Å; K352-Y384 WeakPolarHBondContact CE-OH 3.36Å; K352-Y384 HydrophobicContact CG-CD1 4.43Å; K352-Y384 HydrophobicContact CG-CE1 3.98Å
353	D	70.1	Confident	69	Low	81 Å²	81	66 Å²	66	43%	0.433	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	33.3	179.5	-56.9	-51.2	0	0	0	113.3	E355 G382 T383	D353-E355 VanDerWaalsContact C-N 3.35Å; D353-G382 WeakPolarHBondContact OD1-CA 3.45Å; D353-T383 PolarHBondContact N-O 2.92Å; D353-T383 PolarHBondContact OD1-N 3.47Å
354	G	67	Low	69.1	Low	45 Å²	45	65.2 Å²	65.2	46%	0.464	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	-3.9	-178.1	0	0	0	0	0	115	K352	K352-G354 PolarHBondContact O-N 3.02Å
355	E	64.9	Low	69.4	Low	49 Å²	49	57.4 Å²	57.4	23%	0.229	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	134.4	178.7	-57.3	-166.6	157.1	0	0	111.4	L97 R267 Y351 K352 D353 L357	L97-E355 WeakPolarHBondContact CD1-OE1 3.47Å; L97-E355 WeakPolarHBondContact CD1-OE2 3.47Å; L97-E355 WeakPolarHBondContact CG-OE2 3.24Å; R267-E355 IonicContact CZ-OE1 3.68Å; R267-E355 IonicContact NE-OE1 3.7Å; R267-E355 IonicContact NH2-OE1 2.8Å; R267-E355 PolarHBondContact NH2-OE1 3.47Å; Y351-E355 CarbonylContact C-O 3.27Å; Y351-E355 WeakPolarHBondContact CA-O 3.11Å; Y351-E355 WeakPolarHBondContact CB-O 3.47Å; K352-E355 PolarHBondContact N-O 3.29Å; K352-E355 WeakPolarHBondContact O-CB 3.43Å; K352-E355 PolarHBondContact O-N 3.48Å; D353-E355 VanDerWaalsContact C-N 3.35Å; E355-L357 PolarHBondContact O-N 3.19Å
356	L	72.6	Confident	70.1	Confident	48 Å²	48	49.9 Å²	49.9	25%	0.251	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	128.5	-177.4	-178.1	72.1	0	0	0	110.4	Y349 W350 Y351 E358	Y349-L356 HydrophobicContact CD1-CD1 4.1Å; Y349-L356 HydrophobicContact CG-CD1 4.47Å; W350-L356 WeakPolarHBondContact O-CD1 2.86Å; Y351-L356 HydrophobicContact CD1-CB 4.04Å; Y351-L356 HydrophobicContact CD1-CD1 4.28Å; Y351-L356 HydrophobicContact CD2-CD1 4.42Å; Y351-L356 HydrophobicContact CE1-CB 3.82Å; Y351-L356 HydrophobicContact CE1-CD1 3.78Å; Y351-L356 HydrophobicContact CE1-CG 4.4Å; Y351-L356 HydrophobicContact CE2-CD1 3.9Å; L356-E358 HydrophobicContact CD2-CG 3.81Å; L356-E358 WeakPolarHBondContact CD2-OE1 3.08Å; L356-E358 HydrophobicContact CG-CG 3.99Å
357	L	72.6	Confident	70.3	Confident	14 Å²	14	50.9 Å²	50.9	7%	0.073	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	110.9	172.9	-64.4	177.2	0	0	0	109.5	W350 K352 E355 L367 I372 Y384	W350-L357 HydrophobicContact CB-CB 4.1Å; W350-L357 HydrophobicContact CB-CD1 4.27Å; W350-L357 PolarHBondContact O-N 3.24Å; K352-L357 HydrophobicContact CB-CD1 4.02Å; K352-L357 HydrophobicContact CB-CD2 3.95Å; K352-L357 HydrophobicContact CB-CG 4.08Å; E355-L357 PolarHBondContact O-N 3.19Å; L357-L367 HydrophobicContact CB-CD1 3.9Å; L357-L367 HydrophobicContact CB-CD2 3.73Å; L357-L367 HydrophobicContact CB-CG 4.43Å; L357-L367 HydrophobicContact CD1-CD1 4.39Å; L357-L367 WeakPolarHBondContact O-CD2 3.14Å; L357-I372 HydrophobicContact CD1-CD1 3.45Å; L357-I372 VanDerWaalsContact CD1-CD1 3.45Å; L357-Y384 HydrophobicContact CD1-CD1 4.2Å; L357-Y384 HydrophobicContact CD1-CE1 4.22Å
358	E	63	Low	70.1	Confident	56 Å²	56	51.5 Å²	51.5	26%	0.262	27%	0.272	S	S	.	.			trans	-101.5	-23.8	-178.6	-66.3	175.4	174.3	0	0	112.8	N92 K93 L356	N92-E358 VanDerWaalsContact CA-OE2 3.23Å; N92-E358 WeakPolarHBondContact CA-OE2 3.4Å; N92-E358 WeakPolarHBondContact CB-OE2 3.42Å; N92-E358 PolarHBondContact OD1-OE2 3.17Å; K93-E358 PolarHBondContact N-OE1 3.45Å; K93-E358 PolarHBondContact N-OE2 2.89Å; L356-E358 HydrophobicContact CD2-CG 3.81Å; L356-E358 WeakPolarHBondContact CD2-OE1 3.08Å; L356-E358 HydrophobicContact CG-CG 3.99Å
359	H	58.9	Low	69.4	Low	62 Å²	62	56.8 Å²	56.8	29%	0.287	30%	0.3	S	S	.	.	S	Bend	trans	-135.4	148.3	-170.1	-56.1	91.9	0	0	0	113.2	M239 L367	M239-H359 HydrophobicContact CE-CB 4.1Å; M239-H359 HydrophobicContact SD-CB 4.29Å; H359-L367 WeakPolarHBondContact O-CD1 3.45Å
360	S	62.8	Low	69.1	Low	56 Å²	56	55 Å²	55	39%	0.392	30%	0.297	S	S	.	.			trans	-74	138.6	168.3	-65.3	0	0	0	0	110.6	I365 L367	S360-I365 CarbonylContact C-O 3.59Å; S360-I365 VanDerWaalsContact CA-O 3.23Å; S360-I365 WeakPolarHBondContact CA-O 3.37Å; S360-I365 WeakPolarHBondContact CB-O 3.39Å; S360-L367 PolarHBondContact OG-N 3.4Å; S360-L367 PolarHBondContact OG-O 3.33Å; S360-L367 VanDerWaalsContact OG-O 3.14Å
361	H	58.8	Low	69.2	Low	19 Å²	19	56 Å²	56	9%	0.088	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-106.4	116.6	167.2	-66	-73.1	0	0	0	109.1	T96 N363 Y364 I365	T96-H361 PolarHBondContact OG1-NE2 3.13Å; H361-N363 PolarHBondContact O-N 3.1Å; H361-Y364 PolarHBondContact O-N 3.47Å; H361-Y364 VanDerWaalsContact O-N 3.12Å; H361-I365 CarbonylContact C-O 3.57Å; H361-I365 PolarHBondContact N-O 3.06Å; H361-I365 CarbonylContact O-C 3.56Å; H361-I365 PolarHBondContact O-N 3.47Å
362	P	52.8	Low	69.5	Low	83 Å²	83	54.4 Å²	54.4	54%	0.539	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.6	138.1	176.5	-25.9	33.8	0	0	0	111	Y364	P362-Y364 WeakPolarHBondContact O-CD2 3.34Å; P362-Y364 PolarHBondContact O-N 3.32Å
363	N	51.8	Low	70.1	Confident	121 Å²	121	55.4 Å²	55.4	65%	0.647	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	-12.1	-179.1	-54.4	-27.6	0	0	0	117.3	H361 V375	H361-N363 PolarHBondContact O-N 3.1Å; N363-V375 WeakPolarHBondContact O-CG2 3.36Å
364	Y	61.7	Low	70.8	Confident	74 Å²	74	51.6 Å²	51.6	29%	0.29	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-55.5	-179	-61.5	-79.4	0	0	0	113	H361 P362 I374 V375 I379 N380	H361-Y364 PolarHBondContact O-N 3.47Å; H361-Y364 VanDerWaalsContact O-N 3.12Å; P362-Y364 WeakPolarHBondContact O-CD2 3.34Å; P362-Y364 PolarHBondContact O-N 3.32Å; Y364-I374 WeakPolarHBondContact O-CA 3.29Å; Y364-V375 PolarHBondContact O-N 3.13Å; Y364-I379 HydrophobicContact CD1-CD1 3.92Å; Y364-I379 HydrophobicContact CE1-CD1 3.46Å; Y364-I379 VanDerWaalsContact CE1-CD1 3.46Å; Y364-N380 PolarHBondContact O-ND2 3.24Å
365	I	70.8	Confident	71.4	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.015	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	119.7	-173.7	-57	-177.4	0	0	0	109.7	S360 H361 L367 I372 T373 I374 N380 Y384	S360-I365 CarbonylContact C-O 3.59Å; S360-I365 VanDerWaalsContact CA-O 3.23Å; S360-I365 WeakPolarHBondContact CA-O 3.37Å; S360-I365 WeakPolarHBondContact CB-O 3.39Å; H361-I365 CarbonylContact C-O 3.57Å; H361-I365 PolarHBondContact N-O 3.06Å; H361-I365 CarbonylContact O-C 3.56Å; H361-I365 PolarHBondContact O-N 3.47Å; I365-L367 HydrophobicContact CG2-CD1 3.56Å; I365-L367 HydrophobicContact CG2-CG 4.36Å; I365-I372 HydrophobicContact CG2-CD1 3.6Å; I365-I372 HydrophobicContact CG2-CG1 3.73Å; I365-T373 CarbonylContact C-O 3.57Å; I365-T373 WeakPolarHBondContact CA-O 3.41Å; I365-I374 HydrophobicContact CB-CG2 4.44Å; I365-I374 HydrophobicContact CG1-CG2 4.01Å; I365-I374 HydrophobicContact CG2-CG2 4.16Å; I365-N380 WeakPolarHBondContact CD1-OD1 3.13Å; I365-N380 WeakPolarHBondContact CG1-OD1 3.31Å; I365-Y384 HydrophobicContact CD1-CE1 4.44Å
366	S	78.6	Confident	72.1	Confident	47 Å²	47	47.5 Å²	47.5	33%	0.329	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	108	168.1	-178.2	0	0	0	0	109.7	I372 T373	S366-I372 CarbonylContact O-C 3.57Å; S366-I372 WeakPolarHBondContact O-CA 3.49Å; S366-T373 PolarHBondContact N-O 3.24Å; S366-T373 PolarHBondContact O-N 3.02Å
367	L	78.8	Confident	71.8	Confident	32 Å²	32	45.4 Å²	45.4	17%	0.168	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	126.6	168.8	-83.2	108.4	0	0	0	110.6	W350 L357 H359 S360 I365 I372	W350-L367 HydrophobicContact CB-CD2 3.8Å; W350-L367 HydrophobicContact CG-CD2 4.06Å; L357-L367 HydrophobicContact CB-CD1 3.9Å; L357-L367 HydrophobicContact CB-CD2 3.73Å; L357-L367 HydrophobicContact CB-CG 4.43Å; L357-L367 HydrophobicContact CD1-CD1 4.39Å; L357-L367 WeakPolarHBondContact O-CD2 3.14Å; H359-L367 WeakPolarHBondContact O-CD1 3.45Å; S360-L367 PolarHBondContact OG-N 3.4Å; S360-L367 PolarHBondContact OG-O 3.33Å; S360-L367 VanDerWaalsContact OG-O 3.14Å; I365-L367 HydrophobicContact CG2-CD1 3.56Å; I365-L367 HydrophobicContact CG2-CG 4.36Å; L367-I372 HydrophobicContact CD1-CD1 4.36Å; L367-I372 HydrophobicContact CG-CD1 4.16Å; L367-I372 HydrophobicContact CG-CG1 4.21Å
368	K	77.7	Confident	71.3	Confident	117 Å²	117	45.9 Å²	45.9	51%	0.509	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	162	165.7	-63.9	-174.1	179.2	179	0	108.5	D370 H371	K368-D370 VanDerWaalsContact C-N 3.3Å; K368-D370 PolarHBondContact O-N 2.92Å; K368-H371 CarbonylContact C-O 3.58Å; K368-H371 WeakPolarHBondContact CA-O 3.29Å; K368-H371 WeakPolarHBondContact CB-O 3.47Å; K368-H371 PolarHBondContact N-O 3.08Å; K368-H371 PolarHBondContact O-N 2.04Å
369	D	70.5	Confident	71.1	Confident	148 Å²	148	44 Å²	44	79%	0.791	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-43.4	-172.1	-58.8	-37.1	0	0	0	113.2	I348	I348-D369 WeakPolarHBondContact CB-O 3.35Å; I348-D369 WeakPolarHBondContact CD1-O 3.4Å
370	D	76.8	Confident	71.8	Confident	47 Å²	47	41.1 Å²	41.1	25%	0.251	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-9	-176	76.6	-42.9	0	0	0	114.9	R336 C337 K339 K368	R336-D370 IonicContact NH1-OD2 2.65Å; C337-D370 PolarHBondContact N-O 2.75Å; K339-D370 WeakPolarHBondContact CE-OD2 3.45Å; K339-D370 IonicContact NZ-OD2 3.88Å; K368-D370 VanDerWaalsContact C-N 3.3Å; K368-D370 PolarHBondContact O-N 2.92Å
371	H	86.5	Confident	72.3	Confident	29 Å²	29	39.9 Å²	39.9	13%	0.134	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	151.3	-177.9	66.5	-78.9	0	0	0	113.8	T334 F335 R336 K368	T334-H371 HydrophobicContact CG2-CB 4.03Å; F335-H371 CarbonylContact O-C 3.54Å; F335-H371 WeakPolarHBondContact O-CA 3.5Å; F335-H371 VanDerWaalsContact O-CB 3.24Å; F335-H371 WeakPolarHBondContact O-CB 3.47Å; R336-H371 HydrophobicContact CB-CB 4.46Å; R336-H371 HydrophobicContact CG-CB 3.94Å; K368-H371 CarbonylContact C-O 3.58Å; K368-H371 WeakPolarHBondContact CA-O 3.29Å; K368-H371 WeakPolarHBondContact CB-O 3.47Å; K368-H371 PolarHBondContact N-O 3.08Å; K368-H371 PolarHBondContact O-N 2.04Å
372	I	87.6	Confident	73.2	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	140.7	168.8	-171.1	173.1	0	0	0	108.9	T334 F335 W350 L357 I365 S366 L367 I374 Y384	T334-I372 CarbonylContact C-O 3.51Å; T334-I372 VanDerWaalsContact CA-O 3.3Å; T334-I372 WeakPolarHBondContact CA-O 3.33Å; F335-I372 HydrophobicContact CB-CG2 3.79Å; F335-I372 HydrophobicContact CD2-CG2 3.77Å; F335-I372 HydrophobicContact CG-CG2 4.26Å; F335-I372 PolarHBondContact N-O 3.2Å; F335-I372 PolarHBondContact O-N 3.31Å; W350-I372 HydrophobicContact CD2-CB 4.06Å; W350-I372 HydrophobicContact CD2-CG2 3.95Å; W350-I372 HydrophobicContact CE3-CB 4.23Å; W350-I372 HydrophobicContact CE3-CG2 3.62Å; W350-I372 HydrophobicContact CH2-CB 4.4Å; W350-I372 HydrophobicContact CH2-CG2 3.55Å; W350-I372 HydrophobicContact CZ2-CB 4.24Å; W350-I372 HydrophobicContact CZ2-CG2 3.88Å; W350-I372 HydrophobicContact CZ3-CB 4.38Å; W350-I372 HydrophobicContact CZ3-CG2 3.4Å; W350-I372 VanDerWaalsContact CZ3-CG2 3.4Å; L357-I372 HydrophobicContact CD1-CD1 3.45Å; L357-I372 VanDerWaalsContact CD1-CD1 3.45Å; I365-I372 HydrophobicContact CG2-CD1 3.6Å; I365-I372 HydrophobicContact CG2-CG1 3.73Å; S366-I372 CarbonylContact O-C 3.57Å; S366-I372 WeakPolarHBondContact O-CA 3.49Å; L367-I372 HydrophobicContact CD1-CD1 4.36Å; L367-I372 HydrophobicContact CG-CD1 4.16Å; L367-I372 HydrophobicContact CG-CG1 4.21Å; I372-I374 HydrophobicContact CD1-CG2 4.22Å; I372-I374 HydrophobicContact CG1-CG2 4.11Å; I372-Y384 HydrophobicContact CD1-CD1 3.99Å; I372-Y384 HydrophobicContact CD1-CE1 4.13Å
373	T	88.1	Confident	74.7	Confident	32 Å²	32	36.5 Å²	36.5	20%	0.196	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	131.1	170.2	-56.1	0	0	0	0	109.3	L333 T334 I365 S366	L333-T373 CarbonylContact O-C 3.54Å; L333-T373 WeakPolarHBondContact O-CA 3.37Å; T334-T373 PolarHBondContact OG1-OG1 2.75Å; T334-T373 VanDerWaalsContact OG1-OG1 3.07Å; I365-T373 CarbonylContact C-O 3.57Å; I365-T373 WeakPolarHBondContact CA-O 3.41Å; S366-T373 PolarHBondContact N-O 3.24Å; S366-T373 PolarHBondContact O-N 3.02Å
374	I	85.3	Confident	76.4	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	153.3	177.7	66.2	173.1	0	0	0	110	K332 L333 F335 Y364 I365 I372 N380 Y384 V402	K332-I374 CarbonylContact C-O 3.54Å; K332-I374 WeakPolarHBondContact CA-O 3.45Å; L333-I374 HydrophobicContact CB-CD1 4.46Å; L333-I374 HydrophobicContact CB-CG1 3.81Å; L333-I374 HydrophobicContact CD1-CD1 4.14Å; L333-I374 HydrophobicContact CD1-CG1 4.22Å; L333-I374 PolarHBondContact N-O 3.41Å; L333-I374 PolarHBondContact O-N 2.92Å; F335-I374 HydrophobicContact CE2-CD1 3.64Å; F335-I374 HydrophobicContact CE2-CG1 4.1Å; F335-I374 HydrophobicContact CZ-CD1 4.03Å; F335-I374 HydrophobicContact CZ-CG1 4.47Å; Y364-I374 WeakPolarHBondContact O-CA 3.29Å; I365-I374 HydrophobicContact CB-CG2 4.44Å; I365-I374 HydrophobicContact CG1-CG2 4.01Å; I365-I374 HydrophobicContact CG2-CG2 4.16Å; I372-I374 HydrophobicContact CD1-CG2 4.22Å; I372-I374 HydrophobicContact CG1-CG2 4.11Å; I374-N380 HydrophobicContact CB-CB 4.33Å; I374-N380 HydrophobicContact CD1-CB 4.3Å; I374-Y384 HydrophobicContact CD1-CD2 4.18Å; I374-Y384 HydrophobicContact CD1-CE1 4.44Å; I374-Y384 HydrophobicContact CD1-CE2 3.54Å; I374-Y384 HydrophobicContact CG2-CE1 3.87Å; I374-V402 HydrophobicContact CD1-CG1 4.32Å; I374-V402 HydrophobicContact CD1-CG2 4.04Å
375	V	79.8	Confident	77.6	Confident	8 Å²	8	28 Å²	28	5%	0.048	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	124.4	167.7	-177	0	0	0	0	107.9	Y172 K332 N363 Y364 N377 N380	Y172-V375 HydrophobicContact CD1-CG1 4.46Å; Y172-V375 HydrophobicContact CE1-CG1 4.29Å; K332-V375 HydrophobicContact CG-CG2 4.22Å; N363-V375 WeakPolarHBondContact O-CG2 3.36Å; Y364-V375 PolarHBondContact O-N 3.13Å; V375-N377 PolarHBondContact O-N 2.83Å; V375-N380 VanDerWaalsContact O-CB 3.22Å; V375-N380 WeakPolarHBondContact O-CB 3.49Å; V375-N380 PolarHBondContact O-ND2 3.45Å
376	A	78.6	Confident	78.5	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.154	C	C	.	.			trans	-64	108.6	177.9	0	0	0	0	0	109.9	V327 T328 E329 G330 K331 L333 V404	V327-A376 HydrophobicContact CB-CB 4.11Å; V327-A376 HydrophobicContact CG1-CB 3.85Å; T328-A376 WeakPolarHBondContact O-CB 3.1Å; E329-A376 CarbonylContact C-O 3.49Å; E329-A376 WeakPolarHBondContact CA-O 3.32Å; G330-A376 PolarHBondContact N-O 2.86Å; K331-A376 HydrophobicContact CB-CB 4.44Å; K331-A376 VanDerWaalsContact O-CB 3.28Å; K331-A376 WeakPolarHBondContact O-CB 3.27Å; K331-A376 PolarHBondContact O-N 3.05Å; L333-A376 HydrophobicContact CD1-CB 4.25Å; A376-V404 HydrophobicContact CB-CG2 4.22Å
377	N	67.3	Low	78.9	Confident	4 Å²	4	26 Å²	26	2%	0.021	14%	0.14	C	C	.	.	S	Bend	trans	-153.8	173.2	175.2	59.5	26.7	0	0	0	108.5	L173 V375 I379 N380 E381 V404	L173-N377 HydrophobicContact CD1-CB 3.96Å; L173-N377 HydrophobicContact CD2-CB 4.32Å; V375-N377 PolarHBondContact O-N 2.83Å; N377-I379 PolarHBondContact O-N 3.45Å; N377-I379 VanDerWaalsContact O-N 3.1Å; N377-I379 WeakPolarHBondContact OD1-CB 3.49Å; N377-I379 PolarHBondContact OD1-N 2.86Å; N377-N380 PolarHBondContact O-N 3.25Å; N377-N380 VanDerWaalsContact O-N 3.1Å; N377-N380 WeakPolarHBondContact OD1-CB 3.17Å; N377-N380 PolarHBondContact OD1-N 3.4Å; N377-N380 PolarHBondContact OD1-ND2 2.94Å; N377-E381 PolarHBondContact O-N 2.72Å; N377-E381 VanDerWaalsContact O-N 3.1Å; N377-V404 WeakPolarHBondContact O-CG2 3.49Å
378	A	60.4	Low	79.3	Confident	25 Å²	25	24.5 Å²	24.5	21%	0.207	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-53.3	-33.8	-179.4	0	0	0	0	0	113.2	P99 L102 F406	P99-A378 VanDerWaalsContact CG-O 3.29Å; P99-A378 WeakPolarHBondContact CG-O 3.31Å; L102-A378 HydrophobicContact CD1-CB 4.43Å; L102-A378 HydrophobicContact CD2-CB 4.03Å; A378-F406 HydrophobicContact CB-CE1 4.36Å; A378-F406 HydrophobicContact CB-CZ 3.95Å
379	I	60.3	Low	79.7	Confident	16 Å²	16	21.9 Å²	21.9	8%	0.082	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-72.5	-37.7	-178.5	-59.1	157.7	0	0	0	112.1	P99 L102 F189 M236 K352 Y364 N377 E381	P99-I379 WeakPolarHBondContact CD-O 3.36Å; P99-I379 WeakPolarHBondContact CG-O 3.41Å; L102-I379 HydrophobicContact CD1-CB 4.24Å; L102-I379 HydrophobicContact CD1-CG1 3.43Å; L102-I379 VanDerWaalsContact CD1-CG1 3.43Å; F189-I379 HydrophobicContact CD2-CD1 3.72Å; F189-I379 HydrophobicContact CD2-CG1 4.04Å; F189-I379 HydrophobicContact CE2-CD1 3.51Å; F189-I379 HydrophobicContact CE2-CG1 4.1Å; M236-I379 HydrophobicContact CE-CG2 3.8Å; M236-I379 HydrophobicContact SD-CG2 3.95Å; K352-I379 WeakPolarHBondContact CE-O 3.49Å; K352-I379 PolarHBondContact NZ-O 3.21Å; Y364-I379 HydrophobicContact CD1-CD1 3.92Å; Y364-I379 HydrophobicContact CE1-CD1 3.46Å; Y364-I379 VanDerWaalsContact CE1-CD1 3.46Å; N377-I379 PolarHBondContact O-N 3.45Å; N377-I379 VanDerWaalsContact O-N 3.1Å; N377-I379 WeakPolarHBondContact OD1-CB 3.49Å; N377-I379 PolarHBondContact OD1-N 2.86Å; I379-E381 VanDerWaalsContact C-N 3.34Å
380	N	72.1	Confident	80.4	Confident	1 Å²	1	19 Å²	19	1%	0.005	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-93.1	6.4	-178.2	-70.4	-43.8	0	0	0	112.8	Y364 I365 I374 V375 N377 Y384	Y364-N380 PolarHBondContact O-ND2 3.24Å; I365-N380 WeakPolarHBondContact CD1-OD1 3.13Å; I365-N380 WeakPolarHBondContact CG1-OD1 3.31Å; I374-N380 HydrophobicContact CB-CB 4.33Å; I374-N380 HydrophobicContact CD1-CB 4.3Å; V375-N380 VanDerWaalsContact O-CB 3.22Å; V375-N380 WeakPolarHBondContact O-CB 3.49Å; V375-N380 PolarHBondContact O-ND2 3.45Å; N377-N380 PolarHBondContact O-N 3.25Å; N377-N380 VanDerWaalsContact O-N 3.1Å; N377-N380 WeakPolarHBondContact OD1-CB 3.17Å; N377-N380 PolarHBondContact OD1-N 3.4Å; N377-N380 PolarHBondContact OD1-ND2 2.94Å; N380-Y384 VanDerWaalsContact CA-OH 3.32Å; N380-Y384 WeakPolarHBondContact CA-OH 3.12Å; N380-Y384 WeakPolarHBondContact CB-OH 3.32Å; N380-Y384 VanDerWaalsContact O-CE2 3.28Å; N380-Y384 WeakPolarHBondContact O-CE2 3.23Å; N380-Y384 PolarHBondContact O-OH 2.77Å; N380-Y384 VanDerWaalsContact O-OH 3.06Å; N380-Y384 PolarHBondContact OD1-OH 3.24Å
381	E	74.9	Confident	80.3	Confident	30 Å²	30	27.9 Å²	27.9	14%	0.14	13%	0.131	C	C	.	.			trans	-64.9	141	162.3	179.8	143	178.3	0	0	109.6	P99 K352 N377 I379 V402 R403 V404	P99-E381 WeakPolarHBondContact CG-O 2.95Å; K352-E381 WeakPolarHBondContact CE-O 3.1Å; K352-E381 PolarHBondContact NZ-O 2.89Å; N377-E381 PolarHBondContact O-N 2.72Å; N377-E381 VanDerWaalsContact O-N 3.1Å; I379-E381 VanDerWaalsContact C-N 3.34Å; E381-V402 WeakPolarHBondContact CG-O 3.5Å; E381-R403 WeakPolarHBondContact OE1-CG 3.06Å; E381-V404 HydrophobicContact CB-CG2 4.46Å; E381-V404 PolarHBondContact OE2-N 2.96Å
382	G	77.8	Confident	79.8	Confident	11 Å²	11	33.8 Å²	33.8	11%	0.113	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	144.3	-171.5	-179	0	0	0	0	0	113.9	D353 V402	D353-G382 WeakPolarHBondContact OD1-CA 3.45Å; G382-V402 PolarHBondContact N-O 2.79Å; G382-V402 PolarHBondContact O-N 3.45Å
383	T	83.1	Confident	79.4	Confident	21 Å²	21	41.2 Å²	41.2	13%	0.129	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	111.5	-179	-52.4	0	0	0	0	110	T318 T322 K352 D353 W400	T318-T383 HydrophobicContact CG2-CG2 4.17Å; T322-T383 HydrophobicContact CG2-CG2 4.46Å; K352-T383 CarbonylContact C-O 3.45Å; K352-T383 WeakPolarHBondContact CA-O 3.23Å; D353-T383 PolarHBondContact N-O 2.92Å; D353-T383 PolarHBondContact OD1-N 3.47Å; T383-W400 CarbonylContact C-O 3.52Å; T383-W400 WeakPolarHBondContact CA-O 3.2Å
384	Y	87.6	Confident	79.2	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	124.6	174.9	-66.2	-94.4	0	0	0	109.6	F335 Y351 K352 L357 I365 I372 I374 N380 S399 W400 V402	F335-Y384 HydrophobicContact CD2-CG 4.42Å; F335-Y384 HydrophobicContact CE2-CD2 4.11Å; F335-Y384 HydrophobicContact CE2-CG 4.19Å; Y351-Y384 CarbonylContact O-C 3.51Å; Y351-Y384 VanDerWaalsContact O-CA 3.26Å; Y351-Y384 WeakPolarHBondContact O-CA 3.32Å; K352-Y384 HydrophobicContact CB-CD1 4.24Å; K352-Y384 HydrophobicContact CB-CE1 4.07Å; K352-Y384 HydrophobicContact CD-CE1 3.96Å; K352-Y384 WeakPolarHBondContact CE-OH 3.36Å; K352-Y384 HydrophobicContact CG-CD1 4.43Å; K352-Y384 HydrophobicContact CG-CE1 3.98Å; L357-Y384 HydrophobicContact CD1-CD1 4.2Å; L357-Y384 HydrophobicContact CD1-CE1 4.22Å; I365-Y384 HydrophobicContact CD1-CE1 4.44Å; I372-Y384 HydrophobicContact CD1-CD1 3.99Å; I372-Y384 HydrophobicContact CD1-CE1 4.13Å; I374-Y384 HydrophobicContact CD1-CD2 4.18Å; I374-Y384 HydrophobicContact CD1-CE1 4.44Å; I374-Y384 HydrophobicContact CD1-CE2 3.54Å; I374-Y384 HydrophobicContact CG2-CE1 3.87Å; N380-Y384 VanDerWaalsContact CA-OH 3.32Å; N380-Y384 WeakPolarHBondContact CA-OH 3.12Å; N380-Y384 WeakPolarHBondContact CB-OH 3.32Å; N380-Y384 VanDerWaalsContact O-CE2 3.28Å; N380-Y384 WeakPolarHBondContact O-CE2 3.23Å; N380-Y384 PolarHBondContact O-OH 2.77Å; N380-Y384 VanDerWaalsContact O-OH 3.06Å; N380-Y384 PolarHBondContact OD1-OH 3.24Å; Y384-S399 CarbonylContact O-C 3.55Å; Y384-S399 VanDerWaalsContact O-CA 3.27Å; Y384-S399 WeakPolarHBondContact O-CA 3.48Å; Y384-W400 PolarHBondContact N-O 3.46Å; Y384-W400 PolarHBondContact O-N 3.39Å; Y384-V402 HydrophobicContact CD2-CG2 3.87Å; Y384-V402 HydrophobicContact CE2-CB 4.4Å; Y384-V402 HydrophobicContact CE2-CG2 4.1Å
385	T	87.5	Confident	79.1	Confident	16 Å²	16	46.8 Å²	46.8	10%	0.098	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	123.9	178	-59.2	0	0	0	0	109.6	P319 W350 Y351 I387 Y398 S399	P319-T385 HydrophobicContact CG-CG2 4.47Å; W350-T385 CarbonylContact C-O 3.47Å; Y351-T385 PolarHBondContact N-O 2.97Å; Y351-T385 PolarHBondContact O-N 3.12Å; T385-I387 HydrophobicContact CG2-CD1 4.38Å; T385-I387 HydrophobicContact CG2-CG1 3.88Å; T385-Y398 CarbonylContact C-O 3.52Å; T385-Y398 VanDerWaalsContact CA-O 3.31Å; T385-Y398 WeakPolarHBondContact CA-O 3.04Å; T385-S399 WeakPolarHBondContact CB-OG 3.24Å; T385-S399 VanDerWaalsContact CG2-OG 3.31Å; T385-S399 WeakPolarHBondContact CG2-OG 3.45Å; T385-S399 PolarHBondContact OG1-OG 3.11Å
386	C	89.1	Confident	79.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	136.7	163.5	177.6	0	0	0	0	110	C337 Y349 W350 N397 Y398 W400	C337-C386 HydrophobicContact CB-CB 3.51Å; C337-C386 WeakPolarHBondContact CB-SG 3.4Å; C337-C386 WeakPolarHBondContact SG-CB 3.5Å; C337-C386 CovalentContact SG-SG 1.98Å; C337-C386 PolarHBondContact SG-SG 3.34Å; Y349-C386 CarbonylContact O-C 3.38Å; Y349-C386 WeakPolarHBondContact O-CA 3.4Å; W350-C386 HydrophobicContact CD2-CB 4.17Å; W350-C386 HydrophobicContact CE3-CB 3.81Å; W350-C386 HydrophobicContact CH2-CB 3.83Å; W350-C386 HydrophobicContact CZ2-CB 4.18Å; W350-C386 HydrophobicContact CZ3-CB 3.65Å; C386-N397 CarbonylContact O-C 2.94Å; C386-N397 WeakPolarHBondContact O-CA 3.26Å; C386-Y398 PolarHBondContact N-O 3.12Å; C386-Y398 PolarHBondContact O-N 3.04Å; C386-W400 HydrophobicContact CB-CZ3 4.07Å
387	I	87.4	Confident	79.6	Confident	8 Å²	8	50.6 Å²	50.6	4%	0.041	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	124.1	171.2	-51	-175.5	0	0	0	108.7	Y349 Y351 T385 K389 V394 N397	Y349-I387 PolarHBondContact N-O 2.79Å; Y349-I387 PolarHBondContact O-N 2.95Å; Y351-I387 HydrophobicContact CD2-CD1 3.99Å; Y351-I387 HydrophobicContact CD2-CG1 4.02Å; Y351-I387 HydrophobicContact CE2-CB 4.15Å; Y351-I387 HydrophobicContact CE2-CD1 3.65Å; Y351-I387 HydrophobicContact CE2-CG1 3.85Å; T385-I387 HydrophobicContact CG2-CD1 4.38Å; T385-I387 HydrophobicContact CG2-CG1 3.88Å; I387-K389 HydrophobicContact CG2-CD 4.42Å; I387-K389 HydrophobicContact CG2-CG 3.77Å; I387-V394 HydrophobicContact CG2-CB 4.41Å; I387-V394 HydrophobicContact CG2-CG1 3.72Å; I387-V394 HydrophobicContact CG2-CG2 3.95Å; I387-N397 HydrophobicContact CG1-CB 4.3Å
388	V	87.1	Confident	80.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	118.8	171.3	-172	0	0	0	0	108.4	I341 N347 I348 L395 T396	I341-V388 HydrophobicContact CG2-CG1 4.26Å; N347-V388 CarbonylContact O-C 3.5Å; N347-V388 WeakPolarHBondContact O-CA 3.44Å; I348-V388 HydrophobicContact CG1-CG2 4.18Å; V388-L395 HydrophobicContact CB-CB 4.48Å; V388-L395 HydrophobicContact CG1-CB 4.47Å; V388-L395 HydrophobicContact CG1-CD1 4.25Å; V388-L395 PolarHBondContact O-N 3.4Å; V388-T396 HydrophobicContact CB-CG2 3.75Å; V388-T396 HydrophobicContact CG2-CG2 3.48Å; V388-T396 VanDerWaalsContact CG2-CG2 3.48Å; V388-T396 PolarHBondContact N-O 2.67Å
389	K	86.1	Confident	82	Confident	63 Å²	63	53.8 Å²	53.8	27%	0.274	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	152.3	179.7	-55.8	-176.8	179	177.7	0	112	G346 N347 Y349 I387 K393 V394	G346-K389 CarbonylContact C-O 3.54Å; G346-K389 WeakPolarHBondContact CA-O 3.28Å; N347-K389 PolarHBondContact N-O 2.89Å; N347-K389 PolarHBondContact O-N 3.16Å; Y349-K389 HydrophobicContact CD2-CB 4.27Å; Y349-K389 HydrophobicContact CD2-CD 4.15Å; Y349-K389 HydrophobicContact CD2-CG 4.06Å; Y349-K389 HydrophobicContact CE2-CB 3.92Å; Y349-K389 HydrophobicContact CE2-CD 4.14Å; Y349-K389 HydrophobicContact CE2-CG 4.15Å; I387-K389 HydrophobicContact CG2-CD 4.42Å; I387-K389 HydrophobicContact CG2-CG 3.77Å; K389-K393 CarbonylContact C-O 3.51Å; K389-K393 VanDerWaalsContact CA-O 3.31Å; K389-K393 WeakPolarHBondContact CA-O 3.2Å; K389-V394 HydrophobicContact CG-CG2 4.25Å
390	K	85.2	Confident	83.5	Confident	86 Å²	86	54 Å²	54	37%	0.374	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	117.6	169.3	-177.3	-179.3	-175.6	179.2	0	109.7	R345 D392 K393 L395	R345-K390 WeakPolarHBondContact O-CD 3.48Å; K390-D392 PolarHBondContact O-N 3.18Å; K390-D392 VanDerWaalsContact O-N 3.13Å; K390-K393 PolarHBondContact N-O 3.42Å; K390-K393 PolarHBondContact O-N 3.03Å; K390-L395 HydrophobicContact CB-CD1 3.96Å; K390-L395 HydrophobicContact CB-CD2 4.48Å; K390-L395 HydrophobicContact CB-CG 4.28Å
391	R	75.4	Confident	84.3	Confident	235 Å²	235	59 Å²	59	89%	0.887	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.5	39	-179.8	-57.1	177.9	178.7	169.1	-4.6	112.8
392	D	74.8	Confident	84.8	Confident	153 Å²	153	57.5 Å²	57.5	82%	0.818	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	-7.1	-176.9	-50.7	-40.8	0	0	0	118.8	K390	K390-D392 PolarHBondContact O-N 3.18Å; K390-D392 VanDerWaalsContact O-N 3.13Å
393	K	80.4	Confident	85.1	Confident	155 Å²	155	62.8 Å²	62.8	67%	0.674	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	125.2	170.5	-168.2	170.8	-178.3	173.4	0	111.1	K389 K390 L395	K389-K393 CarbonylContact C-O 3.51Å; K389-K393 VanDerWaalsContact CA-O 3.31Å; K389-K393 WeakPolarHBondContact CA-O 3.2Å; K390-K393 PolarHBondContact N-O 3.42Å; K390-K393 PolarHBondContact O-N 3.03Å; K393-L395 PolarHBondContact O-N 2.79Å
394	V	84.1	Confident	84.7	Confident	74 Å²	74	62.4 Å²	62.4	45%	0.448	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	116.8	169.4	178.2	0	0	0	0	108.8	I387 K389	I387-V394 HydrophobicContact CG2-CB 4.41Å; I387-V394 HydrophobicContact CG2-CG1 3.72Å; I387-V394 HydrophobicContact CG2-CG2 3.95Å; K389-V394 HydrophobicContact CG-CG2 4.25Å
395	L	83.1	Confident	84.3	Confident	76 Å²	76	69.8 Å²	69.8	40%	0.398	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-40.7	178.4	-60.4	-178.4	0	0	0	111.5	I341 V388 K390 K393	I341-L395 HydrophobicContact CG2-CB 4.09Å; I341-L395 HydrophobicContact CG2-CD1 4.17Å; V388-L395 HydrophobicContact CB-CB 4.48Å; V388-L395 HydrophobicContact CG1-CB 4.47Å; V388-L395 HydrophobicContact CG1-CD1 4.25Å; V388-L395 PolarHBondContact O-N 3.4Å; K390-L395 HydrophobicContact CB-CD1 3.96Å; K390-L395 HydrophobicContact CB-CD2 4.48Å; K390-L395 HydrophobicContact CB-CG 4.28Å; K393-L395 PolarHBondContact O-N 2.79Å
396	T	82.8	Confident	83.1	Confident	25 Å²	25	77.2 Å²	77.2	15%	0.153	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	152.1	177	-172.7	0	0	0	0	110.2	I341 V388 Y398	I341-T396 HydrophobicContact CD1-CG2 3.76Å; I341-T396 HydrophobicContact CG2-CG2 4.22Å; V388-T396 HydrophobicContact CB-CG2 3.75Å; V388-T396 HydrophobicContact CG2-CG2 3.48Å; V388-T396 VanDerWaalsContact CG2-CG2 3.48Å; V388-T396 PolarHBondContact N-O 2.67Å; T396-Y398 HydrophobicContact CG2-CD2 4.31Å; T396-Y398 HydrophobicContact CG2-CE2 3.7Å; T396-Y398 WeakPolarHBondContact OG1-CE2 3.47Å
397	N	85.9	Confident	82.8	Confident	64 Å²	64	81.1 Å²	81.1	34%	0.342	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	145.1	167.3	63.1	17.8	0	0	0	110.2	P319 C386 I387	P319-N397 HydrophobicContact CG-CB 4.38Å; C386-N397 CarbonylContact O-C 2.94Å; C386-N397 WeakPolarHBondContact O-CA 3.26Å; I387-N397 HydrophobicContact CG1-CB 4.3Å
398	Y	87.5	Confident	82.6	Confident	93 Å²	93	84.9 Å²	84.9	37%	0.365	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	133	175.4	-65.8	-80.5	0	0	0	108	T385 C386 T396 W400	T385-Y398 CarbonylContact C-O 3.52Å; T385-Y398 VanDerWaalsContact CA-O 3.31Å; T385-Y398 WeakPolarHBondContact CA-O 3.04Å; C386-Y398 PolarHBondContact N-O 3.12Å; C386-Y398 PolarHBondContact O-N 3.04Å; T396-Y398 HydrophobicContact CG2-CD2 4.31Å; T396-Y398 HydrophobicContact CG2-CE2 3.7Å; T396-Y398 WeakPolarHBondContact OG1-CE2 3.47Å; Y398-W400 HydrophobicContact CG-CH2 4.18Å; Y398-W400 WeakPolarHBondContact O-CZ3 3.39Å
399	S	90	Very high	82.4	Confident	2 Å²	2	89.7 Å²	89.7	1%	0.014	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	142.5	178.8	-66.5	0	0	0	0	112.4	P319 T322 K323 Y384 T385	P319-S399 WeakPolarHBondContact CD-OG 3.34Å; P319-S399 VanDerWaalsContact CG-OG 3.26Å; P319-S399 WeakPolarHBondContact CG-OG 3.4Å; T322-S399 WeakPolarHBondContact CA-O 3.47Å; T322-S399 WeakPolarHBondContact OG1-CB 3.39Å; K323-S399 PolarHBondContact N-O 3.29Å; Y384-S399 CarbonylContact O-C 3.55Å; Y384-S399 VanDerWaalsContact O-CA 3.27Å; Y384-S399 WeakPolarHBondContact O-CA 3.48Å; T385-S399 WeakPolarHBondContact CB-OG 3.24Å; T385-S399 VanDerWaalsContact CG2-OG 3.31Å; T385-S399 WeakPolarHBondContact CG2-OG 3.45Å; T385-S399 PolarHBondContact OG1-OG 3.11Å
400	W	91.3	Very high	82.1	Confident	22 Å²	22	91.2 Å²	91.2	8%	0.083	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	121.3	177.1	-61.5	-91.9	0	0	0	109	K323 F335 W350 T383 Y384 C386 Y398	K323-W400 CarbonylContact O-C 3.5Å; K323-W400 VanDerWaalsContact O-CA 3.25Å; K323-W400 WeakPolarHBondContact O-CA 3.39Å; F335-W400 HydrophobicContact CB-CD2 4.12Å; F335-W400 HydrophobicContact CB-CE3 4.14Å; F335-W400 HydrophobicContact CB-CH2 4.25Å; F335-W400 HydrophobicContact CB-CZ2 4.24Å; F335-W400 HydrophobicContact CB-CZ3 4.21Å; F335-W400 HydrophobicContact CD1-CB 4.48Å; F335-W400 AromaticContact CD1-CD1 3.96Å; F335-W400 HydrophobicContact CD1-CD2 4.18Å; F335-W400 AromaticContact CD1-CG 3.97Å; F335-W400 HydrophobicContact CD1-CG 3.97Å; F335-W400 HydrophobicContact CE1-CB 4.41Å; F335-W400 HydrophobicContact CE1-CG 4.29Å; F335-W400 HydrophobicContact CG-CD2 4.04Å; F335-W400 HydrophobicContact CG-CE3 4.31Å; F335-W400 HydrophobicContact CG-CG 4.19Å; F335-W400 HydrophobicContact CZ-CB 4.42Å; W350-W400 HydrophobicContact CH2-CH2 4.1Å; W350-W400 AromaticContact CH2-CZ3 3.81Å; W350-W400 HydrophobicContact CH2-CZ3 3.81Å; W350-W400 HydrophobicContact CZ3-CE3 4.15Å; W350-W400 HydrophobicContact CZ3-CH2 4.31Å; W350-W400 AromaticContact CZ3-CZ3 3.56Å; W350-W400 HydrophobicContact CZ3-CZ3 3.56Å; T383-W400 CarbonylContact C-O 3.52Å; T383-W400 WeakPolarHBondContact CA-O 3.2Å; Y384-W400 PolarHBondContact N-O 3.46Å; Y384-W400 PolarHBondContact O-N 3.39Å; C386-W400 HydrophobicContact CB-CZ3 4.07Å; Y398-W400 HydrophobicContact CG-CH2 4.18Å; Y398-W400 WeakPolarHBondContact O-CZ3 3.39Å
401	R	89.1	Confident	81.9	Confident	104 Å²	104	91.6 Å²	91.6	39%	0.392	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	111.1	170.6	-167.6	173.2	-158.4	172.2	5.1	108.6	T322 K323 H324 K325	T322-R401 HydrophobicContact CG2-CB 3.78Å; K323-R401 PolarHBondContact O-N 3.27Å; H324-R401 CarbonylContact C-O 3.53Å; H324-R401 WeakPolarHBondContact CA-O 3.32Å; K325-R401 PolarHBondContact N-O 2.84Å
402	V	86.6	Confident	82.4	Confident	0 Å²	0	82 Å²	82	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	130.4	179.1	-177.3	0	0	0	0	107.8	K325 L333 F335 I374 E381 G382 Y384	K325-V402 WeakPolarHBondContact O-CA 3.39Å; L333-V402 HydrophobicContact CD1-CG1 3.79Å; L333-V402 HydrophobicContact CD1-CG2 4.42Å; F335-V402 HydrophobicContact CE2-CG2 3.85Å; F335-V402 HydrophobicContact CZ-CG2 3.49Å; F335-V402 VanDerWaalsContact CZ-CG2 3.49Å; I374-V402 HydrophobicContact CD1-CG1 4.32Å; I374-V402 HydrophobicContact CD1-CG2 4.04Å; E381-V402 WeakPolarHBondContact CG-O 3.5Å; G382-V402 PolarHBondContact N-O 2.79Å; G382-V402 PolarHBondContact O-N 3.45Å; Y384-V402 HydrophobicContact CD2-CG2 3.87Å; Y384-V402 HydrophobicContact CE2-CB 4.4Å; Y384-V402 HydrophobicContact CE2-CG2 4.1Å
403	R	82.6	Confident	82.9	Confident	122 Å²	122	76.9 Å²	76.9	46%	0.46	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	138.3	170	-69.4	-166.6	168.8	174.2	-4.3	109	K325 L326 V327 E381	K325-R403 PolarHBondContact O-N 3.38Å; L326-R403 WeakPolarHBondContact CA-O 3.41Å; L326-R403 HydrophobicContact CD1-CB 3.92Å; V327-R403 PolarHBondContact N-O 3Å; E381-R403 WeakPolarHBondContact OE1-CG 3.06Å
404	V	74.8	Confident	83.1	Confident	12 Å²	12	70.9 Å²	70.9	7%	0.073	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	133.4	-179.8	-174.5	0	0	0	0	109.6	V327 E329 A376 N377 E381 F406	V327-V404 CarbonylContact O-C 3.51Å; V327-V404 VanDerWaalsContact O-CA 3.31Å; V327-V404 WeakPolarHBondContact O-CA 3.46Å; E329-V404 HydrophobicContact CB-CG1 3.84Å; E329-V404 HydrophobicContact CG-CG1 4.4Å; A376-V404 HydrophobicContact CB-CG2 4.22Å; N377-V404 WeakPolarHBondContact O-CG2 3.49Å; E381-V404 HydrophobicContact CB-CG2 4.46Å; E381-V404 PolarHBondContact OE2-N 2.96Å; V404-F406 HydrophobicContact CB-CE2 4.42Å; V404-F406 HydrophobicContact CB-CZ 4.3Å; V404-F406 HydrophobicContact CG1-CE1 4.25Å; V404-F406 HydrophobicContact CG1-CZ 4.27Å
405	R	78.8	Confident	83	Confident	155 Å²	155	70.7 Å²	70.7	59%	0.585	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	110.9	167.3	-168.1	-178.2	78.3	179.6	5	106.9	L326 V327 E329	L326-R405 HydrophobicContact CD1-CB 4.13Å; L326-R405 HydrophobicContact CG-CB 4.35Å; V327-R405 PolarHBondContact O-N 3.19Å; E329-R405 PolarHBondContact N-O 3.49Å
406	F	64.1	Low	83	Confident	173 Å²	173	70.2 Å²	70.2	76%	0.759	29%	0.293	S	S	*	.			trans	-70.4	0	169.4	-57.9	-80.3	0	0	0	109.8	E329 A378 V404	E329-F406 WeakPolarHBondContact OE1-CE1 3.31Å; A378-F406 HydrophobicContact CB-CE1 4.36Å; A378-F406 HydrophobicContact CB-CZ 3.95Å; V404-F406 HydrophobicContact CB-CE2 4.42Å; V404-F406 HydrophobicContact CB-CZ 4.3Å; V404-F406 HydrophobicContact CG1-CE1 4.25Å; V404-F406 HydrophobicContact CG1-CZ 4.27Å

Retrieved 406 of 406 residues in 265.9 ms (Link to these results)

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