A0A087XMR1_POEFO Loading...

Vacuolar fusion protein MON1 homolog

Plays an important role in membrane trafficking through the secretory apparatus.

AlphaFold DB , UniProt , Accession A0A087XMR1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 521 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	30.3	Very low	29	Very low	237 Å²	237	139.4 Å²	139.4	100%	1.167	81%	0.812	S	S	*	*				0	144.1	0	-79.8	171.1	165.1	0	0	107.6
2	E	30.5	Very low	28.9	Very low	190 Å²	190	146.1 Å²	146.1	89%	0.888	81%	0.814	S	S	*	*			trans	-61.3	166.4	-178.8	-58.8	105.2	147.9	0	0	112.5
3	G	29	Very low	28.7	Very low	63 Å²	63	145.6 Å²	145.6	65%	0.649	80%	0.801	S	S	*	*			cis	164.7	172.6	-2.9	0	0	0	0	0	111.2
4	E	31.3	Very low	28.7	Very low	196 Å²	196	144.6 Å²	144.6	92%	0.916	79%	0.794	S	S	*	*			trans	52.8	141.7	160.7	-47.3	-165.8	138.8	0	0	119
5	T	31.8	Very low	28.3	Very low	138 Å²	138	138.5 Å²	138.5	85%	0.847	78%	0.778	S	S	*	*			cis	-145.1	-178.8	15.5	54	0	0	0	0	108.5
6	G	27.2	Very low	28.1	Very low	63 Å²	63	139.9 Å²	139.9	65%	0.649	78%	0.782	S	S	*	*			cis	140.7	140.3	-7.1	0	0	0	0	0	113.3
7	K	30.1	Very low	28.1	Very low	219 Å²	219	141.3 Å²	141.3	95%	0.952	79%	0.786	S	S	*	*			trans	75.2	153.8	180	-55.4	177.7	179.5	176.9	0	116.7
8	A	28.3	Very low	28	Very low	81 Å²	81	138.8 Å²	138.8	67%	0.669	79%	0.787	S	S	*	*			cis	-171.9	146.8	-28.2	0	0	0	0	0	105.7
9	T	27.5	Very low	28.4	Very low	126 Å²	126	138 Å²	138	77%	0.773	79%	0.788	S	S	*	*				-169.3	128.5	82.1	37	0	0	0	0	109.8
10	V	28.1	Very low	28.5	Very low	130 Å²	130	138.5 Å²	138.5	79%	0.788	79%	0.793	S	S	*	*				65.2	123.8	94.6	178.7	0	0	0	0	111.7
11	S	25.3	Very low	28.6	Very low	90 Å²	90	139.2 Å²	139.2	63%	0.629	79%	0.794	S	S	*	*				-175	140.3	66.3	96.9	0	0	0	0	115
12	W	27.1	Very low	28.5	Very low	220 Å²	220	138.5 Å²	138.5	83%	0.833	78%	0.779	S	S	*	*			trans	47.2	145.2	157.8	-49.5	81.7	0	0	0	119
13	E	27.1	Very low	28.5	Very low	140 Å²	140	136.5 Å²	136.5	65%	0.654	77%	0.774	S	S	*	*			cis	-165.5	170.5	-10.8	-125.3	-163.4	-155.9	0	0	106.4
14	N	28	Very low	28.3	Very low	131 Å²	131	143.9 Å²	143.9	70%	0.701	78%	0.782	S	S	*	*			cis	-149.8	174.8	-6	-158.1	-31.9	0	0	0	107.5
15	G	23.4	Very low	28.3	Very low	54 Å²	54	139.3 Å²	139.3	56%	0.557	77%	0.771	S	S	*	*			trans	174.2	165	170.1	0	0	0	0	0	115.9
16	L	25.5	Very low	28.1	Very low	161 Å²	161	140.2 Å²	140.2	84%	0.843	77%	0.771	S	S	*	*			trans	77.9	104.7	172.7	-67.7	116.7	0	0	0	119.8
17	L	28.1	Very low	28.2	Very low	163 Å²	163	148 Å²	148	85%	0.853	78%	0.781	S	S	*	*				46.2	114.8	112	-73.2	162.5	0	0	0	120.3
18	A	26.4	Very low	28.2	Very low	96 Å²	96	142.5 Å²	142.5	79%	0.793	78%	0.776	S	S	*	*			trans	-152.6	174.8	146.9	0	0	0	0	0	108.8
19	P	34.7	Very low	28.2	Very low	124 Å²	124	146.3 Å²	146.3	81%	0.805	79%	0.785	S	S	*	*				-118	169.4	-91.1	35.3	-21.1	0	0	0	114.4
20	V	31.4	Very low	28.3	Very low	147 Å²	147	145.5 Å²	145.5	89%	0.891	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-81	121.3	175.9	177.9	0	0	0	0	110.5
21	D	29.2	Very low	28.5	Very low	154 Å²	154	145.1 Å²	145.1	82%	0.824	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-89.8	157	177	-130.1	-32.6	0	0	0	113.1
22	R	28.4	Very low	28.7	Very low	223 Å²	223	147.3 Å²	147.3	84%	0.842	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-83.8	157	-173.7	-61.5	165.7	170.5	170.9	-4.1	111.4
23	L	29.8	Very low	28.9	Very low	148 Å²	148	142.5 Å²	142.5	78%	0.775	79%	0.792	S	S	*	*				-170.9	124.6	123.6	-100.8	160.4	0	0	0	114.7
24	R	26.2	Very low	28.9	Very low	218 Å²	218	139.2 Å²	139.2	82%	0.823	80%	0.796	S	S	*	*			trans	37.1	120.4	148.7	-74.5	173.7	-177.2	167.3	0	122.3
25	S	31.2	Very low	28.9	Very low	100 Å²	100	140.9 Å²	140.9	70%	0.699	80%	0.804	S	S	*	*			trans	-64.2	128.9	147.1	149.8	0	0	0	0	111.2
26	D	27.3	Very low	29.1	Very low	156 Å²	156	145.2 Å²	145.2	83%	0.834	82%	0.819	S	S	*	*			trans	-123.3	123.9	150.7	-83.3	-46.9	0	0	0	108.8
27	R	29.7	Very low	29.2	Very low	227 Å²	227	146.4 Å²	146.4	86%	0.857	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-91.2	127.3	173	-74.1	176.2	170.1	167.7	-4.6	107.7
28	A	29.5	Very low	29.2	Very low	103 Å²	103	142.3 Å²	142.3	85%	0.851	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-80.9	128.8	169.3	0	0	0	0	0	109.9
29	D	27.9	Very low	29.2	Very low	162 Å²	162	144.2 Å²	144.2	87%	0.866	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-69.4	141.8	179.7	-69.6	-57	0	0	0	112.6
30	S	30.5	Very low	29	Very low	108 Å²	108	147.3 Å²	147.3	76%	0.755	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-92.9	136.6	169.7	44.2	0	0	0	0	110.8
31	P	31.4	Very low	28.9	Very low	123 Å²	123	146.3 Å²	146.3	80%	0.799	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-75.3	133.6	-177.4	29.6	-34.2	0	0	0	112.1	P33	P31-P33 WeakPolarHBondContact O-CD 3.48Å
32	T	29.1	Very low	28.8	Very low	136 Å²	136	142.9 Å²	142.9	83%	0.834	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-74.2	127.1	-179.8	-30.5	0	0	0	0	112.2
33	P	33	Very low	28.7	Very low	119 Å²	119	137 Å²	137	77%	0.773	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-77.7	132.5	162.1	-11.2	28.7	0	0	0	110.2	P31	P31-P33 WeakPolarHBondContact O-CD 3.48Å
34	G	26.5	Very low	28.5	Very low	71 Å²	71	133.9 Å²	133.9	73%	0.732	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-70.8	159.1	178.8	0	0	0	0	0	114
35	L	26.8	Very low	28.6	Very low	166 Å²	166	132.7 Å²	132.7	87%	0.869	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-58.1	137.6	176.3	-80.3	69.7	0	0	0	112.2
36	V	28.7	Very low	28.4	Very low	144 Å²	144	137 Å²	137	87%	0.873	84%	0.836	S	S	*	*			trans	-133.2	122.8	145.5	-177.7	0	0	0	0	107.5
37	E	27.3	Very low	28.2	Very low	187 Å²	187	134.5 Å²	134.5	87%	0.874	83%	0.831	S	S	*	*			trans	-72.4	144.7	175.3	-76.3	174	119.1	0	0	111.7
38	G	28.6	Very low	28	Very low	77 Å²	77	127.5 Å²	127.5	79%	0.794	82%	0.821	S	S	*	*			trans	178.1	78.6	-179.7	0	0	0	0	0	111.6
39	T	27.1	Very low	27.7	Very low	136 Å²	136	129.1 Å²	129.1	83%	0.834	82%	0.815	S	S	*	*			trans	-69.5	140.2	-179.9	46.9	0	0	0	0	113.2
40	E	29.9	Very low	27.6	Very low	189 Å²	189	130.2 Å²	130.2	88%	0.883	81%	0.812	S	S	*	*				-157.6	152.6	116.2	-108.2	-175.4	-156.8	0	0	111.5
41	P	28.2	Very low	27.2	Very low	125 Å²	125	134.8 Å²	134.8	81%	0.812	81%	0.814	S	S	*	*			trans	-106.7	148.9	-161.9	38.7	-32.2	0	0	0	114.2
42	G	27.6	Very low	26.9	Very low	83 Å²	83	137.4 Å²	137.4	86%	0.856	82%	0.815	S	S	*	*			trans	154.8	48	166.6	0	0	0	0	0	118.2
43	A	27.3	Very low	26.9	Very low	99 Å²	99	135.1 Å²	135.1	82%	0.818	80%	0.801	S	S	*	*			trans	-129.2	93.8	170.6	0	0	0	0	0	110.7	Q45	A43-Q45 PolarHBondContact O-N 3.38Å
44	G	24.9	Very low	26.7	Very low	83 Å²	83	136.9 Å²	136.9	86%	0.856	80%	0.799	S	S	*	*			trans	-65.3	124	170.8	0	0	0	0	0	110.4
45	Q	27.7	Very low	27	Very low	192 Å²	192	135.1 Å²	135.1	90%	0.897	78%	0.775	S	S	*	*			trans	-63	137.8	172.9	-65.2	175	-32.9	0	0	110.5	A43	A43-Q45 PolarHBondContact O-N 3.38Å
46	Q	26.4	Very low	27.6	Very low	190 Å²	190	129.4 Å²	129.4	89%	0.888	74%	0.743	S	S	*	*			trans	-150.9	114.4	148.8	-117.1	166.1	25.6	0	0	112.5
47	S	24.1	Very low	28.1	Very low	105 Å²	105	125.5 Å²	125.5	73%	0.734	72%	0.715	S	S	*	*			trans	43.3	91.9	159.2	58.9	0	0	0	0	118
48	A	25.5	Very low	28.4	Very low	79 Å²	79	121.9 Å²	121.9	65%	0.653	70%	0.702	S	S	*	*			trans	-70.6	129.3	152.3	0	0	0	0	0	110.1	F50	A48-F50 HydrophobicContact CB-CD2 3.91Å; A48-F50 HydrophobicContact CB-CE2 3.62Å; A48-F50 HydrophobicContact CB-CZ 4.5Å
49	I	23.3	Very low	28.7	Very low	138 Å²	138	123.2 Å²	123.2	71%	0.708	69%	0.69	S	S	*	*			trans	-122.9	101.9	158.1	-62.5	-179.4	0	0	0	105.9	Y51	I49-Y51 HydrophobicContact CG2-CD2 3.8Å; I49-Y51 HydrophobicContact CG2-CE2 3.65Å
50	F	25.2	Very low	29	Very low	184 Å²	184	121.2 Å²	121.2	81%	0.807	68%	0.678	S	S	*	*			trans	-88.8	105	174.1	-70.8	-82.5	0	0	0	109.1	A48	A48-F50 HydrophobicContact CB-CD2 3.91Å; A48-F50 HydrophobicContact CB-CE2 3.62Å; A48-F50 HydrophobicContact CB-CZ 4.5Å
51	Y	23.2	Very low	29	Very low	205 Å²	205	117.7 Å²	117.7	80%	0.804	67%	0.669	S	S	*	*			trans	-90.3	112.6	152	-78.5	-79.8	0	0	0	107.5	I49 T53	I49-Y51 HydrophobicContact CG2-CD2 3.8Å; I49-Y51 HydrophobicContact CG2-CE2 3.65Å; Y51-T53 VanDerWaalsContact C-N 3.29Å; Y51-T53 PolarHBondContact O-N 3.24Å
52	H	25.1	Very low	29.4	Very low	177 Å²	177	121 Å²	121	82%	0.819	67%	0.674	S	S	*	*			trans	-84.3	75.2	-178.6	-153.4	39.5	0	0	0	109.4
53	T	28.6	Very low	29.3	Very low	88 Å²	88	121.6 Å²	121.6	54%	0.54	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-77.3	128.3	151.6	50.7	0	0	0	0	107.1	Y51 S55	Y51-T53 VanDerWaalsContact C-N 3.29Å; Y51-T53 PolarHBondContact O-N 3.24Å; T53-S55 PolarHBondContact O-N 3Å
54	Q	28.6	Very low	29.3	Very low	156 Å²	156	120.4 Å²	120.4	73%	0.729	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-58.7	133.6	173.4	-72.1	173.5	-24.6	0	0	108.6
55	S	32.4	Very low	29.6	Very low	34 Å²	34	125.9 Å²	125.9	24%	0.238	67%	0.672	C	S	.	*	P	Polyproline II helix	trans	-71	140.3	-178.6	-169	0	0	0	0	109.8	T53 E57 D58	T53-S55 PolarHBondContact O-N 3Å; S55-E57 PolarHBondContact O-N 3.05Å; S55-E57 VanDerWaalsContact O-N 3.11Å; S55-D58 PolarHBondContact O-N 3.33Å
56	Y	40	Very low	29.5	Very low	46 Å²	46	125.5 Å²	125.5	18%	0.18	67%	0.67	C	S	.	*	G	3₁₀ helix	trans	-63.1	-18.6	-179	-112.6	-72.4	0	0	0	114.2	L306	Y56-L306 PolarHBondContact OH-O 3.2Å
57	E	39.7	Very low	29.5	Very low	62 Å²	62	121.3 Å²	121.3	29%	0.29	67%	0.667	S	S	.	*	G	3₁₀ helix	trans	-79.5	-23.7	-174.3	-65.3	175.4	178	0	0	112.8	S55 L59 T60 K417 K419	S55-E57 PolarHBondContact O-N 3.05Å; S55-E57 VanDerWaalsContact O-N 3.11Å; E57-L59 PolarHBondContact O-N 2.82Å; E57-T60 PolarHBondContact O-N 3.23Å; E57-T60 PolarHBondContact O-OG1 3.5Å; E57-K417 WeakPolarHBondContact OE1-CE 3.47Å; E57-K417 IonicContact OE1-NZ 3.32Å; E57-K417 PolarHBondContact OE1-NZ 2.73Å; E57-K419 IonicContact OE1-NZ 3.27Å; E57-K419 PolarHBondContact OE1-NZ 2.9Å; E57-K419 IonicContact OE2-NZ 3.84Å; E57-K419 PolarHBondContact OE2-NZ 2.87Å
58	D	32.6	Very low	29.6	Very low	112 Å²	112	125.3 Å²	125.3	60%	0.599	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-72.8	-8.8	-174.8	-63	-35.9	0	0	0	113.5	S55 T60 T61	S55-D58 PolarHBondContact O-N 3.33Å; D58-T60 VanDerWaalsContact C-N 3.26Å; D58-T60 PolarHBondContact O-N 3.1Å; D58-T61 PolarHBondContact O-OG1 3.32Å
59	L	34.5	Very low	29.7	Very low	105 Å²	105	133.4 Å²	133.4	55%	0.55	69%	0.688	S	S	.	*	G	3₁₀ helix	trans	-86.4	12.5	175.2	-64.1	174	0	0	0	114.1	E57 K337	E57-L59 PolarHBondContact O-N 2.82Å; L59-K337 PolarHBondContact O-NZ 3.28Å; L59-K337 VanDerWaalsContact O-NZ 3.1Å
60	T	33.8	Very low	29.8	Very low	94 Å²	94	131.1 Å²	131.1	58%	0.577	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-110.2	-8.5	179.3	63.9	0	0	0	0	114.5	E57 D58 E62	E57-T60 PolarHBondContact O-N 3.23Å; E57-T60 PolarHBondContact O-OG1 3.5Å; D58-T60 VanDerWaalsContact C-N 3.26Å; D58-T60 PolarHBondContact O-N 3.1Å; T60-E62 PolarHBondContact O-N 2.99Å
61	T	30.5	Very low	30	Very low	114 Å²	114	128.6 Å²	128.6	70%	0.699	69%	0.692	S	S	*	*	S	Bend	trans	-73.4	117.2	165.7	50.5	0	0	0	0	109.3	D58 A63	D58-T61 PolarHBondContact O-OG1 3.32Å; T61-A63 PolarHBondContact O-N 3.25Å
62	E	36.4	Very low	30.2	Very low	194 Å²	194	122.6 Å²	122.6	91%	0.907	69%	0.693	S	S	*	*			trans	-57.8	100.1	179.1	-65	170.9	157.5	0	0	110.9	T60	T60-E62 PolarHBondContact O-N 2.99Å
63	A	26.1	Very low	30.4	Very low	97 Å²	97	119.8 Å²	119.8	80%	0.802	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-79.5	124.1	162.9	0	0	0	0	0	108	T61	T61-A63 PolarHBondContact O-N 3.25Å
64	G	27.6	Very low	30.7	Very low	73 Å²	73	123 Å²	123	75%	0.753	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-61.2	155.7	-174.6	0	0	0	0	0	113.9	E66	G64-E66 PolarHBondContact O-N 3.2Å
65	E	30.9	Very low	30.8	Very low	199 Å²	199	123.5 Å²	123.5	93%	0.93	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-66.6	116.8	-178	-57.9	175.1	138.6	0	0	112.1
66	E	24.3	Very low	31.1	Very low	183 Å²	183	125.5 Å²	125.5	86%	0.855	73%	0.728	S	S	*	*			trans	-128.5	88.6	155.6	-75.7	-162.6	162.5	0	0	109.8	G64 Q68	G64-E66 PolarHBondContact O-N 3.2Å; E66-Q68 PolarHBondContact O-N 3.37Å
67	A	28.3	Very low	31.2	Very low	102 Å²	102	125.8 Å²	125.8	84%	0.843	74%	0.74	S	S	*	*			trans	-78.1	108.2	175.7	0	0	0	0	0	111.1
68	Q	25.8	Very low	31	Very low	189 Å²	189	131.3 Å²	131.3	88%	0.883	77%	0.766	S	S	*	*			trans	-79.3	123.8	167.4	-68.3	-172	0.3	0	0	110.3	E66	E66-Q68 PolarHBondContact O-N 3.37Å
69	R	26.7	Very low	31.2	Very low	250 Å²	250	132.4 Å²	132.4	94%	0.943	77%	0.767	S	S	*	*			trans	-72.5	132.8	-179.4	-67	176.3	174.7	173.2	-3.5	111.5
70	A	26	Very low	31.4	Very low	90 Å²	90	129.4 Å²	129.4	74%	0.744	75%	0.752	S	S	*	*			trans	-104.4	151.3	158.5	0	0	0	0	0	109.5
71	P	28.9	Very low	31.6	Very low	131 Å²	131	128.8 Å²	128.8	85%	0.851	74%	0.742	S	S	*	*			trans	-75.4	143.5	-174	31.3	-34.9	0	0	0	111.9
72	G	27.9	Very low	32	Very low	79 Å²	79	130.7 Å²	130.7	81%	0.814	74%	0.743	S	S	*	*			trans	-83.1	164	-176.5	0	0	0	0	0	114.7
73	S	28.4	Very low	32.3	Very low	117 Å²	117	125.8 Å²	125.8	82%	0.818	72%	0.72	S	S	*	*			trans	-134.3	102.1	160.2	55	0	0	0	0	107.1
74	D	35.9	Very low	32.9	Very low	156 Å²	156	124.2 Å²	124.2	83%	0.834	70%	0.695	S	S	*	*			trans	-70.4	128.7	173	-71.9	-41	0	0	0	109.6
75	D	30	Very low	33.2	Very low	167 Å²	167	125.5 Å²	125.5	89%	0.893	69%	0.685	S	S	*	*			trans	167.1	14.6	150.5	-93.1	-12.3	0	0	0	114.2
76	S	38.9	Very low	33.4	Very low	75 Å²	75	119.3 Å²	119.3	52%	0.524	67%	0.668	S	S	.	*			trans	-95.7	-13.3	-177.9	72.2	0	0	0	0	116.4	E78 H79 D80	S76-E78 PolarHBondContact O-N 3.09Å; S76-H79 WeakPolarHBondContact O-CB 3.31Å; S76-H79 PolarHBondContact O-N 3.44Å; S76-D80 PolarHBondContact O-N 2.99Å
77	A	41.4	Very low	34.2	Very low	53 Å²	53	116 Å²	116	44%	0.438	66%	0.656	S	S	.	*	H	α-helix	trans	-71.6	-32.6	-162.2	0	0	0	0	0	115.5	H79	A77-H79 VanDerWaalsContact C-N 3.31Å
78	E	35.5	Very low	34.7	Very low	178 Å²	178	115.1 Å²	115.1	83%	0.832	64%	0.64	S	S	*	*	H	α-helix	trans	-73.5	-26.9	174.3	-65.4	-169.2	156.7	0	0	111.6	S76 E82	S76-E78 PolarHBondContact O-N 3.09Å; E78-E82 PolarHBondContact O-N 3.12Å
79	H	37.1	Very low	34.9	Very low	135 Å²	135	108.6 Å²	108.6	63%	0.625	62%	0.623	S	S	*	*	H	α-helix	trans	-73.7	-40.7	179.2	-130.8	-68.7	0	0	0	112.2	S76 A77 E82 E83	S76-H79 WeakPolarHBondContact O-CB 3.31Å; S76-H79 PolarHBondContact O-N 3.44Å; A77-H79 VanDerWaalsContact C-N 3.31Å; H79-E82 PolarHBondContact O-N 3.24Å; H79-E83 VanDerWaalsContact O-CB 3.25Å; H79-E83 WeakPolarHBondContact O-CB 3.49Å; H79-E83 PolarHBondContact O-N 3.45Å
80	D	38.9	Very low	35.3	Very low	41 Å²	41	105.4 Å²	105.4	22%	0.219	62%	0.619	C	S	.	*	H	α-helix	trans	-69.3	-32.8	179.3	-73.1	-39.1	0	0	0	112.5	S76 F84 R366	S76-D80 PolarHBondContact O-N 2.99Å; D80-F84 PolarHBondContact O-N 2.95Å; D80-R366 IonicContact OD1-NH1 3.81Å; D80-R366 IonicContact OD1-NH2 3.66Å
81	E	38.8	Very low	35.4	Very low	82 Å²	82	110.4 Å²	110.4	38%	0.383	62%	0.624	S	S	.	*	H	α-helix	trans	-70	-36.5	175.7	-81.3	-166.2	-174.7	0	0	112.1	N85 K225	E81-N85 PolarHBondContact O-ND2 3.27Å; E81-K225 IonicContact OE1-NZ 2.78Å
82	E	38.1	Very low	35.6	Very low	154 Å²	154	110.3 Å²	110.3	72%	0.72	63%	0.627	S	S	*	*	H	α-helix	trans	-76.1	-38.2	175.2	-69.8	-163.4	153.9	0	0	112.6	E78 H79 N85 A86	E78-E82 PolarHBondContact O-N 3.12Å; H79-E82 PolarHBondContact O-N 3.24Å; E82-N85 PolarHBondContact O-N 3.46Å; E82-A86 PolarHBondContact O-N 3.05Å
83	E	43.7	Very low	35.5	Very low	91 Å²	91	111 Å²	111	43%	0.425	63%	0.625	S	S	.	*	H	α-helix	trans	-70	-34.9	-177	-169.2	165.5	-128.9	0	0	112.7	H79 A86 L87 R366	H79-E83 VanDerWaalsContact O-CB 3.25Å; H79-E83 WeakPolarHBondContact O-CB 3.49Å; H79-E83 PolarHBondContact O-N 3.45Å; E83-A86 WeakPolarHBondContact O-CB 3.47Å; E83-A86 PolarHBondContact O-N 3.2Å; E83-L87 PolarHBondContact O-N 3.04Å; E83-L87 VanDerWaalsContact O-N 3.14Å; E83-R366 IonicContact OE2-NH1 3.45Å; E83-R366 PolarHBondContact OE2-NH1 3.4Å
84	F	38.5	Very low	35.8	Very low	63 Å²	63	115.5 Å²	115.5	28%	0.276	63%	0.629	S	S	.	*	H	α-helix	trans	-64	-42.9	170.6	-172.8	-95.5	0	0	0	111.8	D80 A86 L87 V88 L233	D80-F84 PolarHBondContact O-N 2.95Å; F84-A86 VanDerWaalsContact C-N 3.28Å; F84-A86 PolarHBondContact O-N 3.14Å; F84-L87 PolarHBondContact O-N 3.06Å; F84-V88 HydrophobicContact CD1-CG2 4.23Å; F84-V88 HydrophobicContact CE1-CG2 3.83Å; F84-V88 HydrophobicContact CZ-CG2 4.09Å; F84-V88 WeakPolarHBondContact O-CG2 3.47Å; F84-V88 PolarHBondContact O-N 3.18Å; F84-V88 VanDerWaalsContact O-N 3.07Å; F84-L233 VanDerWaalsContact CE1-O 3.23Å; F84-L233 WeakPolarHBondContact CE1-O 3.43Å; F84-L233 WeakPolarHBondContact CZ-O 3.36Å
85	N	34	Very low	35.4	Very low	100 Å²	100	114.8 Å²	114.8	54%	0.535	62%	0.621	S	S	.	*	H	α-helix	trans	-66.3	-29.1	175.2	-78.4	-65.8	0	0	0	112.6	E81 E82 G89	E81-N85 PolarHBondContact O-ND2 3.27Å; E82-N85 PolarHBondContact O-N 3.46Å; N85-G89 WeakPolarHBondContact O-CA 3.27Å; N85-G89 PolarHBondContact O-N 3.34Å
86	A	35.3	Very low	35.5	Very low	70 Å²	70	117 Å²	117	58%	0.579	62%	0.617	S	S	*	*	H	α-helix	trans	-68.7	-37.4	173.9	0	0	0	0	0	112.5	E82 E83 F84 G89	E82-A86 PolarHBondContact O-N 3.05Å; E83-A86 WeakPolarHBondContact O-CB 3.47Å; E83-A86 PolarHBondContact O-N 3.2Å; F84-A86 VanDerWaalsContact C-N 3.28Å; F84-A86 PolarHBondContact O-N 3.14Å; A86-G89 PolarHBondContact O-N 3.31Å
87	L	39.4	Very low	35	Very low	113 Å²	113	122 Å²	122	59%	0.592	64%	0.637	S	S	*	*	H	α-helix	trans	-74.5	-30.1	175.8	-75	165.9	0	0	0	113.5	E83 F84 G89	E83-L87 PolarHBondContact O-N 3.04Å; E83-L87 VanDerWaalsContact O-N 3.14Å; F84-L87 PolarHBondContact O-N 3.06Å; L87-G89 VanDerWaalsContact C-N 3.26Å
88	V	38.8	Very low	34.4	Very low	84 Å²	84	126.9 Å²	126.9	51%	0.509	66%	0.656	S	S	.	*	S	Bend	trans	-83.2	-5.4	172.1	-178.4	0	0	0	0	111.6	F84 E90	F84-V88 HydrophobicContact CD1-CG2 4.23Å; F84-V88 HydrophobicContact CE1-CG2 3.83Å; F84-V88 HydrophobicContact CZ-CG2 4.09Å; F84-V88 WeakPolarHBondContact O-CG2 3.47Å; F84-V88 PolarHBondContact O-N 3.18Å; F84-V88 VanDerWaalsContact O-N 3.07Å; V88-E90 PolarHBondContact O-N 2.9Å
89	G	30.4	Very low	34.2	Very low	52 Å²	52	123 Å²	123	54%	0.536	65%	0.648	S	S	.	*			trans	-81.8	16.5	-172.4	0	0	0	0	0	117.6	N85 A86 L87 K91	N85-G89 WeakPolarHBondContact O-CA 3.27Å; N85-G89 PolarHBondContact O-N 3.34Å; A86-G89 PolarHBondContact O-N 3.31Å; L87-G89 VanDerWaalsContact C-N 3.26Å; G89-K91 PolarHBondContact O-N 2.83Å; G89-K91 VanDerWaalsContact O-N 3.17Å
90	E	35.2	Very low	33.8	Very low	183 Å²	183	123.9 Å²	123.9	86%	0.855	66%	0.657	S	S	*	*			trans	-87	88	179.6	-69.2	-142.8	126.6	0	0	113.7	V88	V88-E90 PolarHBondContact O-N 2.9Å
91	K	29.4	Very low	33.5	Very low	194 Å²	194	127.4 Å²	127.4	84%	0.843	68%	0.681	S	S	*	*			trans	36.5	107	153.2	-69.6	175.4	-176.9	163.4	0	118.1	G89 A93	G89-K91 PolarHBondContact O-N 2.83Å; G89-K91 VanDerWaalsContact O-N 3.17Å; K91-A93 PolarHBondContact O-N 3.12Å
92	S	32.1	Very low	33.2	Very low	130 Å²	130	127.1 Å²	127.1	91%	0.909	69%	0.688	S	S	*	*			trans	-56.8	88.4	160.8	48.5	0	0	0	0	114
93	A	26.1	Very low	33.2	Very low	94 Å²	94	123.6 Å²	123.6	78%	0.777	68%	0.68	S	S	*	*			trans	-94.8	85.6	167.1	0	0	0	0	0	110.6	K91 E95	K91-A93 PolarHBondContact O-N 3.12Å; A93-E95 PolarHBondContact O-N 2.94Å
94	K	33.7	Very low	33.2	Very low	210 Å²	210	123.6 Å²	123.6	91%	0.913	68%	0.68	S	S	*	*			trans	-67.6	99.4	163	-84.3	-176.4	174.2	177.6	0	109
95	E	28.4	Very low	33.2	Very low	141 Å²	141	124.9 Å²	124.9	66%	0.659	70%	0.697	S	S	*	*			trans	-161.9	117.4	143.4	-110	-173.7	154	0	0	114.2	A93	A93-E95 PolarHBondContact O-N 2.94Å
96	R	32.4	Very low	33.7	Very low	213 Å²	213	128.6 Å²	128.6	80%	0.804	70%	0.704	S	S	*	*			trans	54.4	83.5	148.1	-56	171.6	-156.3	-156.1	8.6	118.5
97	L	28	Very low	34.7	Very low	181 Å²	181	127.6 Å²	127.6	95%	0.948	69%	0.69	S	S	*	*			trans	-109.1	130.7	135.6	-82.8	101.2	0	0	0	109.7
98	N	28	Very low	35.8	Very low	155 Å²	155	124.8 Å²	124.8	83%	0.829	67%	0.673	S	S	*	*			trans	-121.3	150.1	177.4	-148.4	4.6	0	0	0	108.8
99	S	32.4	Very low	37.3	Very low	97 Å²	97	129.1 Å²	129.1	68%	0.678	69%	0.688	S	S	*	*	S	Bend	trans	53.5	82.8	177.1	58.1	0	0	0	0	117.5
100	N	28.9	Very low	39.8	Very low	153 Å²	153	129 Å²	129	82%	0.818	67%	0.673	S	S	*	*	S	Bend		-178.9	-8.4	110	-89.4	-1.9	0	0	0	114.8	S102	N100-S102 PolarHBondContact O-N 2.81Å
101	T	32.7	Very low	42.1	Very low	116 Å²	116	124.7 Å²	124.7	71%	0.712	66%	0.656	S	S	*	*			trans	-99.1	42.3	-176.9	-14.6	0	0	0	0	113.9
102	S	30.8	Very low	44.9	Very low	75 Å²	75	116.9 Å²	116.9	52%	0.524	63%	0.625	S	S	.	*			trans	-92.6	7.9	-168.3	59.4	0	0	0	0	116.2	N100 R106	N100-S102 PolarHBondContact O-N 2.81Å; S102-R106 WeakPolarHBondContact O-CD 3.24Å; S102-R106 PolarHBondContact O-NE 3.42Å
103	S	38.7	Very low	47.6	Very low	80 Å²	80	114.2 Å²	114.2	56%	0.559	61%	0.606	S	S	*	*	S	Bend	trans	-90	-43.6	-179.5	43.7	0	0	0	0	113.6	S105 R106	S103-S105 PolarHBondContact O-N 3.16Å; S103-R106 PolarHBondContact O-N 2.93Å
104	E	43.3	Very low	50.6	Low	92 Å²	92	111.1 Å²	111.1	43%	0.43	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-72.4	-30.8	-167.1	-65.4	-179.5	149.2	0	0	114.1	R106 T107	E104-R106 PolarHBondContact O-N 3.32Å; E104-T107 PolarHBondContact O-OG1 2.95Å
105	S	39.9	Very low	53.2	Low	90 Å²	90	108.6 Å²	108.6	63%	0.629	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-73.4	-10.8	176.7	82.9	0	0	0	0	113.4	S103	S103-S105 PolarHBondContact O-N 3.16Å
106	R	43.3	Very low	56.2	Low	178 Å²	178	104.8 Å²	104.8	67%	0.672	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-90.7	-15.3	-175	-66.6	-179.1	173.8	179.7	-0.9	113.8	S102 S103 E104	S102-R106 WeakPolarHBondContact O-CD 3.24Å; S102-R106 PolarHBondContact O-NE 3.42Å; S103-R106 PolarHBondContact O-N 2.93Å; E104-R106 PolarHBondContact O-N 3.32Å
107	T	57.1	Low	59.1	Low	48 Å²	48	95.7 Å²	95.7	29%	0.294	53%	0.528	S	S	.	.	S	Bend	trans	-80.2	-25	-176.7	50.9	0	0	0	0	113.6	E104 Y138 G139	E104-T107 PolarHBondContact O-OG1 2.95Å; T107-Y138 HydrophobicContact CG2-CD1 4.28Å; T107-Y138 HydrophobicContact CG2-CE1 4.3Å; T107-G139 PolarHBondContact O-N 2.92Å
108	K	63.2	Low	62	Low	55 Å²	55	93.7 Å²	93.7	24%	0.239	51%	0.508	C	S	.	.	S	Bend	trans	-86.2	-23.7	178.8	-63.1	-169.6	-178	178.3	0	113.5	E110 G139 T140 D242	K108-E110 VanDerWaalsContact C-N 3.32Å; K108-G139 CarbonylContact O-C 3.22Å; K108-G139 WeakPolarHBondContact O-CA 3.38Å; K108-T140 VanDerWaalsContact O-CG2 3.24Å; K108-T140 WeakPolarHBondContact O-CG2 3.42Å; K108-D242 IonicContact NZ-OD2 2.83Å; K108-D242 PolarHBondContact NZ-OD2 3.06Å; K108-D242 VanDerWaalsContact NZ-OD2 3.13Å
109	E	68.3	Low	65	Low	175 Å²	175	91.1 Å²	91.1	82%	0.818	49%	0.494	S	S	*	.	S	Bend	trans	-88.5	10	175	-63.8	-172.5	164.2	0	0	113.7
110	E	82.9	Confident	67.8	Low	48 Å²	48	88.5 Å²	88.5	22%	0.224	47%	0.472	C	S	.	.	S	Bend	trans	-70.6	142.1	179.8	-170.4	176.1	-159.1	0	0	112.5	K108 V112 W117 H120	K108-E110 VanDerWaalsContact C-N 3.32Å; E110-V112 PolarHBondContact O-N 3.33Å; E110-W117 HydrophobicContact CG-CB 4.19Å; E110-W117 WeakPolarHBondContact OE1-CA 3.41Å; E110-W117 PolarHBondContact OE1-N 3.12Å; E110-H120 IonicContact OE1-NE2 3.61Å; E110-H120 IonicContact OE2-CD2 3.89Å; E110-H120 IonicContact OE2-CE1 3.77Å; E110-H120 IonicContact OE2-NE2 2.88Å; E110-H120 PolarHBondContact OE2-NE2 2.89Å
111	D	84.9	Confident	70.7	Confident	93 Å²	93	87.6 Å²	87.6	50%	0.497	46%	0.46	S	S	.	.			trans	-67.3	102.7	171.8	174.7	10.5	0	0	0	110.8	S113 S114 W117	D111-S113 VanDerWaalsContact CG-OG 3.27Å; D111-S113 PolarHBondContact O-N 2.91Å; D111-S113 VanDerWaalsContact O-N 3.11Å; D111-S113 WeakPolarHBondContact OD1-CA 3.4Å; D111-S113 VanDerWaalsContact OD1-CB 3.28Å; D111-S113 WeakPolarHBondContact OD1-CB 3.47Å; D111-S113 PolarHBondContact OD1-N 2.87Å; D111-S113 PolarHBondContact OD1-OG 3.41Å; D111-S113 PolarHBondContact OD2-OG 3.03Å; D111-S114 WeakPolarHBondContact O-CB 3.32Å; D111-S114 PolarHBondContact O-N 2.95Å; D111-S114 PolarHBondContact O-OG 3.21Å; D111-W117 WeakPolarHBondContact O-CB 3.45Å
112	V	88.6	Confident	73.5	Confident	31 Å²	31	82.3 Å²	82.3	19%	0.188	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-14.9	178.8	-57.6	0	0	0	0	114.1	E110 W117 A143 L144	E110-V112 PolarHBondContact O-N 3.33Å; V112-W117 HydrophobicContact CB-CD2 4.29Å; V112-A143 HydrophobicContact CG1-CB 4.2Å; V112-A143 HydrophobicContact CG2-CB 3.96Å; V112-L144 HydrophobicContact CB-CD2 4.23Å; V112-L144 HydrophobicContact CB-CG 4.45Å; V112-L144 HydrophobicContact CG1-CD1 4.07Å; V112-L144 HydrophobicContact CG1-CD2 4.29Å; V112-L144 HydrophobicContact CG1-CG 4.03Å
113	S	87	Confident	76.6	Confident	74 Å²	74	79.3 Å²	79.3	52%	0.517	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-23.6	175.1	79.2	0	0	0	0	112.7	D111 R118	D111-S113 VanDerWaalsContact CG-OG 3.27Å; D111-S113 PolarHBondContact O-N 2.91Å; D111-S113 VanDerWaalsContact O-N 3.11Å; D111-S113 WeakPolarHBondContact OD1-CA 3.4Å; D111-S113 VanDerWaalsContact OD1-CB 3.28Å; D111-S113 WeakPolarHBondContact OD1-CB 3.47Å; D111-S113 PolarHBondContact OD1-N 2.87Å; D111-S113 PolarHBondContact OD1-OG 3.41Å; D111-S113 PolarHBondContact OD2-OG 3.03Å; S113-R118 PolarHBondContact O-NE 3.25Å; S113-R118 VanDerWaalsContact O-NE 3.1Å
114	S	90.5	Very high	79.4	Confident	29 Å²	29	75.5 Å²	75.5	20%	0.203	38%	0.379	C	S	.	.	S	Bend	trans	-65.4	155.7	-171.1	74.3	0	0	0	0	114.4	D111 A116 W117 R118	D111-S114 WeakPolarHBondContact O-CB 3.32Å; D111-S114 PolarHBondContact O-N 2.95Å; D111-S114 PolarHBondContact O-OG 3.21Å; S114-A116 PolarHBondContact O-N 2.93Å; S114-W117 PolarHBondContact OG-N 3.01Å; S114-R118 VanDerWaalsContact O-CG 3.26Å; S114-R118 WeakPolarHBondContact O-CG 3.36Å; S114-R118 PolarHBondContact O-N 3.4Å
115	E	88.9	Confident	82	Confident	157 Å²	157	71.4 Å²	71.4	73%	0.734	36%	0.359	S	S	*	.	H	α-helix	trans	-66.1	-28.1	171.2	-66.7	-171.6	171.7	0	0	112.6	R118 N119	E115-R118 PolarHBondContact O-N 3.25Å; E115-N119 WeakPolarHBondContact O-CB 3.4Å; E115-N119 PolarHBondContact O-N 2.88Å; E115-N119 PolarHBondContact O-ND2 3.4Å
116	A	90.8	Very high	84.7	Confident	60 Å²	60	67.1 Å²	67.1	50%	0.496	33%	0.329	S	S	.	.	H	α-helix	trans	-63	-54.2	177.3	0	0	0	0	0	110.9	S114 R118 N119 H120	S114-A116 PolarHBondContact O-N 2.93Å; A116-R118 VanDerWaalsContact C-N 3.31Å; A116-R118 PolarHBondContact O-N 3.18Å; A116-N119 WeakPolarHBondContact O-CA 3.47Å; A116-N119 PolarHBondContact O-N 2.63Å; A116-H120 PolarHBondContact O-N 2.86Å
117	W	92.6	Very high	87.3	Confident	23 Å²	23	58.6 Å²	58.6	9%	0.087	30%	0.297	C	S	.	.	H	α-helix	trans	-56.1	-47.6	175.6	-178	90.9	0	0	0	110.8	E110 D111 V112 S114 N119 H120 H123 F125 Y138 L144	E110-W117 HydrophobicContact CG-CB 4.19Å; E110-W117 WeakPolarHBondContact OE1-CA 3.41Å; E110-W117 PolarHBondContact OE1-N 3.12Å; D111-W117 WeakPolarHBondContact O-CB 3.45Å; V112-W117 HydrophobicContact CB-CD2 4.29Å; S114-W117 PolarHBondContact OG-N 3.01Å; W117-N119 PolarHBondContact O-N 3.48Å; W117-N119 VanDerWaalsContact O-N 3.08Å; W117-H120 PolarHBondContact O-CD2 3.16Å; W117-H120 PolarHBondContact O-N 3.01Å; W117-H123 AromaticContact CD2-CE1 3.6Å; W117-H123 AromaticContact CE2-CE1 3.47Å; W117-H123 VanDerWaalsContact CE2-CE1 3.47Å; W117-H123 AromaticContact CE2-ND1 3.64Å; W117-H123 AromaticContact CE3-CE1 3.81Å; W117-H123 AromaticContact CH2-CE1 3.77Å; W117-H123 AromaticContact CH2-ND1 3.83Å; W117-H123 AromaticContact CZ2-CE1 3.56Å; W117-H123 AromaticContact CZ2-ND1 3.41Å; W117-H123 WeakPolarHBondContact CZ2-ND1 3.47Å; W117-H123 AromaticContact CZ3-CE1 3.89Å; W117-H123 PolarHBondContact O-CE1 3.29Å; W117-H123 PolarHBondContact O-NE2 2.92Å; W117-F125 HydrophobicContact CH2-CE1 4.38Å; W117-F125 HydrophobicContact CH2-CZ 4.05Å; W117-F125 HydrophobicContact CZ2-CE1 4.14Å; W117-F125 HydrophobicContact CZ2-CZ 4.12Å; W117-Y138 PolarHBondContact NE1-O 2.98Å; W117-L144 HydrophobicContact CH2-CD2 3.68Å; W117-L144 HydrophobicContact CZ2-CD1 3.86Å; W117-L144 HydrophobicContact CZ2-CD2 3.52Å; W117-L144 HydrophobicContact CZ2-CG 4.33Å
118	R	89.8	Confident	89.1	Confident	138 Å²	138	56.4 Å²	56.4	52%	0.521	28%	0.284	S	S	.	.	H	α-helix	trans	-61.7	-17.7	177.5	-68.4	171.1	-173.6	-79.3	-5.4	113.9	S113 S114 E115 A116 K190	S113-R118 PolarHBondContact O-NE 3.25Å; S113-R118 VanDerWaalsContact O-NE 3.1Å; S114-R118 VanDerWaalsContact O-CG 3.26Å; S114-R118 WeakPolarHBondContact O-CG 3.36Å; S114-R118 PolarHBondContact O-N 3.4Å; E115-R118 PolarHBondContact O-N 3.25Å; A116-R118 VanDerWaalsContact C-N 3.31Å; A116-R118 PolarHBondContact O-N 3.18Å; R118-K190 WeakPolarHBondContact O-CE 3.18Å; R118-K190 PolarHBondContact O-NZ 3.4Å
119	N	90.1	Very high	90.4	Very high	101 Å²	101	58.1 Å²	58.1	54%	0.54	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	3.5	-176.9	-76.9	-29.2	0	0	0	114.3	E115 A116 W117 K121 K190	E115-N119 WeakPolarHBondContact O-CB 3.4Å; E115-N119 PolarHBondContact O-N 2.88Å; E115-N119 PolarHBondContact O-ND2 3.4Å; A116-N119 WeakPolarHBondContact O-CA 3.47Å; A116-N119 PolarHBondContact O-N 2.63Å; W117-N119 PolarHBondContact O-N 3.48Å; W117-N119 VanDerWaalsContact O-N 3.08Å; N119-K121 PolarHBondContact O-N 3.48Å; N119-K190 PolarHBondContact OD1-NZ 3.19Å
120	H	91.6	Very high	91.5	Very high	43 Å²	43	52.2 Å²	52.2	20%	0.199	27%	0.274	C	S	.	.			trans	-53.5	139.9	165	-73.5	-52.1	0	0	0	111.1	E110 A116 W117 K122 Y138	E110-H120 IonicContact OE1-NE2 3.61Å; E110-H120 IonicContact OE2-CD2 3.89Å; E110-H120 IonicContact OE2-CE1 3.77Å; E110-H120 IonicContact OE2-NE2 2.88Å; E110-H120 PolarHBondContact OE2-NE2 2.89Å; A116-H120 PolarHBondContact O-N 2.86Å; W117-H120 PolarHBondContact O-CD2 3.16Å; W117-H120 PolarHBondContact O-N 3.01Å; H120-K122 PolarHBondContact O-N 3.44Å; H120-Y138 HydrophobicContact CB-CD2 3.92Å; H120-Y138 HydrophobicContact CB-CE2 3.66Å; H120-Y138 AromaticContact CD2-CD2 3.48Å; H120-Y138 VanDerWaalsContact CD2-CD2 3.48Å; H120-Y138 WeakPolarHBondContact CD2-CD2 3.36Å; H120-Y138 AromaticContact CD2-CE2 3.87Å; H120-Y138 AromaticContact CD2-CG 3.64Å; H120-Y138 AromaticContact CG-CD2 3.66Å; H120-Y138 AromaticContact CG-CE2 3.55Å; H120-Y138 AromaticContact CG-CZ 3.99Å; H120-Y138 AromaticContact ND1-CE2 3.99Å; H120-Y138 AromaticContact ND1-CZ 3.94Å; H120-Y138 AromaticContact NE2-CD1 3.95Å; H120-Y138 AromaticContact NE2-CG 3.87Å
121	K	89.6	Confident	91.9	Very high	134 Å²	134	50.6 Å²	50.6	58%	0.583	27%	0.27	S	S	*	.	S	Bend	trans	-61	-33.7	-177.6	-62.7	179.4	-173.9	176.6	0	111.9	N119 K190 E440	N119-K121 PolarHBondContact O-N 3.48Å; K121-K190 PolarHBondContact O-N 2.9Å; K121-E440 IonicContact NZ-OE2 3.13Å; K121-E440 PolarHBondContact NZ-OE2 3.01Å
122	K	92.9	Very high	92.3	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.017	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	120.9	-173.7	178.7	173.1	60.2	-172.5	0	113.2	H120 R137 Y138 V188 A189 L198 E201 E249	H120-K122 PolarHBondContact O-N 3.44Å; K122-R137 PolarHBondContact O-NH1 3.2Å; K122-Y138 WeakPolarHBondContact O-CE2 3.37Å; K122-V188 CarbonylContact C-O 3.58Å; K122-V188 WeakPolarHBondContact CA-O 3.18Å; K122-A189 HydrophobicContact CG-CB 4.44Å; K122-L198 HydrophobicContact CD-CD2 3.95Å; K122-E201 VanDerWaalsContact CD-OE2 3.25Å; K122-E201 WeakPolarHBondContact CD-OE2 3.41Å; K122-E201 VanDerWaalsContact CE-OE2 3.29Å; K122-E201 WeakPolarHBondContact CE-OE2 3.47Å; K122-E201 IonicContact NZ-OE1 3.62Å; K122-E201 PolarHBondContact NZ-OE1 3.28Å; K122-E201 IonicContact NZ-OE2 3.58Å; K122-E201 PolarHBondContact NZ-OE2 2.76Å; K122-E249 WeakPolarHBondContact CE-OE1 3.31Å; K122-E249 IonicContact NZ-OE1 3.85Å; K122-E249 PolarHBondContact NZ-OE1 2.98Å; K122-E249 VanDerWaalsContact NZ-OE1 3.15Å
123	H	95	Very high	92.6	Very high	12 Å²	12	48.7 Å²	48.7	6%	0.056	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	153.6	168.6	-55.9	-104.7	0	0	0	111.4	W117 F125 Y138 V188	W117-H123 AromaticContact CD2-CE1 3.6Å; W117-H123 AromaticContact CE2-CE1 3.47Å; W117-H123 VanDerWaalsContact CE2-CE1 3.47Å; W117-H123 AromaticContact CE2-ND1 3.64Å; W117-H123 AromaticContact CE3-CE1 3.81Å; W117-H123 AromaticContact CH2-CE1 3.77Å; W117-H123 AromaticContact CH2-ND1 3.83Å; W117-H123 AromaticContact CZ2-CE1 3.56Å; W117-H123 AromaticContact CZ2-ND1 3.41Å; W117-H123 WeakPolarHBondContact CZ2-ND1 3.47Å; W117-H123 AromaticContact CZ3-CE1 3.89Å; W117-H123 PolarHBondContact O-CE1 3.29Å; W117-H123 PolarHBondContact O-NE2 2.92Å; H123-F125 HydrophobicContact CB-CD2 4.45Å; H123-F125 HydrophobicContact CB-CE1 4.46Å; H123-F125 HydrophobicContact CB-CE2 3.52Å; H123-F125 HydrophobicContact CB-CZ 3.53Å; H123-Y138 AromaticContact ND1-CD2 3.85Å; H123-V188 HydrophobicContact CB-CB 4.29Å; H123-V188 PolarHBondContact N-O 2.92Å; H123-V188 PolarHBondContact O-N 3.42Å
124	V	97.1	Very high	93	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	137.6	170.9	170.4	0	0	0	0	108.6	Y135 T136 R137 V186 L202 I205 L245	V124-Y135 HydrophobicContact CG1-CD1 4.48Å; V124-Y135 HydrophobicContact CG1-CE1 4.28Å; V124-T136 WeakPolarHBondContact O-CA 3.46Å; V124-R137 HydrophobicContact CB-CB 4.38Å; V124-R137 PolarHBondContact O-N 3.39Å; V124-V186 WeakPolarHBondContact CA-O 3.43Å; V124-L202 HydrophobicContact CG1-CD2 4.29Å; V124-I205 HydrophobicContact CB-CD1 4.43Å; V124-I205 HydrophobicContact CG1-CD1 3.55Å; V124-I205 HydrophobicContact CG2-CD1 4.07Å; V124-L245 HydrophobicContact CB-CD1 4.36Å; V124-L245 HydrophobicContact CG2-CD1 4.39Å; V124-L245 HydrophobicContact CG2-CD2 3.9Å
125	F	97.7	Very high	93.3	Very high	5 Å²	5	44.7 Å²	44.7	2%	0.022	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	136	176.6	-49.1	-82.7	0	0	0	109	W117 H123 L144 M148 M151 L185 V186 V188	W117-F125 HydrophobicContact CH2-CE1 4.38Å; W117-F125 HydrophobicContact CH2-CZ 4.05Å; W117-F125 HydrophobicContact CZ2-CE1 4.14Å; W117-F125 HydrophobicContact CZ2-CZ 4.12Å; H123-F125 HydrophobicContact CB-CD2 4.45Å; H123-F125 HydrophobicContact CB-CE1 4.46Å; H123-F125 HydrophobicContact CB-CE2 3.52Å; H123-F125 HydrophobicContact CB-CZ 3.53Å; F125-L144 HydrophobicContact CE1-CD1 4.12Å; F125-L144 HydrophobicContact CE1-CD2 4.33Å; F125-M148 HydrophobicContact CB-CE 4.02Å; F125-M148 HydrophobicContact CB-CG 4.48Å; F125-M148 HydrophobicContact CB-SD 4.4Å; F125-M148 HydrophobicContact CD1-CE 3.84Å; F125-M148 HydrophobicContact CG-CE 4.42Å; F125-M151 HydrophobicContact CB-SD 4.31Å; F125-M151 HydrophobicContact CD2-CE 3.62Å; F125-M151 HydrophobicContact CD2-SD 4.04Å; F125-M151 HydrophobicContact CE2-CE 3.69Å; F125-M151 HydrophobicContact CG-CE 4.21Å; F125-M151 HydrophobicContact CG-SD 4.19Å; F125-M151 HydrophobicContact CZ-CE 4.33Å; F125-L185 WeakPolarHBondContact O-CA 3.44Å; F125-V186 HydrophobicContact CB-CB 4.41Å; F125-V186 HydrophobicContact CD2-CB 4.43Å; F125-V186 PolarHBondContact N-O 2.83Å; F125-V186 PolarHBondContact O-N 3.32Å; F125-V188 HydrophobicContact CD2-CG2 4.3Å; F125-V188 HydrophobicContact CE2-CB 4.43Å; F125-V188 HydrophobicContact CE2-CG2 3.78Å
126	V	97.9	Very high	93.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	134	170.1	-175.6	0	0	0	0	108.1	I134 Y135 L185 I205 I209	V126-I134 HydrophobicContact CB-CB 4.32Å; V126-I134 HydrophobicContact CG1-CB 4.07Å; V126-I134 HydrophobicContact CG1-CD1 4.43Å; V126-I134 HydrophobicContact CG1-CG2 4.16Å; V126-I134 WeakPolarHBondContact O-CA 3.37Å; V126-I134 WeakPolarHBondContact O-CB 3.39Å; V126-I134 PolarHBondContact O-N 3.04Å; V126-Y135 HydrophobicContact CG2-CD1 4.17Å; V126-Y135 PolarHBondContact N-O 2.86Å; V126-Y135 PolarHBondContact O-N 2.84Å; V126-Y135 VanDerWaalsContact O-N 3.17Å; V126-L185 HydrophobicContact CG1-CG 4.15Å; V126-L185 HydrophobicContact CG2-CD2 3.9Å; V126-L185 HydrophobicContact CG2-CG 4.05Å; V126-I205 HydrophobicContact CG2-CG2 3.84Å; V126-I209 HydrophobicContact CG1-CD1 3.78Å; V126-I209 HydrophobicContact CG2-CD1 4.31Å
127	L	96.8	Very high	93.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	156.3	-176.4	59.3	172.8	0	0	0	110.9	K132 M148 M151 M152 V184 V186	L127-K132 CarbonylContact C-O 3.39Å; L127-K132 WeakPolarHBondContact CA-O 3.47Å; L127-K132 VanDerWaalsContact CB-O 3.31Å; L127-K132 WeakPolarHBondContact CB-O 3.2Å; L127-M148 HydrophobicContact CB-SD 3.92Å; L127-M148 HydrophobicContact CD1-CB 3.72Å; L127-M148 HydrophobicContact CD1-CG 4.32Å; L127-M148 WeakPolarHBondContact CD1-O 3.31Å; L127-M151 HydrophobicContact CD1-CB 4.37Å; L127-M152 HydrophobicContact CD1-CG 3.51Å; L127-M152 HydrophobicContact CD1-SD 3.73Å; L127-M152 HydrophobicContact CG-CG 4.3Å; L127-M152 HydrophobicContact CG-SD 3.98Å; L127-V184 HydrophobicContact CD2-CB 4.18Å; L127-V184 HydrophobicContact CD2-CG1 4.16Å; L127-V184 WeakPolarHBondContact CD2-O 3.27Å; L127-V184 HydrophobicContact CG-CB 4.23Å; L127-V184 PolarHBondContact N-O 3.36Å; L127-V184 PolarHBondContact O-N 3.16Å; L127-V184 VanDerWaalsContact O-O 3.05Å; L127-V186 HydrophobicContact CD2-CG2 4.08Å
128	S	95.2	Very high	93.8	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.007	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	165.3	173.3	68.4	0	0	0	0	111.7	A130 G131 K132	S128-A130 PolarHBondContact O-N 3.4Å; S128-A130 VanDerWaalsContact O-N 3.11Å; S128-A130 PolarHBondContact OG-N 3.16Å; S128-G131 WeakPolarHBondContact O-CA 3.37Å; S128-G131 PolarHBondContact O-N 3.19Å; S128-K132 PolarHBondContact N-O 2.94Å; S128-K132 PolarHBondContact OG-N 3Å
129	E	91.6	Very high	93.9	Very high	91 Å²	91	28.6 Å²	28.6	43%	0.425	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-22.8	169	-73.5	172.7	-178.5	0	0	113.5	G131 S181 P182	E129-G131 PolarHBondContact O-N 3.21Å; E129-S181 WeakPolarHBondContact OE1-CA 3.09Å; E129-S181 WeakPolarHBondContact OE1-CB 3.4Å; E129-S181 PolarHBondContact OE1-OG 3.21Å; E129-P182 PolarHBondContact N-O 3.04Å; E129-P182 VanDerWaalsContact N-O 3.11Å
130	A	90.1	Very high	94	Very high	51 Å²	51	26.2 Å²	26.2	42%	0.421	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	4.6	172.1	0	0	0	0	0	113.9	S128 K132	S128-A130 PolarHBondContact O-N 3.4Å; S128-A130 VanDerWaalsContact O-N 3.11Å; S128-A130 PolarHBondContact OG-N 3.16Å; A130-K132 VanDerWaalsContact C-N 3.28Å; A130-K132 PolarHBondContact O-N 3.05Å
131	G	91.1	Very high	94	Very high	14 Å²	14	25.4 Å²	25.4	14%	0.144	13%	0.131	C	C	.	.			trans	72.4	14.8	-178	0	0	0	0	0	115.1	S128 E129 M152	S128-G131 WeakPolarHBondContact O-CA 3.37Å; S128-G131 PolarHBondContact O-N 3.19Å; E129-G131 PolarHBondContact O-N 3.21Å; G131-M152 VanDerWaalsContact CA-CG 3.41Å
132	K	93.3	Very high	94.1	Very high	70 Å²	70	24.6 Å²	24.6	30%	0.304	13%	0.129	S	C	.	.			trans	-77.8	131.9	176.6	-65.8	-167.9	167.1	-159	0	110.4	L127 S128 A130 N227 Y228	L127-K132 CarbonylContact C-O 3.39Å; L127-K132 WeakPolarHBondContact CA-O 3.47Å; L127-K132 VanDerWaalsContact CB-O 3.31Å; L127-K132 WeakPolarHBondContact CB-O 3.2Å; S128-K132 PolarHBondContact N-O 2.94Å; S128-K132 PolarHBondContact OG-N 3Å; A130-K132 VanDerWaalsContact C-N 3.28Å; A130-K132 PolarHBondContact O-N 3.05Å; K132-N227 WeakPolarHBondContact CE-O 3.18Å; K132-N227 PolarHBondContact NZ-O 2.85Å; K132-Y228 WeakPolarHBondContact CD-O 3.19Å
133	P	95.4	Very high	94	Very high	14 Å²	14	26.7 Å²	26.7	9%	0.091	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	138.3	175.9	32.1	-37.4	0	0	0	110.4	E141 M148 R231	P133-E141 HydrophobicContact CB-CB 3.85Å; P133-E141 HydrophobicContact CB-CG 4.27Å; P133-E141 HydrophobicContact CG-CB 4.08Å; P133-E141 WeakPolarHBondContact CG-O 3.45Å; P133-M148 VanDerWaalsContact CA-SD 3.5Å; P133-M148 HydrophobicContact CB-CE 3.87Å; P133-M148 HydrophobicContact CB-SD 3.4Å; P133-M148 WeakPolarHBondContact CB-SD 3.47Å; P133-R231 VanDerWaalsContact O-CD 3.31Å; P133-R231 WeakPolarHBondContact O-CD 3.32Å
134	I	95.6	Very high	93.9	Very high	10 Å²	10	26.2 Å²	26.2	5%	0.051	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	-41.1	-179.3	-64.5	172.3	0	0	0	110.9	V126 L183 L230 R231 L234	V126-I134 HydrophobicContact CB-CB 4.32Å; V126-I134 HydrophobicContact CG1-CB 4.07Å; V126-I134 HydrophobicContact CG1-CD1 4.43Å; V126-I134 HydrophobicContact CG1-CG2 4.16Å; V126-I134 WeakPolarHBondContact O-CA 3.37Å; V126-I134 WeakPolarHBondContact O-CB 3.39Å; V126-I134 PolarHBondContact O-N 3.04Å; I134-L183 HydrophobicContact CD1-CD2 3.45Å; I134-L183 VanDerWaalsContact CD1-CD2 3.45Å; I134-L230 HydrophobicContact CD1-CB 4.15Å; I134-L230 HydrophobicContact CD1-CD2 3.98Å; I134-L230 HydrophobicContact CG1-CB 4.18Å; I134-L230 HydrophobicContact CG2-CB 4.34Å; I134-L230 HydrophobicContact CG2-CD2 4.13Å; I134-R231 WeakPolarHBondContact O-CG 3.47Å; I134-L234 HydrophobicContact CG2-CD1 3.75Å
135	Y	96.4	Very high	93.8	Very high	10 Å²	10	28.8 Å²	28.8	4%	0.039	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	143.4	176.8	168.9	-92.1	0	0	0	110.6	V124 V126 R137 E141 T241 D242 L245	V124-Y135 HydrophobicContact CG1-CD1 4.48Å; V124-Y135 HydrophobicContact CG1-CE1 4.28Å; V126-Y135 HydrophobicContact CG2-CD1 4.17Å; V126-Y135 PolarHBondContact N-O 2.86Å; V126-Y135 PolarHBondContact O-N 2.84Å; V126-Y135 VanDerWaalsContact O-N 3.17Å; Y135-R137 HydrophobicContact CE1-CB 4.47Å; Y135-E141 WeakPolarHBondContact CA-OE1 3.39Å; Y135-T241 HydrophobicContact CD1-CG2 4.15Å; Y135-T241 HydrophobicContact CD2-CG2 4.32Å; Y135-T241 HydrophobicContact CE1-CG2 3.76Å; Y135-T241 HydrophobicContact CE2-CG2 3.94Å; Y135-T241 HydrophobicContact CG-CG2 4.42Å; Y135-D242 VanDerWaalsContact CE2-OD1 3.32Å; Y135-D242 WeakPolarHBondContact CE2-OD1 3.41Å; Y135-D242 PolarHBondContact OH-OD1 3.21Å; Y135-L245 HydrophobicContact CE1-CD1 3.97Å; Y135-L245 WeakPolarHBondContact OH-CD1 3.4Å
136	T	95.7	Very high	93.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	146	163.6	-170.7	0	0	0	0	112	V124 Y138 G139 E141 L144	V124-T136 WeakPolarHBondContact O-CA 3.46Å; T136-Y138 PolarHBondContact OG1-O 2.84Å; T136-G139 VanDerWaalsContact CG2-O 3.32Å; T136-G139 WeakPolarHBondContact CG2-O 3.35Å; T136-E141 PolarHBondContact N-OE1 2.78Å; T136-L144 HydrophobicContact CG2-CD1 3.88Å
137	R	94.1	Very high	93.4	Very high	8 Å²	8	35.4 Å²	35.4	3%	0.03	21%	0.208	C	C	.	.	S	Bend	trans	-70.5	-32.1	177.6	-169.3	-179.5	-173.2	-173	5.4	113.4	K122 V124 Y135 L245 E249	K122-R137 PolarHBondContact O-NH1 3.2Å; V124-R137 HydrophobicContact CB-CB 4.38Å; V124-R137 PolarHBondContact O-N 3.39Å; Y135-R137 HydrophobicContact CE1-CB 4.47Å; R137-L245 HydrophobicContact CB-CD1 4.42Å; R137-L245 HydrophobicContact CG-CD1 4.16Å; R137-E249 IonicContact CZ-OE1 3.57Å; R137-E249 IonicContact CZ-OE2 3.65Å; R137-E249 IonicContact NH1-OE1 3.86Å; R137-E249 PolarHBondContact NH1-OE1 2.94Å; R137-E249 IonicContact NH1-OE2 3.61Å; R137-E249 VanDerWaalsContact NH2-CD 3.3Å; R137-E249 IonicContact NH2-OE1 2.83Å; R137-E249 PolarHBondContact NH2-OE1 3.49Å; R137-E249 IonicContact NH2-OE2 3.63Å; R137-E249 PolarHBondContact NH2-OE2 2.84Å
138	Y	93.8	Very high	93.4	Very high	32 Å²	32	35.4 Å²	35.4	13%	0.125	21%	0.208	C	C	.	.	S	Bend	trans	-142.8	134.7	-172.4	-58	-58.9	0	0	0	110.6	T107 W117 H120 K122 H123 T136 L144	T107-Y138 HydrophobicContact CG2-CD1 4.28Å; T107-Y138 HydrophobicContact CG2-CE1 4.3Å; W117-Y138 PolarHBondContact NE1-O 2.98Å; H120-Y138 HydrophobicContact CB-CD2 3.92Å; H120-Y138 HydrophobicContact CB-CE2 3.66Å; H120-Y138 AromaticContact CD2-CD2 3.48Å; H120-Y138 VanDerWaalsContact CD2-CD2 3.48Å; H120-Y138 WeakPolarHBondContact CD2-CD2 3.36Å; H120-Y138 AromaticContact CD2-CE2 3.87Å; H120-Y138 AromaticContact CD2-CG 3.64Å; H120-Y138 AromaticContact CG-CD2 3.66Å; H120-Y138 AromaticContact CG-CE2 3.55Å; H120-Y138 AromaticContact CG-CZ 3.99Å; H120-Y138 AromaticContact ND1-CE2 3.99Å; H120-Y138 AromaticContact ND1-CZ 3.94Å; H120-Y138 AromaticContact NE2-CD1 3.95Å; H120-Y138 AromaticContact NE2-CG 3.87Å; K122-Y138 WeakPolarHBondContact O-CE2 3.37Å; H123-Y138 AromaticContact ND1-CD2 3.85Å; T136-Y138 PolarHBondContact OG1-O 2.84Å; Y138-L144 VanDerWaalsContact O-CD1 3.28Å; Y138-L144 WeakPolarHBondContact O-CD1 3.23Å
139	G	91.3	Very high	93.4	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	77.6	-169.3	-168.2	0	0	0	0	0	112.8	T107 K108 T136	T107-G139 PolarHBondContact O-N 2.92Å; K108-G139 CarbonylContact O-C 3.22Å; K108-G139 WeakPolarHBondContact O-CA 3.38Å; T136-G139 VanDerWaalsContact CG2-O 3.32Å; T136-G139 WeakPolarHBondContact CG2-O 3.35Å
140	T	91.3	Very high	93.6	Very high	50 Å²	50	37 Å²	37	31%	0.307	23%	0.231	S	C	.	.			trans	-106.2	153	177.2	67.9	0	0	0	0	113.1	K108 E142 A143 L144	K108-T140 VanDerWaalsContact O-CG2 3.24Å; K108-T140 WeakPolarHBondContact O-CG2 3.42Å; T140-E142 VanDerWaalsContact C-N 3.29Å; T140-E142 PolarHBondContact O-N 2.86Å; T140-A143 PolarHBondContact O-N 2.88Å; T140-A143 WeakPolarHBondContact OG1-CB 3.07Å; T140-A143 PolarHBondContact OG1-N 2.88Å; T140-L144 PolarHBondContact O-N 3.06Å; T140-L144 VanDerWaalsContact O-N 3.16Å
141	E	92.4	Very high	93.9	Very high	26 Å²	26	35.7 Å²	35.7	12%	0.121	22%	0.216	C	C	.	.	H	α-helix	trans	-56.6	-40.1	174.7	-72.7	74	-161.2	0	0	112.2	P133 Y135 T136 S145	P133-E141 HydrophobicContact CB-CB 3.85Å; P133-E141 HydrophobicContact CB-CG 4.27Å; P133-E141 HydrophobicContact CG-CB 4.08Å; P133-E141 WeakPolarHBondContact CG-O 3.45Å; Y135-E141 WeakPolarHBondContact CA-OE1 3.39Å; T136-E141 PolarHBondContact N-OE1 2.78Å; E141-S145 PolarHBondContact O-N 3.49Å; E141-S145 VanDerWaalsContact O-N 3.09Å
142	E	90.9	Very high	94.1	Very high	117 Å²	117	35.6 Å²	35.6	55%	0.547	21%	0.212	S	C	.	.	H	α-helix	trans	-62.3	-46.7	175.8	-70.9	71.7	-157.6	0	0	112.1	T140 L144 S145 R231	T140-E142 VanDerWaalsContact C-N 3.29Å; T140-E142 PolarHBondContact O-N 2.86Å; E142-L144 VanDerWaalsContact C-N 3.27Å; E142-L144 PolarHBondContact O-N 2.78Å; E142-S145 VanDerWaalsContact O-CB 3.3Å; E142-S145 WeakPolarHBondContact O-CB 3.16Å; E142-S145 PolarHBondContact O-N 3.27Å; E142-R231 IonicContact OE1-CZ 2.67Å; E142-R231 IonicContact OE1-NH1 2.63Å; E142-R231 PolarHBondContact OE1-NH1 3.01Å; E142-R231 IonicContact OE1-NH2 3.51Å; E142-R231 IonicContact OE2-NH1 2.68Å
143	A	91.6	Very high	94.2	Very high	48 Å²	48	35.1 Å²	35.1	40%	0.397	22%	0.221	S	C	.	.	H	α-helix	trans	-66.5	-32.2	-176.5	0	0	0	0	0	112	V112 T140	V112-A143 HydrophobicContact CG1-CB 4.2Å; V112-A143 HydrophobicContact CG2-CB 3.96Å; T140-A143 PolarHBondContact O-N 2.88Å; T140-A143 WeakPolarHBondContact OG1-CB 3.07Å; T140-A143 PolarHBondContact OG1-N 2.88Å
144	L	93.6	Very high	94.3	Very high	3 Å²	3	38 Å²	38	2%	0.016	24%	0.236	C	C	.	.	H	α-helix	trans	-95.6	-0.8	-177.4	-71.3	158.7	0	0	0	114.1	V112 W117 F125 T136 Y138 T140 E142 S146 T147 M148	V112-L144 HydrophobicContact CB-CD2 4.23Å; V112-L144 HydrophobicContact CB-CG 4.45Å; V112-L144 HydrophobicContact CG1-CD1 4.07Å; V112-L144 HydrophobicContact CG1-CD2 4.29Å; V112-L144 HydrophobicContact CG1-CG 4.03Å; W117-L144 HydrophobicContact CH2-CD2 3.68Å; W117-L144 HydrophobicContact CZ2-CD1 3.86Å; W117-L144 HydrophobicContact CZ2-CD2 3.52Å; W117-L144 HydrophobicContact CZ2-CG 4.33Å; F125-L144 HydrophobicContact CE1-CD1 4.12Å; F125-L144 HydrophobicContact CE1-CD2 4.33Å; T136-L144 HydrophobicContact CG2-CD1 3.88Å; Y138-L144 VanDerWaalsContact O-CD1 3.28Å; Y138-L144 WeakPolarHBondContact O-CD1 3.23Å; T140-L144 PolarHBondContact O-N 3.06Å; T140-L144 VanDerWaalsContact O-N 3.16Å; E142-L144 VanDerWaalsContact C-N 3.27Å; E142-L144 PolarHBondContact O-N 2.78Å; L144-S146 VanDerWaalsContact C-N 3.27Å; L144-S146 PolarHBondContact O-N 3.3Å; L144-T147 WeakPolarHBondContact O-CA 3.27Å; L144-T147 WeakPolarHBondContact O-CB 3.26Å; L144-T147 PolarHBondContact O-N 2.67Å; L144-M148 HydrophobicContact CB-CE 4.44Å; L144-M148 PolarHBondContact O-N 2.94Å
145	S	93.8	Very high	94.2	Very high	54 Å²	54	37.6 Å²	37.6	38%	0.378	23%	0.233	S	C	.	.	H	α-helix	trans	-50.1	-42.4	178.8	-179.8	0	0	0	0	113.4	E141 E142 T147 M148 G149	E141-S145 PolarHBondContact O-N 3.49Å; E141-S145 VanDerWaalsContact O-N 3.09Å; E142-S145 VanDerWaalsContact O-CB 3.3Å; E142-S145 WeakPolarHBondContact O-CB 3.16Å; E142-S145 PolarHBondContact O-N 3.27Å; S145-T147 PolarHBondContact O-N 2.89Å; S145-M148 PolarHBondContact O-N 2.85Å; S145-G149 PolarHBondContact O-N 2.75Å
146	S	94.3	Very high	94.2	Very high	88 Å²	88	39.9 Å²	39.9	62%	0.615	25%	0.251	S	S	*	.	H	α-helix	trans	-66.1	-37.8	177.1	59.8	0	0	0	0	113.1	L144 G149 V150	L144-S146 VanDerWaalsContact C-N 3.27Å; L144-S146 PolarHBondContact O-N 3.3Å; S146-G149 PolarHBondContact O-N 3.15Å; S146-V150 WeakPolarHBondContact O-CG2 3.39Å; S146-V150 PolarHBondContact O-N 2.67Å; S146-V150 VanDerWaalsContact O-N 3.16Å
147	T	94.2	Very high	94.2	Very high	57 Å²	57	46.5 Å²	46.5	35%	0.35	28%	0.28	S	S	.	.	H	α-helix	trans	-71	-41.8	178.2	-62.8	0	0	0	0	110.8	L144 S145 G149 V150 M151	L144-T147 WeakPolarHBondContact O-CA 3.27Å; L144-T147 WeakPolarHBondContact O-CB 3.26Å; L144-T147 PolarHBondContact O-N 2.67Å; S145-T147 PolarHBondContact O-N 2.89Å; T147-G149 VanDerWaalsContact C-N 3.35Å; T147-V150 PolarHBondContact O-N 2.86Å; T147-M151 HydrophobicContact CG2-CE 3.88Å; T147-M151 WeakPolarHBondContact O-CG 3.48Å; T147-M151 PolarHBondContact O-N 2.94Å
148	M	95.6	Very high	94.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-64.1	-37.6	173.4	-70.9	-159.9	-157.2	0	0	112.1	F125 L127 P133 L144 S145 V150 M151 M152	F125-M148 HydrophobicContact CB-CE 4.02Å; F125-M148 HydrophobicContact CB-CG 4.48Å; F125-M148 HydrophobicContact CB-SD 4.4Å; F125-M148 HydrophobicContact CD1-CE 3.84Å; F125-M148 HydrophobicContact CG-CE 4.42Å; L127-M148 HydrophobicContact CB-SD 3.92Å; L127-M148 HydrophobicContact CD1-CB 3.72Å; L127-M148 HydrophobicContact CD1-CG 4.32Å; L127-M148 WeakPolarHBondContact CD1-O 3.31Å; P133-M148 VanDerWaalsContact CA-SD 3.5Å; P133-M148 HydrophobicContact CB-CE 3.87Å; P133-M148 HydrophobicContact CB-SD 3.4Å; P133-M148 WeakPolarHBondContact CB-SD 3.47Å; L144-M148 HydrophobicContact CB-CE 4.44Å; L144-M148 PolarHBondContact O-N 2.94Å; S145-M148 PolarHBondContact O-N 2.85Å; M148-V150 VanDerWaalsContact C-N 3.34Å; M148-V150 PolarHBondContact O-N 3.32Å; M148-M151 WeakPolarHBondContact O-CB 3.49Å; M148-M151 PolarHBondContact O-N 3.48Å; M148-M151 VanDerWaalsContact O-N 3.16Å; M148-M152 PolarHBondContact O-N 2.64Å
149	G	95.4	Very high	94.2	Very high	34 Å²	34	49.6 Å²	49.6	35%	0.351	30%	0.298	S	S	.	.	H	α-helix	trans	-60	-39.7	171.5	0	0	0	0	0	113.4	S145 S146 T147 M152 A153	S145-G149 PolarHBondContact O-N 2.75Å; S146-G149 PolarHBondContact O-N 3.15Å; T147-G149 VanDerWaalsContact C-N 3.35Å; G149-M152 PolarHBondContact O-N 3.39Å; G149-A153 PolarHBondContact O-N 3.14Å
150	V	95.8	Very high	94.4	Very high	92 Å²	92	53.6 Å²	53.6	56%	0.558	33%	0.331	S	S	*	.	H	α-helix	trans	-66.7	-39.3	172.9	174.1	0	0	0	0	111.5	S146 T147 M148 M152 A153 L154	S146-V150 WeakPolarHBondContact O-CG2 3.39Å; S146-V150 PolarHBondContact O-N 2.67Å; S146-V150 VanDerWaalsContact O-N 3.16Å; T147-V150 PolarHBondContact O-N 2.86Å; M148-V150 VanDerWaalsContact C-N 3.34Å; M148-V150 PolarHBondContact O-N 3.32Å; V150-M152 PolarHBondContact O-N 3.35Å; V150-A153 PolarHBondContact O-N 3.16Å; V150-L154 WeakPolarHBondContact O-CG 3.43Å; V150-L154 PolarHBondContact O-N 2.94Å; V150-L154 VanDerWaalsContact O-N 3.08Å
151	M	96.1	Very high	94.5	Very high	22 Å²	22	57.8 Å²	57.8	11%	0.108	35%	0.347	C	S	.	.	H	α-helix	trans	-60.3	-44.4	175.3	-69.6	169.9	177.1	0	0	111.8	F125 L127 T147 M148 L154 V155 F177 V186	F125-M151 HydrophobicContact CB-SD 4.31Å; F125-M151 HydrophobicContact CD2-CE 3.62Å; F125-M151 HydrophobicContact CD2-SD 4.04Å; F125-M151 HydrophobicContact CE2-CE 3.69Å; F125-M151 HydrophobicContact CG-CE 4.21Å; F125-M151 HydrophobicContact CG-SD 4.19Å; F125-M151 HydrophobicContact CZ-CE 4.33Å; L127-M151 HydrophobicContact CD1-CB 4.37Å; T147-M151 HydrophobicContact CG2-CE 3.88Å; T147-M151 WeakPolarHBondContact O-CG 3.48Å; T147-M151 PolarHBondContact O-N 2.94Å; M148-M151 WeakPolarHBondContact O-CB 3.49Å; M148-M151 PolarHBondContact O-N 3.48Å; M148-M151 VanDerWaalsContact O-N 3.16Å; M151-L154 PolarHBondContact O-N 3.17Å; M151-V155 WeakPolarHBondContact O-CG2 3.26Å; M151-V155 PolarHBondContact O-N 3.07Å; M151-V155 VanDerWaalsContact O-N 3.16Å; M151-F177 HydrophobicContact CB-CE1 4.46Å; M151-V186 HydrophobicContact CB-CG2 4.38Å; M151-V186 HydrophobicContact CE-CG1 4.24Å; M151-V186 HydrophobicContact SD-CB 4.05Å; M151-V186 HydrophobicContact SD-CG1 4.03Å; M151-V186 HydrophobicContact SD-CG2 4.07Å
152	M	95.8	Very high	94.5	Very high	12 Å²	12	66.3 Å²	66.3	6%	0.059	38%	0.383	C	S	.	.	H	α-helix	trans	-64.2	-41.2	173.2	-75.3	-44.4	-59.4	0	0	112.9	L127 G131 M148 G149 V150 L154 V155 S156 V184	L127-M152 HydrophobicContact CD1-CG 3.51Å; L127-M152 HydrophobicContact CD1-SD 3.73Å; L127-M152 HydrophobicContact CG-CG 4.3Å; L127-M152 HydrophobicContact CG-SD 3.98Å; G131-M152 VanDerWaalsContact CA-CG 3.41Å; M148-M152 PolarHBondContact O-N 2.64Å; G149-M152 PolarHBondContact O-N 3.39Å; V150-M152 PolarHBondContact O-N 3.35Å; M152-L154 PolarHBondContact O-N 3.39Å; M152-V155 HydrophobicContact CE-CB 4.36Å; M152-V155 HydrophobicContact CE-CG1 4.31Å; M152-V155 PolarHBondContact O-N 3.11Å; M152-S156 PolarHBondContact O-N 2.68Å; M152-S156 PolarHBondContact O-OG 3.49Å; M152-V184 HydrophobicContact CE-CG2 3.79Å; M152-V184 HydrophobicContact SD-CB 3.78Å; M152-V184 HydrophobicContact SD-CG1 4.09Å; M152-V184 HydrophobicContact SD-CG2 3.61Å
153	A	96.3	Very high	94.7	Very high	61 Å²	61	65.4 Å²	65.4	50%	0.504	38%	0.382	S	S	.	.	H	α-helix	trans	-58.3	-36.2	178.4	0	0	0	0	0	112	G149 V150 F157	G149-A153 PolarHBondContact O-N 3.14Å; V150-A153 PolarHBondContact O-N 3.16Å; A153-F157 WeakPolarHBondContact O-CB 3.27Å; A153-F157 PolarHBondContact O-N 2.87Å
154	L	95.7	Very high	94.7	Very high	75 Å²	75	68 Å²	68	39%	0.393	39%	0.388	S	S	.	.	H	α-helix	trans	-67.6	-43.5	173	-66.9	171.8	0	0	0	112.6	V150 M151 M152 V158 I165 I168	V150-L154 WeakPolarHBondContact O-CG 3.43Å; V150-L154 PolarHBondContact O-N 2.94Å; V150-L154 VanDerWaalsContact O-N 3.08Å; M151-L154 PolarHBondContact O-N 3.17Å; M152-L154 PolarHBondContact O-N 3.39Å; L154-V158 WeakPolarHBondContact O-CG2 3.43Å; L154-V158 PolarHBondContact O-N 3.45Å; L154-I165 HydrophobicContact CB-CD1 4.43Å; L154-I168 HydrophobicContact CD1-CD1 4.16Å
155	V	95.3	Very high	94.8	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-60.4	-56	176.4	173.3	0	0	0	0	110.4	M151 M152 F157 V158 E159 I165 F177 V184	M151-V155 WeakPolarHBondContact O-CG2 3.26Å; M151-V155 PolarHBondContact O-N 3.07Å; M151-V155 VanDerWaalsContact O-N 3.16Å; M152-V155 HydrophobicContact CE-CB 4.36Å; M152-V155 HydrophobicContact CE-CG1 4.31Å; M152-V155 PolarHBondContact O-N 3.11Å; V155-F157 VanDerWaalsContact C-N 3.29Å; V155-F157 PolarHBondContact O-N 3.38Å; V155-V158 PolarHBondContact O-N 2.94Å; V155-V158 VanDerWaalsContact O-N 3.14Å; V155-E159 HydrophobicContact CG1-CG 4.34Å; V155-E159 WeakPolarHBondContact CG1-OE1 3.23Å; V155-E159 WeakPolarHBondContact O-CG 3.35Å; V155-E159 PolarHBondContact O-N 2.7Å; V155-I165 HydrophobicContact CB-CG2 4.23Å; V155-I165 HydrophobicContact CG2-CG2 3.7Å; V155-F177 HydrophobicContact CG2-CD1 3.64Å; V155-F177 HydrophobicContact CG2-CE1 3.93Å; V155-V184 HydrophobicContact CG2-CG1 4.24Å
156	S	94.8	Very high	94.8	Very high	58 Å²	58	75 Å²	75	41%	0.406	41%	0.408	S	S	.	.	H	α-helix	trans	-64	-30.4	-178.1	-56	0	0	0	0	113.5	M152 A160	M152-S156 PolarHBondContact O-N 2.68Å; M152-S156 PolarHBondContact O-OG 3.49Å; S156-A160 WeakPolarHBondContact O-CB 3.42Å; S156-A160 PolarHBondContact O-N 2.87Å
157	F	95.9	Very high	94.8	Very high	140 Å²	140	72.5 Å²	72.5	61%	0.614	39%	0.39	S	S	*	.	H	α-helix	trans	-64.2	-44.5	173.8	178.2	-93.4	0	0	0	111.8	A153 V155 A160	A153-F157 WeakPolarHBondContact O-CB 3.27Å; A153-F157 PolarHBondContact O-N 2.87Å; V155-F157 VanDerWaalsContact C-N 3.29Å; V155-F157 PolarHBondContact O-N 3.38Å; F157-A160 PolarHBondContact O-N 2.74Å
158	V	95.1	Very high	94.9	Very high	28 Å²	28	72.7 Å²	72.7	17%	0.17	39%	0.388	C	S	.	.	H	α-helix	trans	-73.3	-35.3	179.1	178.3	0	0	0	0	111.4	L154 V155 A160 E161 N163 I165	L154-V158 WeakPolarHBondContact O-CG2 3.43Å; L154-V158 PolarHBondContact O-N 3.45Å; V155-V158 PolarHBondContact O-N 2.94Å; V155-V158 VanDerWaalsContact O-N 3.14Å; V158-A160 VanDerWaalsContact C-N 3.32Å; V158-A160 PolarHBondContact O-N 3.13Å; V158-E161 PolarHBondContact O-N 3.29Å; V158-N163 CarbonylContact C-O 3.51Å; V158-N163 HydrophobicContact CG1-CB 3.79Å; V158-N163 PolarHBondContact O-N 3.48Å; V158-I165 HydrophobicContact CB-CB 4.25Å; V158-I165 HydrophobicContact CG1-CB 4.25Å; V158-I165 HydrophobicContact CG2-CB 4.24Å
159	E	93.6	Very high	94.8	Very high	77 Å²	77	77.5 Å²	77.5	36%	0.36	41%	0.411	S	S	.	.	H	α-helix	trans	-65.8	-31.4	174.9	-73.3	174	167.7	0	0	112.9	V155 E161 K162 N163	V155-E159 HydrophobicContact CG1-CG 4.34Å; V155-E159 WeakPolarHBondContact CG1-OE1 3.23Å; V155-E159 WeakPolarHBondContact O-CG 3.35Å; V155-E159 PolarHBondContact O-N 2.7Å; E159-E161 PolarHBondContact O-N 3.24Å; E159-K162 WeakPolarHBondContact O-CA 3.44Å; E159-K162 PolarHBondContact O-N 2.76Å; E159-N163 WeakPolarHBondContact CA-O 3.2Å
160	A	94.1	Very high	94.5	Very high	84 Å²	84	78.5 Å²	78.5	69%	0.694	42%	0.415	S	S	*	.	H	α-helix	trans	-61	-28	173.6	0	0	0	0	0	112.9	S156 F157 V158 K162	S156-A160 WeakPolarHBondContact O-CB 3.42Å; S156-A160 PolarHBondContact O-N 2.87Å; F157-A160 PolarHBondContact O-N 2.74Å; V158-A160 VanDerWaalsContact C-N 3.32Å; V158-A160 PolarHBondContact O-N 3.13Å; A160-K162 VanDerWaalsContact C-N 3.25Å; A160-K162 PolarHBondContact O-N 3.04Å
161	E	94.5	Very high	93.9	Very high	137 Å²	137	82.5 Å²	82.5	64%	0.64	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	8.1	172.9	-59.3	-169.1	158.7	0	0	113.2	V158 E159 N163	V158-E161 PolarHBondContact O-N 3.29Å; E159-E161 PolarHBondContact O-N 3.24Å; E161-N163 PolarHBondContact O-N 3.49Å
162	K	92.8	Very high	93.3	Very high	206 Å²	206	84.6 Å²	84.6	90%	0.896	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	33	-172.6	-54.3	-178.5	179.9	-179	0	113.4	E159 A160	E159-K162 WeakPolarHBondContact O-CA 3.44Å; E159-K162 PolarHBondContact O-N 2.76Å; A160-K162 VanDerWaalsContact C-N 3.25Å; A160-K162 PolarHBondContact O-N 3.04Å
163	N	94.4	Very high	93	Very high	98 Å²	98	85.5 Å²	85.5	52%	0.524	47%	0.468	S	S	.	.			trans	-117.4	168.2	176.8	-165.4	6.3	0	0	0	109.8	V158 E159 E161	V158-N163 CarbonylContact C-O 3.51Å; V158-N163 HydrophobicContact CG1-CB 3.79Å; V158-N163 PolarHBondContact O-N 3.48Å; E159-N163 WeakPolarHBondContact CA-O 3.2Å; E161-N163 PolarHBondContact O-N 3.49Å
164	I	92.5	Very high	92.9	Very high	101 Å²	101	84.8 Å²	84.8	52%	0.518	45%	0.454	S	S	.	.			trans	-124.3	122.9	-179.7	-60.6	171.7	0	0	0	108.5	R166	I164-R166 PolarHBondContact O-N 2.99Å
165	I	94.8	Very high	92.9	Very high	20 Å²	20	82.7 Å²	82.7	10%	0.103	44%	0.444	C	S	.	.			trans	-68.4	124.2	172.5	-167.7	168.5	0	0	0	109.5	L154 V155 V158 I168 F177	L154-I165 HydrophobicContact CB-CD1 4.43Å; V155-I165 HydrophobicContact CB-CG2 4.23Å; V155-I165 HydrophobicContact CG2-CG2 3.7Å; V158-I165 HydrophobicContact CB-CB 4.25Å; V158-I165 HydrophobicContact CG1-CB 4.25Å; V158-I165 HydrophobicContact CG2-CB 4.24Å; I165-I168 HydrophobicContact CD1-CD1 3.95Å; I165-I168 HydrophobicContact CD1-CG1 4.03Å; I165-F177 HydrophobicContact CD1-CD2 4.05Å; I165-F177 HydrophobicContact CD1-CE2 3.73Å; I165-F177 HydrophobicContact CD1-CZ 4.04Å; I165-F177 HydrophobicContact CG1-CD2 3.92Å; I165-F177 HydrophobicContact CG1-CE2 4.11Å; I165-F177 HydrophobicContact CG1-CG 4.42Å; I165-F177 HydrophobicContact CG2-CB 4.08Å; I165-F177 HydrophobicContact CG2-CD1 4.11Å; I165-F177 HydrophobicContact CG2-CD2 4.27Å; I165-F177 HydrophobicContact CG2-CG 3.91Å
166	R	94.1	Very high	93	Very high	186 Å²	186	82.9 Å²	82.9	70%	0.702	45%	0.445	S	S	*	.			trans	-104.7	-49.7	179.3	-67	-179.4	179.2	-101.2	-1.8	111.4	I164 F177	I164-R166 PolarHBondContact O-N 2.99Å; R166-F177 PolarHBondContact O-N 3.36Å
167	S	95.1	Very high	93.1	Very high	34 Å²	34	80.5 Å²	80.5	24%	0.238	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	154.3	-178.2	55.3	0	0	0	0	112.8	H169 V175 E195	S167-H169 PolarHBondContact OG-CE1 3.11Å; S167-V175 CarbonylContact C-O 3.2Å; S167-V175 WeakPolarHBondContact CA-O 3.45Å; S167-V175 WeakPolarHBondContact CB-O 3.3Å; S167-E195 VanDerWaalsContact CB-OE2 3.25Å; S167-E195 WeakPolarHBondContact CB-OE2 3.39Å; S167-E195 PolarHBondContact OG-OE2 2.95Å
168	I	94.8	Very high	93.2	Very high	62 Å²	62	74.5 Å²	74.5	32%	0.318	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	137.5	169.7	-55.3	169.5	0	0	0	107.5	L154 I165 V175 F177	L154-I168 HydrophobicContact CD1-CD1 4.16Å; I165-I168 HydrophobicContact CD1-CD1 3.95Å; I165-I168 HydrophobicContact CD1-CG1 4.03Å; I168-V175 HydrophobicContact CB-CB 4.22Å; I168-V175 PolarHBondContact N-O 2.83Å; I168-V175 PolarHBondContact O-N 3.31Å; I168-F177 HydrophobicContact CD1-CE2 3.76Å; I168-F177 HydrophobicContact CD1-CZ 4.03Å; I168-F177 HydrophobicContact CG1-CE2 3.96Å
169	H	93.1	Very high	93.2	Very high	101 Å²	101	75.3 Å²	75.3	47%	0.468	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	118.6	179.5	-67.8	85.6	0	0	0	109.4	S167 E195	S167-H169 PolarHBondContact OG-CE1 3.11Å; H169-E195 VanDerWaalsContact CE1-CD 3.41Å; H169-E195 IonicContact CE1-OE1 3.67Å; H169-E195 PolarHBondContact CE1-OE1 2.64Å; H169-E195 IonicContact CE1-OE2 3.96Å; H169-E195 IonicContact NE2-OE1 2.71Å
170	A	89.6	Confident	93.2	Very high	55 Å²	55	73.9 Å²	73.9	46%	0.455	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	135.3	-179.9	0	0	0	0	0	110.6	G172 C173	A170-G172 VanDerWaalsContact C-N 3.28Å; A170-G172 PolarHBondContact O-N 3.09Å; A170-G172 VanDerWaalsContact O-N 3.09Å; A170-C173 PolarHBondContact N-O 3.44Å; A170-C173 VanDerWaalsContact N-O 3.08Å; A170-C173 WeakPolarHBondContact O-CA 3.12Å; A170-C173 VanDerWaalsContact O-CB 3.28Å; A170-C173 WeakPolarHBondContact O-CB 3.4Å; A170-C173 PolarHBondContact O-N 2.84Å; A170-C173 VanDerWaalsContact O-O 3.12Å
171	D	84	Confident	93.1	Very high	175 Å²	175	73.2 Å²	73.2	94%	0.936	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	41	170.6	-56.6	-24.2	0	0	0	115.9	C173	D171-C173 PolarHBondContact O-N 2.86Å
172	G	83.1	Confident	93	Very high	66 Å²	66	67 Å²	67	68%	0.68	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	-2.4	-177.9	0	0	0	0	0	114.8	A170	A170-G172 VanDerWaalsContact C-N 3.28Å; A170-G172 PolarHBondContact O-N 3.09Å; A170-G172 VanDerWaalsContact O-N 3.09Å
173	C	89.8	Confident	93.2	Very high	31 Å²	31	57.1 Å²	57.1	21%	0.209	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	142.1	173.7	-166.2	0	0	0	0	111.1	A170 D171 V188 A189	A170-C173 PolarHBondContact N-O 3.44Å; A170-C173 VanDerWaalsContact N-O 3.08Å; A170-C173 WeakPolarHBondContact O-CA 3.12Å; A170-C173 VanDerWaalsContact O-CB 3.28Å; A170-C173 WeakPolarHBondContact O-CB 3.4Å; A170-C173 PolarHBondContact O-N 2.84Å; A170-C173 VanDerWaalsContact O-O 3.12Å; D171-C173 PolarHBondContact O-N 2.86Å; C173-V188 WeakPolarHBondContact SG-CG1 3.47Å; C173-A189 WeakPolarHBondContact CA-O 3.36Å
174	K	93.5	Very high	93.4	Very high	47 Å²	47	52.5 Å²	52.5	20%	0.204	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	128	171.8	-52.4	-176.1	-167.4	165	0	108.9	V188 A189 S192 Q193 L198	K174-V188 CarbonylContact O-C 3.5Å; K174-V188 WeakPolarHBondContact O-CA 3.48Å; K174-A189 PolarHBondContact N-O 3.27Å; K174-A189 PolarHBondContact O-N 3.12Å; K174-S192 PolarHBondContact NZ-O 3.18Å; K174-Q193 PolarHBondContact NZ-O 3.13Å; K174-L198 HydrophobicContact CB-CD1 4.4Å
175	V	95.8	Very high	93.6	Very high	30 Å²	30	47.7 Å²	47.7	18%	0.182	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	124.1	170.3	-177.6	0	0	0	0	106.2	S167 I168 F177 V186 G187 V188	S167-V175 CarbonylContact C-O 3.2Å; S167-V175 WeakPolarHBondContact CA-O 3.45Å; S167-V175 WeakPolarHBondContact CB-O 3.3Å; I168-V175 HydrophobicContact CB-CB 4.22Å; I168-V175 PolarHBondContact N-O 2.83Å; I168-V175 PolarHBondContact O-N 3.31Å; V175-F177 HydrophobicContact CB-CE2 4.23Å; V175-F177 HydrophobicContact CG1-CD2 4.13Å; V175-F177 HydrophobicContact CG1-CE2 3.41Å; V175-F177 VanDerWaalsContact CG1-CE2 3.41Å; V175-F177 HydrophobicContact CG1-CZ 3.69Å; V175-V186 HydrophobicContact CG1-CG1 3.59Å; V175-G187 CarbonylContact C-O 3.58Å; V175-G187 WeakPolarHBondContact CA-O 3.48Å; V175-V188 HydrophobicContact CG1-CG2 4.11Å; V175-V188 HydrophobicContact CG2-CG1 4.28Å; V175-V188 HydrophobicContact CG2-CG2 4.11Å
176	V	96.9	Very high	93.8	Very high	4 Å²	4	46.8 Å²	46.8	2%	0.024	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.6	179.7	177.9	0	0	0	0	108.7	V186 G187 E195 L198 L199 L202	V176-V186 WeakPolarHBondContact O-CA 3.46Å; V176-G187 PolarHBondContact N-O 3.15Å; V176-G187 PolarHBondContact O-N 3.35Å; V176-E195 HydrophobicContact CG2-CB 4.31Å; V176-E195 HydrophobicContact CG2-CG 4.34Å; V176-L198 HydrophobicContact CB-CB 4.21Å; V176-L198 HydrophobicContact CG2-CB 3.99Å; V176-L198 HydrophobicContact CG2-CD1 3.81Å; V176-L199 HydrophobicContact CG1-CB 4.26Å; V176-L199 HydrophobicContact CG1-CD1 4.36Å; V176-L202 HydrophobicContact CG1-CD1 4.27Å
177	F	97.8	Very high	93.9	Very high	8 Å²	8	38 Å²	38	4%	0.035	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	138.6	-178.4	-65.1	-100.5	0	0	0	110.2	M151 V155 I165 R166 I168 V175 V186	M151-F177 HydrophobicContact CB-CE1 4.46Å; V155-F177 HydrophobicContact CG2-CD1 3.64Å; V155-F177 HydrophobicContact CG2-CE1 3.93Å; I165-F177 HydrophobicContact CD1-CD2 4.05Å; I165-F177 HydrophobicContact CD1-CE2 3.73Å; I165-F177 HydrophobicContact CD1-CZ 4.04Å; I165-F177 HydrophobicContact CG1-CD2 3.92Å; I165-F177 HydrophobicContact CG1-CE2 4.11Å; I165-F177 HydrophobicContact CG1-CG 4.42Å; I165-F177 HydrophobicContact CG2-CB 4.08Å; I165-F177 HydrophobicContact CG2-CD1 4.11Å; I165-F177 HydrophobicContact CG2-CD2 4.27Å; I165-F177 HydrophobicContact CG2-CG 3.91Å; R166-F177 PolarHBondContact O-N 3.36Å; I168-F177 HydrophobicContact CD1-CE2 3.76Å; I168-F177 HydrophobicContact CD1-CZ 4.03Å; I168-F177 HydrophobicContact CG1-CE2 3.96Å; V175-F177 HydrophobicContact CB-CE2 4.23Å; V175-F177 HydrophobicContact CG1-CD2 4.13Å; V175-F177 HydrophobicContact CG1-CE2 3.41Å; V175-F177 VanDerWaalsContact CG1-CE2 3.41Å; V175-F177 HydrophobicContact CG1-CZ 3.69Å; F177-V186 HydrophobicContact CD1-CG1 4.3Å; F177-V186 HydrophobicContact CD1-CG2 3.68Å; F177-V186 HydrophobicContact CE1-CG1 4.11Å; F177-V186 HydrophobicContact CE1-CG2 3.84Å; F177-V186 HydrophobicContact CZ-CG1 4.36Å
178	L	97.6	Very high	93.9	Very high	15 Å²	15	37.5 Å²	37.5	8%	0.079	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	98.3	171.2	173.9	64.9	0	0	0	108.5	K180 L185 L199 L202 Q203	L178-K180 HydrophobicContact CD1-CD 4.39Å; L178-K180 HydrophobicContact CD1-CG 4.07Å; L178-K180 HydrophobicContact CG-CG 4.3Å; L178-L185 HydrophobicContact CB-CB 4.28Å; L178-L185 HydrophobicContact CD2-CD1 4.47Å; L178-L185 PolarHBondContact N-O 3.23Å; L178-L185 PolarHBondContact O-N 2.86Å; L178-L199 HydrophobicContact CB-CD1 4.04Å; L178-L199 HydrophobicContact CD1-CD1 3.89Å; L178-L199 HydrophobicContact CG-CD1 4.43Å; L178-L202 HydrophobicContact CB-CB 4.13Å; L178-L202 HydrophobicContact CB-CD1 4.08Å; L178-L202 HydrophobicContact CD2-CB 3.72Å; L178-Q203 HydrophobicContact CD2-CB 4.48Å; L178-Q203 HydrophobicContact CD2-CG 3.86Å
179	T	95.4	Very high	93.9	Very high	44 Å²	44	34.6 Å²	34.6	27%	0.27	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	123.2	169	-54.9	0	0	0	0	109.3	V184	T179-V184 HydrophobicContact CG2-CG2 4.22Å
180	K	94	Very high	93.5	Very high	48 Å²	48	34.7 Å²	34.7	21%	0.209	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	92.6	171.3	-79.9	-167.8	171	-172.4	0	108.4	L178 L183 Y206 Y207	L178-K180 HydrophobicContact CD1-CD 4.39Å; L178-K180 HydrophobicContact CD1-CG 4.07Å; L178-K180 HydrophobicContact CG-CG 4.3Å; K180-L183 CarbonylContact C-O 3.45Å; K180-L183 PolarHBondContact N-O 2.94Å; K180-L183 CarbonylContact O-C 3.58Å; K180-L183 WeakPolarHBondContact O-CA 3.23Å; K180-L183 PolarHBondContact O-N 3.2Å; K180-Y206 HydrophobicContact CB-CD2 3.82Å; K180-Y206 HydrophobicContact CB-CE2 3.48Å; K180-Y206 VanDerWaalsContact CB-CE2 3.48Å; K180-Y206 HydrophobicContact CD-CD1 3.64Å; K180-Y206 HydrophobicContact CD-CD2 3.73Å; K180-Y206 HydrophobicContact CD-CE1 3.6Å; K180-Y206 HydrophobicContact CD-CE2 3.68Å; K180-Y206 HydrophobicContact CD-CG 3.71Å; K180-Y206 HydrophobicContact CG-CD2 4.41Å; K180-Y206 HydrophobicContact CG-CE2 4.26Å; K180-Y207 PolarHBondContact NZ-OH 3.22Å
181	S	90.8	Very high	92.7	Very high	70 Å²	70	33.8 Å²	33.8	49%	0.49	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.3	131.2	-175.7	-168.6	0	0	0	0	112.5	E129	E129-S181 WeakPolarHBondContact OE1-CA 3.09Å; E129-S181 WeakPolarHBondContact OE1-CB 3.4Å; E129-S181 PolarHBondContact OE1-OG 3.21Å
182	P	94.1	Very high	92.2	Very high	5 Å²	5	30 Å²	30	3%	0.032	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	cis	-91.8	17.9	6.7	37.3	-36.1	0	0	0	114.6	E129 L218 F222	E129-P182 PolarHBondContact N-O 3.04Å; E129-P182 VanDerWaalsContact N-O 3.11Å; P182-L218 HydrophobicContact CG-CD1 4.1Å; P182-L218 HydrophobicContact CG-CD2 4.31Å; P182-L218 HydrophobicContact CG-CG 3.75Å; P182-F222 HydrophobicContact CB-CB 3.6Å; P182-F222 HydrophobicContact CB-CD1 4.16Å; P182-F222 HydrophobicContact CB-CD2 3.74Å; P182-F222 HydrophobicContact CB-CE2 4.46Å; P182-F222 HydrophobicContact CB-CG 3.55Å; P182-F222 HydrophobicContact CG-CB 3.85Å; P182-F222 HydrophobicContact CG-CD2 3.32Å; P182-F222 HydrophobicContact CG-CE2 4.01Å; P182-F222 HydrophobicContact CG-CG 3.68Å
183	L	96.3	Very high	92.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	146.8	-173.5	-57.2	-176.8	0	0	0	112.9	I134 K180 L185 Y206 I209 L218 L230	I134-L183 HydrophobicContact CD1-CD2 3.45Å; I134-L183 VanDerWaalsContact CD1-CD2 3.45Å; K180-L183 CarbonylContact C-O 3.45Å; K180-L183 PolarHBondContact N-O 2.94Å; K180-L183 CarbonylContact O-C 3.58Å; K180-L183 WeakPolarHBondContact O-CA 3.23Å; K180-L183 PolarHBondContact O-N 3.2Å; L183-L185 HydrophobicContact CB-CD1 4.16Å; L183-Y206 HydrophobicContact CD1-CD2 4.3Å; L183-Y206 HydrophobicContact CD1-CE2 4.44Å; L183-I209 HydrophobicContact CD1-CD1 4.38Å; L183-I209 HydrophobicContact CD1-CG2 4.11Å; L183-L218 HydrophobicContact CD1-CD1 4.47Å; L183-L218 HydrophobicContact CD1-CD2 3.88Å; L183-L218 HydrophobicContact CD2-CD1 4.35Å; L183-L218 HydrophobicContact CG-CD1 4.48Å; L183-L218 HydrophobicContact CG-CD2 4.15Å; L183-L230 HydrophobicContact CD2-CD2 4.16Å
184	V	97.4	Very high	92.1	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.006	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	139	163.8	178.1	0	0	0	0	108.1	L127 M152 V155 T179 V186	L127-V184 HydrophobicContact CD2-CB 4.18Å; L127-V184 HydrophobicContact CD2-CG1 4.16Å; L127-V184 WeakPolarHBondContact CD2-O 3.27Å; L127-V184 HydrophobicContact CG-CB 4.23Å; L127-V184 PolarHBondContact N-O 3.36Å; L127-V184 PolarHBondContact O-N 3.16Å; L127-V184 VanDerWaalsContact O-O 3.05Å; M152-V184 HydrophobicContact CE-CG2 3.79Å; M152-V184 HydrophobicContact SD-CB 3.78Å; M152-V184 HydrophobicContact SD-CG1 4.09Å; M152-V184 HydrophobicContact SD-CG2 3.61Å; V155-V184 HydrophobicContact CG2-CG1 4.24Å; T179-V184 HydrophobicContact CG2-CG2 4.22Å; V184-V186 HydrophobicContact CG1-CG2 4.14Å
185	L	98.4	Very high	92	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	135.9	175.6	-61.6	89.3	0	0	0	108.9	F125 V126 L178 L183 L202 I205 Y206	F125-L185 WeakPolarHBondContact O-CA 3.44Å; V126-L185 HydrophobicContact CG1-CG 4.15Å; V126-L185 HydrophobicContact CG2-CD2 3.9Å; V126-L185 HydrophobicContact CG2-CG 4.05Å; L178-L185 HydrophobicContact CB-CB 4.28Å; L178-L185 HydrophobicContact CD2-CD1 4.47Å; L178-L185 PolarHBondContact N-O 3.23Å; L178-L185 PolarHBondContact O-N 2.86Å; L183-L185 HydrophobicContact CB-CD1 4.16Å; L185-L202 HydrophobicContact CB-CB 4.32Å; L185-L202 HydrophobicContact CB-CD2 4.17Å; L185-L202 WeakPolarHBondContact CD2-O 3.36Å; L185-I205 HydrophobicContact CD2-CB 4.01Å; L185-I205 HydrophobicContact CD2-CG2 3.78Å; L185-Y206 HydrophobicContact CD1-CD2 4.06Å
186	V	98.2	Very high	91.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	122.3	-177.4	-171.9	0	0	0	0	109.6	V124 F125 L127 M151 V175 V176 F177 V184 V188	V124-V186 WeakPolarHBondContact CA-O 3.43Å; F125-V186 HydrophobicContact CB-CB 4.41Å; F125-V186 HydrophobicContact CD2-CB 4.43Å; F125-V186 PolarHBondContact N-O 2.83Å; F125-V186 PolarHBondContact O-N 3.32Å; L127-V186 HydrophobicContact CD2-CG2 4.08Å; M151-V186 HydrophobicContact CB-CG2 4.38Å; M151-V186 HydrophobicContact CE-CG1 4.24Å; M151-V186 HydrophobicContact SD-CB 4.05Å; M151-V186 HydrophobicContact SD-CG1 4.03Å; M151-V186 HydrophobicContact SD-CG2 4.07Å; V175-V186 HydrophobicContact CG1-CG1 3.59Å; V176-V186 WeakPolarHBondContact O-CA 3.46Å; F177-V186 HydrophobicContact CD1-CG1 4.3Å; F177-V186 HydrophobicContact CD1-CG2 3.68Å; F177-V186 HydrophobicContact CE1-CG1 4.11Å; F177-V186 HydrophobicContact CE1-CG2 3.84Å; F177-V186 HydrophobicContact CZ-CG1 4.36Å; V184-V186 HydrophobicContact CG1-CG2 4.14Å; V186-V188 HydrophobicContact CG1-CG2 4.33Å
187	G	96.9	Very high	91.4	Very high	2 Å²	2	32.2 Å²	32.2	2%	0.021	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.7	174.5	0	0	0	0	0	110.1	V175 V176	V175-G187 CarbonylContact C-O 3.58Å; V175-G187 WeakPolarHBondContact CA-O 3.48Å; V176-G187 PolarHBondContact N-O 3.15Å; V176-G187 PolarHBondContact O-N 3.35Å
188	V	95.3	Very high	91.1	Very high	23 Å²	23	31.9 Å²	31.9	14%	0.139	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	118.4	178.7	-178.2	0	0	0	0	108.2	K122 H123 F125 C173 K174 V175 V186	K122-V188 CarbonylContact C-O 3.58Å; K122-V188 WeakPolarHBondContact CA-O 3.18Å; H123-V188 HydrophobicContact CB-CB 4.29Å; H123-V188 PolarHBondContact N-O 2.92Å; H123-V188 PolarHBondContact O-N 3.42Å; F125-V188 HydrophobicContact CD2-CG2 4.3Å; F125-V188 HydrophobicContact CE2-CB 4.43Å; F125-V188 HydrophobicContact CE2-CG2 3.78Å; C173-V188 WeakPolarHBondContact SG-CG1 3.47Å; K174-V188 CarbonylContact O-C 3.5Å; K174-V188 WeakPolarHBondContact O-CA 3.48Å; V175-V188 HydrophobicContact CG1-CG2 4.11Å; V175-V188 HydrophobicContact CG2-CG1 4.28Å; V175-V188 HydrophobicContact CG2-CG2 4.11Å; V186-V188 HydrophobicContact CG1-CG2 4.33Å
189	A	93.1	Very high	91	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.008	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	137.8	-177.9	0	0	0	0	0	112.4	K122 C173 K174 L198	K122-A189 HydrophobicContact CG-CB 4.44Å; C173-A189 WeakPolarHBondContact CA-O 3.36Å; K174-A189 PolarHBondContact N-O 3.27Å; K174-A189 PolarHBondContact O-N 3.12Å; A189-L198 HydrophobicContact CB-CD1 3.76Å; A189-L198 HydrophobicContact CB-CD2 3.78Å; A189-L198 HydrophobicContact CB-CG 4.41Å
190	K	86.1	Confident	91	Very high	103 Å²	103	33.3 Å²	33.3	45%	0.448	18%	0.18	S	C	.	.			trans	-94.8	-0.4	168.7	-59.1	-168.4	-176.4	-169.3	0	113	R118 N119 K121	R118-K190 WeakPolarHBondContact O-CE 3.18Å; R118-K190 PolarHBondContact O-NZ 3.4Å; N119-K190 PolarHBondContact OD1-NZ 3.19Å; K121-K190 PolarHBondContact O-N 2.9Å
191	S	73.3	Confident	91	Very high	37 Å²	37	31.4 Å²	31.4	26%	0.259	17%	0.172	S	C	.	.	S	Bend	trans	-86.2	168.9	-174.9	62.9	0	0	0	0	112.5	Q193	S191-Q193 PolarHBondContact O-N 3.18Å; S191-Q193 VanDerWaalsContact O-N 3.16Å; S191-Q193 VanDerWaalsContact OG-CG 3.32Å; S191-Q193 WeakPolarHBondContact OG-CG 3.32Å; S191-Q193 PolarHBondContact OG-OE1 3.28Å; S191-Q193 VanDerWaalsContact OG-OE1 3.06Å
192	S	72.6	Confident	91.3	Very high	96 Å²	96	28.2 Å²	28.2	67%	0.671	15%	0.149	S	C	*	.	S	Bend	trans	-65	-11.8	175.5	-53.2	0	0	0	0	114.4	K174	K174-S192 PolarHBondContact NZ-O 3.18Å
193	Q	82.8	Confident	91.5	Very high	13 Å²	13	30.7 Å²	30.7	6%	0.061	16%	0.16	C	C	.	.			trans	-47.7	140.5	-174.7	-70.1	-176	-64.6	0	0	112.9	K174 S191 L198 E201	K174-Q193 PolarHBondContact NZ-O 3.13Å; S191-Q193 PolarHBondContact O-N 3.18Å; S191-Q193 VanDerWaalsContact O-N 3.16Å; S191-Q193 VanDerWaalsContact OG-CG 3.32Å; S191-Q193 WeakPolarHBondContact OG-CG 3.32Å; S191-Q193 PolarHBondContact OG-OE1 3.28Å; S191-Q193 VanDerWaalsContact OG-OE1 3.06Å; Q193-L198 HydrophobicContact CB-CD2 4.43Å; Q193-L198 HydrophobicContact CB-CG 4.36Å; Q193-E201 PolarHBondContact NE2-OE1 2.78Å
194	S	88.1	Confident	91.6	Very high	28 Å²	28	30.8 Å²	30.8	20%	0.196	16%	0.161	C	C	.	.			trans	-78.7	157.4	178.4	68.1	0	0	0	0	112.5	K196 E197 L198 S451	S194-K196 PolarHBondContact O-N 3.44Å; S194-E197 PolarHBondContact N-OE2 2.78Å; S194-E197 PolarHBondContact O-N 3.4Å; S194-E197 WeakPolarHBondContact OG-CG 3.39Å; S194-E197 PolarHBondContact OG-OE2 2.78Å; S194-L198 PolarHBondContact O-N 3.49Å; S194-L198 VanDerWaalsContact O-N 3.13Å; S194-S451 WeakPolarHBondContact CB-OG 3.35Å; S194-S451 PolarHBondContact OG-OG 3.04Å
195	E	90.3	Very high	91.6	Very high	82 Å²	82	30.7 Å²	30.7	38%	0.383	16%	0.16	S	C	.	.	H	α-helix	trans	-55.2	-35.6	175.8	-63.7	171.6	-109.3	0	0	112.2	S167 H169 V176 L199	S167-E195 VanDerWaalsContact CB-OE2 3.25Å; S167-E195 WeakPolarHBondContact CB-OE2 3.39Å; S167-E195 PolarHBondContact OG-OE2 2.95Å; H169-E195 VanDerWaalsContact CE1-CD 3.41Å; H169-E195 IonicContact CE1-OE1 3.67Å; H169-E195 PolarHBondContact CE1-OE1 2.64Å; H169-E195 IonicContact CE1-OE2 3.96Å; H169-E195 IonicContact NE2-OE1 2.71Å; V176-E195 HydrophobicContact CG2-CB 4.31Å; V176-E195 HydrophobicContact CG2-CG 4.34Å; E195-L199 WeakPolarHBondContact O-CB 3.34Å; E195-L199 PolarHBondContact O-N 3.48Å
196	K	89.1	Confident	91.6	Very high	99 Å²	99	31.4 Å²	31.4	43%	0.43	16%	0.163	S	C	.	.	H	α-helix	trans	-64.9	-37.1	175.9	-79.1	-169.9	168.1	-171.1	0	113	S194 R200 H454	S194-K196 PolarHBondContact O-N 3.44Å; K196-R200 WeakPolarHBondContact O-CB 3.45Å; K196-R200 PolarHBondContact O-N 2.93Å; K196-H454 PolarHBondContact NZ-O 3.16Å
197	E	90.8	Very high	91.6	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-71.8	-46.4	-179.3	-69.3	171.5	155.2	0	0	110.2	S194 L199 R200 E201 H450 S451	S194-E197 PolarHBondContact N-OE2 2.78Å; S194-E197 PolarHBondContact O-N 3.4Å; S194-E197 WeakPolarHBondContact OG-CG 3.39Å; S194-E197 PolarHBondContact OG-OE2 2.78Å; E197-L199 VanDerWaalsContact C-N 3.34Å; E197-L199 PolarHBondContact O-N 3.27Å; E197-R200 WeakPolarHBondContact O-CB 3.29Å; E197-R200 PolarHBondContact O-N 3.39Å; E197-R200 VanDerWaalsContact O-N 3.16Å; E197-E201 WeakPolarHBondContact O-CG 3.39Å; E197-E201 PolarHBondContact O-N 3.04Å; E197-H450 IonicContact OE1-CG 3.81Å; E197-H450 IonicContact OE1-ND1 3.35Å; E197-H450 PolarHBondContact OE1-ND1 3.06Å; E197-S451 PolarHBondContact OE1-OG 3.13Å; E197-S451 PolarHBondContact OE2-OG 2.75Å
198	L	93.3	Very high	91.6	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-59.4	-44.4	172.6	-64.7	171.8	0	0	0	111.4	K122 K174 V176 A189 Q193 S194 R200 E201 L202	K122-L198 HydrophobicContact CD-CD2 3.95Å; K174-L198 HydrophobicContact CB-CD1 4.4Å; V176-L198 HydrophobicContact CB-CB 4.21Å; V176-L198 HydrophobicContact CG2-CB 3.99Å; V176-L198 HydrophobicContact CG2-CD1 3.81Å; A189-L198 HydrophobicContact CB-CD1 3.76Å; A189-L198 HydrophobicContact CB-CD2 3.78Å; A189-L198 HydrophobicContact CB-CG 4.41Å; Q193-L198 HydrophobicContact CB-CD2 4.43Å; Q193-L198 HydrophobicContact CB-CG 4.36Å; S194-L198 PolarHBondContact O-N 3.49Å; S194-L198 VanDerWaalsContact O-N 3.13Å; L198-R200 VanDerWaalsContact C-N 3.29Å; L198-R200 PolarHBondContact O-N 3.14Å; L198-E201 WeakPolarHBondContact O-CB 3.27Å; L198-E201 PolarHBondContact O-N 3.01Å; L198-E201 VanDerWaalsContact O-N 3.16Å; L198-L202 WeakPolarHBondContact O-CG 3.26Å; L198-L202 PolarHBondContact O-N 3.33Å
199	L	94.9	Very high	91.7	Very high	54 Å²	54	31.9 Å²	31.9	28%	0.283	16%	0.162	S	C	.	.	H	α-helix	trans	-58.9	-40.2	175.9	-174.1	65.5	0	0	0	112	V176 L178 E195 E197 L202 Q203	V176-L199 HydrophobicContact CG1-CB 4.26Å; V176-L199 HydrophobicContact CG1-CD1 4.36Å; L178-L199 HydrophobicContact CB-CD1 4.04Å; L178-L199 HydrophobicContact CD1-CD1 3.89Å; L178-L199 HydrophobicContact CG-CD1 4.43Å; E195-L199 WeakPolarHBondContact O-CB 3.34Å; E195-L199 PolarHBondContact O-N 3.48Å; E197-L199 VanDerWaalsContact C-N 3.34Å; E197-L199 PolarHBondContact O-N 3.27Å; L199-L202 PolarHBondContact O-N 3.13Å; L199-Q203 VanDerWaalsContact O-CG 3.3Å; L199-Q203 WeakPolarHBondContact O-CG 3.41Å; L199-Q203 PolarHBondContact O-N 2.93Å
200	R	94.3	Very high	91.8	Very high	35 Å²	35	31.9 Å²	31.9	13%	0.132	16%	0.162	C	C	.	.	H	α-helix	trans	-68.1	-40.6	175.1	-178.6	-176.3	59.9	-149.9	-7.4	112.1	K196 E197 L198 Q203 Y204 L254 L255 H450	K196-R200 WeakPolarHBondContact O-CB 3.45Å; K196-R200 PolarHBondContact O-N 2.93Å; E197-R200 WeakPolarHBondContact O-CB 3.29Å; E197-R200 PolarHBondContact O-N 3.39Å; E197-R200 VanDerWaalsContact O-N 3.16Å; L198-R200 VanDerWaalsContact C-N 3.29Å; L198-R200 PolarHBondContact O-N 3.14Å; R200-Q203 WeakPolarHBondContact O-CB 3.48Å; R200-Q203 PolarHBondContact O-N 3.08Å; R200-Y204 HydrophobicContact CG-CD2 4.07Å; R200-Y204 HydrophobicContact CG-CE2 3.9Å; R200-Y204 VanDerWaalsContact O-CD2 3.31Å; R200-Y204 WeakPolarHBondContact O-CD2 3.42Å; R200-Y204 PolarHBondContact O-N 2.8Å; R200-L254 PolarHBondContact NE-O 3.39Å; R200-L255 PolarHBondContact NH1-O 3.28Å; R200-H450 PolarHBondContact NH1-CE1 3.44Å; R200-H450 PolarHBondContact NH1-NE2 3.04Å
201	E	95.4	Very high	92.3	Very high	8 Å²	8	27.6 Å²	27.6	4%	0.037	15%	0.145	C	C	.	.	H	α-helix	trans	-58.2	-47.3	172.9	-69.2	-176.8	-166.8	0	0	111	K122 Q193 E197 L198 Q203 Y204 I205 L248	K122-E201 VanDerWaalsContact CD-OE2 3.25Å; K122-E201 WeakPolarHBondContact CD-OE2 3.41Å; K122-E201 VanDerWaalsContact CE-OE2 3.29Å; K122-E201 WeakPolarHBondContact CE-OE2 3.47Å; K122-E201 IonicContact NZ-OE1 3.62Å; K122-E201 PolarHBondContact NZ-OE1 3.28Å; K122-E201 IonicContact NZ-OE2 3.58Å; K122-E201 PolarHBondContact NZ-OE2 2.76Å; Q193-E201 PolarHBondContact NE2-OE1 2.78Å; E197-E201 WeakPolarHBondContact O-CG 3.39Å; E197-E201 PolarHBondContact O-N 3.04Å; L198-E201 WeakPolarHBondContact O-CB 3.27Å; L198-E201 PolarHBondContact O-N 3.01Å; L198-E201 VanDerWaalsContact O-N 3.16Å; E201-Q203 VanDerWaalsContact C-N 3.31Å; E201-Q203 PolarHBondContact O-N 3.46Å; E201-Y204 WeakPolarHBondContact O-CB 3.22Å; E201-Y204 PolarHBondContact O-N 3.06Å; E201-Y204 VanDerWaalsContact O-N 3.11Å; E201-I205 WeakPolarHBondContact O-CD1 3.11Å; E201-I205 WeakPolarHBondContact O-CG1 3.44Å; E201-I205 PolarHBondContact O-N 3.2Å; E201-I205 VanDerWaalsContact O-N 3.08Å; E201-L248 HydrophobicContact CB-CD1 4.05Å; E201-L248 HydrophobicContact CG-CB 4.28Å; E201-L248 HydrophobicContact CG-CD1 4.16Å; E201-L248 HydrophobicContact CG-CD2 4.11Å; E201-L248 HydrophobicContact CG-CG 4.42Å
202	L	97.4	Very high	93.4	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-61.7	-36.7	174.7	-61.7	176.1	0	0	0	112.1	V124 V176 L178 L185 L198 L199 I205 Y206	V124-L202 HydrophobicContact CG1-CD2 4.29Å; V176-L202 HydrophobicContact CG1-CD1 4.27Å; L178-L202 HydrophobicContact CB-CB 4.13Å; L178-L202 HydrophobicContact CB-CD1 4.08Å; L178-L202 HydrophobicContact CD2-CB 3.72Å; L185-L202 HydrophobicContact CB-CB 4.32Å; L185-L202 HydrophobicContact CB-CD2 4.17Å; L185-L202 WeakPolarHBondContact CD2-O 3.36Å; L198-L202 WeakPolarHBondContact O-CG 3.26Å; L198-L202 PolarHBondContact O-N 3.33Å; L199-L202 PolarHBondContact O-N 3.13Å; L202-I205 HydrophobicContact CD2-CD1 4.15Å; L202-I205 PolarHBondContact O-N 3.38Å; L202-Y206 PolarHBondContact O-N 3.25Å
203	Q	97.3	Very high	94.3	Very high	57 Å²	57	23.4 Å²	23.4	27%	0.266	11%	0.112	S	C	.	.	H	α-helix	trans	-62.7	-40.6	173	-74.9	172.6	-7.1	0	0	112.2	L178 L199 R200 E201 Y206 Y207	L178-Q203 HydrophobicContact CD2-CB 4.48Å; L178-Q203 HydrophobicContact CD2-CG 3.86Å; L199-Q203 VanDerWaalsContact O-CG 3.3Å; L199-Q203 WeakPolarHBondContact O-CG 3.41Å; L199-Q203 PolarHBondContact O-N 2.93Å; R200-Q203 WeakPolarHBondContact O-CB 3.48Å; R200-Q203 PolarHBondContact O-N 3.08Å; E201-Q203 VanDerWaalsContact C-N 3.31Å; E201-Q203 PolarHBondContact O-N 3.46Å; Q203-Y206 PolarHBondContact O-N 3.02Å; Q203-Y207 HydrophobicContact CB-CD2 4.48Å; Q203-Y207 HydrophobicContact CB-CE2 4.35Å; Q203-Y207 WeakPolarHBondContact O-CD2 3.18Å; Q203-Y207 PolarHBondContact O-N 2.95Å
204	Y	97.9	Very high	95	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.008	11%	0.11	C	C	.	.	H	α-helix	trans	-61.5	-42.9	174.1	-88.2	-76.4	0	0	0	111.9	R200 E201 Y207 Q208 L248 L254 H308 I309 H312	R200-Y204 HydrophobicContact CG-CD2 4.07Å; R200-Y204 HydrophobicContact CG-CE2 3.9Å; R200-Y204 VanDerWaalsContact O-CD2 3.31Å; R200-Y204 WeakPolarHBondContact O-CD2 3.42Å; R200-Y204 PolarHBondContact O-N 2.8Å; E201-Y204 WeakPolarHBondContact O-CB 3.22Å; E201-Y204 PolarHBondContact O-N 3.06Å; E201-Y204 VanDerWaalsContact O-N 3.11Å; Y204-Y207 CarbonylContact O-C 3.58Å; Y204-Y207 PolarHBondContact O-N 3.41Å; Y204-Q208 PolarHBondContact O-N 2.89Å; Y204-L248 HydrophobicContact CD2-CD2 3.66Å; Y204-L248 HydrophobicContact CE2-CD2 4.29Å; Y204-L248 HydrophobicContact CG-CD2 4Å; Y204-L254 HydrophobicContact CD1-CD2 4.21Å; Y204-L254 HydrophobicContact CE1-CD2 4.16Å; Y204-L254 HydrophobicContact CE2-CB 4.34Å; Y204-L254 HydrophobicContact CG-CD2 4.46Å; Y204-H308 PolarHBondContact OH-ND1 3.33Å; Y204-I309 HydrophobicContact CD1-CG2 4.17Å; Y204-I309 HydrophobicContact CE1-CB 4.16Å; Y204-I309 HydrophobicContact CE1-CG1 3.91Å; Y204-I309 HydrophobicContact CE1-CG2 3.99Å; Y204-H312 HydrophobicContact CE1-CB 4.04Å; Y204-H312 AromaticContact CE1-ND1 3.61Å; Y204-H312 AromaticContact CZ-ND1 3.59Å; Y204-H312 PolarHBondContact OH-CE1 2.87Å; Y204-H312 PolarHBondContact OH-ND1 3.18Å
205	I	97.8	Very high	95.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.9	-45	176.9	-63.7	151.4	0	0	0	111.4	V124 V126 L185 E201 L202 Y207 Q208 I209 T241 L245	V124-I205 HydrophobicContact CB-CD1 4.43Å; V124-I205 HydrophobicContact CG1-CD1 3.55Å; V124-I205 HydrophobicContact CG2-CD1 4.07Å; V126-I205 HydrophobicContact CG2-CG2 3.84Å; L185-I205 HydrophobicContact CD2-CB 4.01Å; L185-I205 HydrophobicContact CD2-CG2 3.78Å; E201-I205 WeakPolarHBondContact O-CD1 3.11Å; E201-I205 WeakPolarHBondContact O-CG1 3.44Å; E201-I205 PolarHBondContact O-N 3.2Å; E201-I205 VanDerWaalsContact O-N 3.08Å; L202-I205 HydrophobicContact CD2-CD1 4.15Å; L202-I205 PolarHBondContact O-N 3.38Å; I205-Y207 VanDerWaalsContact C-N 3.31Å; I205-Y207 PolarHBondContact O-N 3.1Å; I205-Q208 WeakPolarHBondContact O-CB 3.34Å; I205-Q208 PolarHBondContact O-N 2.74Å; I205-I209 PolarHBondContact O-N 2.95Å; I205-I209 VanDerWaalsContact O-N 3.1Å; I205-T241 HydrophobicContact CG2-CG2 4.06Å; I205-L245 HydrophobicContact CD1-CD2 4.15Å; I205-L245 HydrophobicContact CD1-CG 4.42Å
206	Y	98	Very high	95.5	Very high	14 Å²	14	23 Å²	23	6%	0.055	11%	0.114	C	C	.	.	H	α-helix	trans	-56.4	-46.6	173.2	170.5	-90.9	0	0	0	111.3	K180 L183 L185 L202 Q203 Q208 I209 V210	K180-Y206 HydrophobicContact CB-CD2 3.82Å; K180-Y206 HydrophobicContact CB-CE2 3.48Å; K180-Y206 VanDerWaalsContact CB-CE2 3.48Å; K180-Y206 HydrophobicContact CD-CD1 3.64Å; K180-Y206 HydrophobicContact CD-CD2 3.73Å; K180-Y206 HydrophobicContact CD-CE1 3.6Å; K180-Y206 HydrophobicContact CD-CE2 3.68Å; K180-Y206 HydrophobicContact CD-CG 3.71Å; K180-Y206 HydrophobicContact CG-CD2 4.41Å; K180-Y206 HydrophobicContact CG-CE2 4.26Å; L183-Y206 HydrophobicContact CD1-CD2 4.3Å; L183-Y206 HydrophobicContact CD1-CE2 4.44Å; L185-Y206 HydrophobicContact CD1-CD2 4.06Å; L202-Y206 PolarHBondContact O-N 3.25Å; Q203-Y206 PolarHBondContact O-N 3.02Å; Y206-Q208 VanDerWaalsContact C-N 3.34Å; Y206-Q208 PolarHBondContact O-N 3.45Å; Y206-I209 PolarHBondContact O-N 3.35Å; Y206-V210 HydrophobicContact CD1-CG2 4.21Å; Y206-V210 HydrophobicContact CE1-CG2 3.69Å; Y206-V210 HydrophobicContact CE2-CG2 4.15Å; Y206-V210 WeakPolarHBondContact O-CG2 3.27Å; Y206-V210 PolarHBondContact O-N 3.36Å
207	Y	97.9	Very high	95.7	Very high	29 Å²	29	20.8 Å²	20.8	11%	0.114	11%	0.105	C	C	.	.	H	α-helix	trans	-70.8	-27.7	179.1	-68.3	-53.2	0	0	0	112.9	K180 Q203 Y204 I205 V210 S211 I309 P336 K337	K180-Y207 PolarHBondContact NZ-OH 3.22Å; Q203-Y207 HydrophobicContact CB-CD2 4.48Å; Q203-Y207 HydrophobicContact CB-CE2 4.35Å; Q203-Y207 WeakPolarHBondContact O-CD2 3.18Å; Q203-Y207 PolarHBondContact O-N 2.95Å; Y204-Y207 CarbonylContact O-C 3.58Å; Y204-Y207 PolarHBondContact O-N 3.41Å; I205-Y207 VanDerWaalsContact C-N 3.31Å; I205-Y207 PolarHBondContact O-N 3.1Å; Y207-V210 PolarHBondContact O-N 2.65Å; Y207-S211 WeakPolarHBondContact O-CB 3.22Å; Y207-S211 PolarHBondContact O-N 3.02Å; Y207-I309 HydrophobicContact CD2-CD1 3.98Å; Y207-I309 HydrophobicContact CD2-CG2 3.9Å; Y207-I309 HydrophobicContact CE2-CD1 3.94Å; Y207-I309 HydrophobicContact CG-CG2 4.2Å; Y207-P336 HydrophobicContact CD1-CB 3.4Å; Y207-P336 VanDerWaalsContact CD1-CB 3.4Å; Y207-P336 HydrophobicContact CD1-CG 4.25Å; Y207-P336 HydrophobicContact CE1-CB 4.08Å; Y207-P336 HydrophobicContact CG-CB 4.13Å; Y207-P336 WeakPolarHBondContact O-CG 3.27Å; Y207-K337 HydrophobicContact CE1-CD 4.35Å; Y207-K337 HydrophobicContact CE2-CD 4.27Å
208	Q	97.6	Very high	95.8	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.009	10%	0.104	C	C	.	.	H	α-helix	trans	-62.3	-43.8	169.8	-176	59.3	77.8	0	0	111.3	Y204 I205 Y206 S211 L212 L244 L313 N316	Y204-Q208 PolarHBondContact O-N 2.89Å; I205-Q208 WeakPolarHBondContact O-CB 3.34Å; I205-Q208 PolarHBondContact O-N 2.74Å; Y206-Q208 VanDerWaalsContact C-N 3.34Å; Y206-Q208 PolarHBondContact O-N 3.45Å; Q208-S211 PolarHBondContact NE2-OG 3.04Å; Q208-S211 VanDerWaalsContact NE2-OG 3.12Å; Q208-S211 PolarHBondContact O-N 3.35Å; Q208-S211 PolarHBondContact O-OG 2.86Å; Q208-L212 WeakPolarHBondContact O-CG 3.49Å; Q208-L212 PolarHBondContact O-N 3.27Å; Q208-L244 HydrophobicContact CB-CD2 3.65Å; Q208-L244 HydrophobicContact CG-CD2 4.03Å; Q208-L313 HydrophobicContact CB-CD2 3.9Å; Q208-L313 HydrophobicContact CG-CD2 4.49Å; Q208-N316 PolarHBondContact OE1-ND2 3.07Å
209	I	96.6	Very high	95.9	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.021	12%	0.117	C	C	.	.	H	α-helix	trans	-64.6	-45.8	175	-64.1	167.9	0	0	0	110.9	V126 L183 I205 Y206 S211 L212 L213 L230 L234	V126-I209 HydrophobicContact CG1-CD1 3.78Å; V126-I209 HydrophobicContact CG2-CD1 4.31Å; L183-I209 HydrophobicContact CD1-CD1 4.38Å; L183-I209 HydrophobicContact CD1-CG2 4.11Å; I205-I209 PolarHBondContact O-N 2.95Å; I205-I209 VanDerWaalsContact O-N 3.1Å; Y206-I209 PolarHBondContact O-N 3.35Å; I209-S211 VanDerWaalsContact C-N 3.27Å; I209-S211 PolarHBondContact O-N 3.05Å; I209-L212 PolarHBondContact O-N 3.02Å; I209-L212 VanDerWaalsContact O-N 3.14Å; I209-L213 PolarHBondContact O-N 3.25Å; I209-L230 HydrophobicContact CG2-CD2 4.42Å; I209-L234 HydrophobicContact CG1-CD1 4.4Å; I209-L234 HydrophobicContact CG2-CD1 4.23Å; I209-L234 HydrophobicContact CG2-CD2 4.45Å
210	V	96.7	Very high	95.8	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.006	12%	0.121	C	C	.	.	H	α-helix	trans	-64.2	-30.5	176.8	176.1	0	0	0	0	112	Y206 Y207 L212 T214 L215 L218 C334 P336	Y206-V210 HydrophobicContact CD1-CG2 4.21Å; Y206-V210 HydrophobicContact CE1-CG2 3.69Å; Y206-V210 HydrophobicContact CE2-CG2 4.15Å; Y206-V210 WeakPolarHBondContact O-CG2 3.27Å; Y206-V210 PolarHBondContact O-N 3.36Å; Y207-V210 PolarHBondContact O-N 2.65Å; V210-L212 PolarHBondContact O-N 3.34Å; V210-T214 VanDerWaalsContact O-CA 3.26Å; V210-T214 WeakPolarHBondContact O-CA 3.02Å; V210-T214 PolarHBondContact O-N 3Å; V210-L215 HydrophobicContact CG1-CB 4.33Å; V210-L218 HydrophobicContact CG2-CD2 4.48Å; V210-C334 WeakPolarHBondContact O-CB 3.41Å; V210-P336 HydrophobicContact CB-CB 4.27Å; V210-P336 HydrophobicContact CB-CG 4.11Å; V210-P336 HydrophobicContact CG1-CB 3.83Å; V210-P336 HydrophobicContact CG1-CG 3.93Å
211	S	96.7	Very high	95.7	Very high	14 Å²	14	23.6 Å²	23.6	10%	0.098	12%	0.12	C	C	.	.	H	α-helix	trans	-65.8	-25.7	176.4	74.8	0	0	0	0	113.4	Y207 Q208 I209 C334	Y207-S211 WeakPolarHBondContact O-CB 3.22Å; Y207-S211 PolarHBondContact O-N 3.02Å; Q208-S211 PolarHBondContact NE2-OG 3.04Å; Q208-S211 VanDerWaalsContact NE2-OG 3.12Å; Q208-S211 PolarHBondContact O-N 3.35Å; Q208-S211 PolarHBondContact O-OG 2.86Å; I209-S211 VanDerWaalsContact C-N 3.27Å; I209-S211 PolarHBondContact O-N 3.05Å; S211-C334 WeakPolarHBondContact CA-O 3.08Å; S211-C334 WeakPolarHBondContact CB-O 3.38Å; S211-C334 WeakPolarHBondContact O-CB 3.29Å; S211-C334 PolarHBondContact O-N 3.41Å
212	L	94.9	Very high	95.6	Very high	40 Å²	40	24 Å²	24	21%	0.209	12%	0.122	C	C	.	.	H	α-helix	trans	-89.4	-33.4	-179.5	-64.6	167.7	0	0	0	113.1	Q208 I209 V210 L234 S237 L240 F343	Q208-L212 WeakPolarHBondContact O-CG 3.49Å; Q208-L212 PolarHBondContact O-N 3.27Å; I209-L212 PolarHBondContact O-N 3.02Å; I209-L212 VanDerWaalsContact O-N 3.14Å; V210-L212 PolarHBondContact O-N 3.34Å; L212-L234 HydrophobicContact CB-CD2 4.28Å; L212-L234 HydrophobicContact CD1-CD2 3.99Å; L212-S237 WeakPolarHBondContact CD1-OG 3.27Å; L212-L240 HydrophobicContact CD2-CD1 3.82Å; L212-F343 WeakPolarHBondContact O-CE1 3.39Å; L212-F343 WeakPolarHBondContact O-CZ 3.24Å
213	L	93.4	Very high	95.2	Very high	4 Å²	4	30.8 Å²	30.8	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-120.3	-8.7	-172.1	-59.3	-179.5	0	0	0	115.3	I209 Q217 L230 L233 L234	I209-L213 PolarHBondContact O-N 3.25Å; L213-Q217 VanDerWaalsContact O-CB 3.28Å; L213-Q217 WeakPolarHBondContact O-CB 3.46Å; L213-Q217 PolarHBondContact O-OE1 3.45Å; L213-L230 HydrophobicContact CD1-CD1 3.71Å; L213-L230 HydrophobicContact CD1-CD2 4.28Å; L213-L230 HydrophobicContact CD1-CG 4.07Å; L213-L233 HydrophobicContact CD1-CB 4.28Å; L213-L233 HydrophobicContact CD2-CB 3.86Å; L213-L234 HydrophobicContact CD1-CD2 3.79Å; L213-L234 HydrophobicContact CD1-CG 4.22Å; L213-L234 HydrophobicContact CD2-CD2 4.49Å; L213-L234 HydrophobicContact CG-CD2 4Å
214	T	95.6	Very high	94.9	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.018	17%	0.17	C	C	.	.	H	α-helix	trans	60.2	160.7	-162.3	78.9	0	0	0	0	113.9	V210 T216 Q217 L218 C334 T340 F343	V210-T214 VanDerWaalsContact O-CA 3.26Å; V210-T214 WeakPolarHBondContact O-CA 3.02Å; V210-T214 PolarHBondContact O-N 3Å; T214-T216 PolarHBondContact OG1-N 3.26Å; T214-Q217 PolarHBondContact OG1-N 3.4Å; T214-Q217 VanDerWaalsContact OG1-N 3.15Å; T214-L218 VanDerWaalsContact O-CB 3.29Å; T214-L218 WeakPolarHBondContact O-CB 3.27Å; T214-L218 PolarHBondContact O-N 3.36Å; T214-C334 HydrophobicContact CG2-CB 3.81Å; T214-T340 WeakPolarHBondContact CB-O 3.32Å; T214-F343 HydrophobicContact CG2-CD1 4.05Å; T214-F343 HydrophobicContact CG2-CD2 3.72Å; T214-F343 HydrophobicContact CG2-CE1 3.96Å; T214-F343 HydrophobicContact CG2-CE2 3.63Å; T214-F343 HydrophobicContact CG2-CG 3.94Å; T214-F343 HydrophobicContact CG2-CZ 3.76Å
215	L	95.5	Very high	94.5	Very high	38 Å²	38	39.6 Å²	39.6	20%	0.199	19%	0.192	C	C	.	.	H	α-helix	trans	-74.2	-29.2	171.6	-176.8	57	0	0	0	111.7	V210 L218 N219 T340	V210-L215 HydrophobicContact CG1-CB 4.33Å; L215-L218 HydrophobicContact CD1-CD2 4.46Å; L215-N219 VanDerWaalsContact O-CB 3.3Å; L215-N219 WeakPolarHBondContact O-CB 3.39Å; L215-N219 VanDerWaalsContact O-CG 3.26Å; L215-N219 PolarHBondContact O-N 2.71Å; L215-N219 PolarHBondContact O-ND2 3.26Å; L215-T340 WeakPolarHBondContact CB-O 3.25Å; L215-T340 HydrophobicContact CD2-CG2 4.29Å; L215-T340 PolarHBondContact N-O 3.06Å
216	T	93.9	Very high	93.9	Very high	74 Å²	74	46.4 Å²	46.4	45%	0.454	22%	0.224	S	C	.	.	H	α-helix	trans	-66.8	-52.3	-179.2	-54.3	0	0	0	0	111.4	T214 L218 N219 H220 A341	T214-T216 PolarHBondContact OG1-N 3.26Å; T216-L218 VanDerWaalsContact C-N 3.34Å; T216-L218 PolarHBondContact O-N 2.86Å; T216-N219 PolarHBondContact O-N 2.8Å; T216-H220 VanDerWaalsContact O-CB 3.27Å; T216-H220 WeakPolarHBondContact O-CB 3.21Å; T216-H220 PolarHBondContact O-N 3.07Å; T216-A341 WeakPolarHBondContact CB-O 3.48Å; T216-A341 WeakPolarHBondContact OG1-CA 3.27Å; T216-A341 WeakPolarHBondContact OG1-CB 3.41Å; T216-A341 PolarHBondContact OG1-O 2.71Å
217	Q	93	Very high	93.4	Very high	52 Å²	52	51 Å²	51	24%	0.243	25%	0.25	C	C	.	.	H	α-helix	trans	-65.4	-41.2	178.4	-55.8	179.4	-36.2	0	0	110.4	L213 T214 N219 H220 I221	L213-Q217 VanDerWaalsContact O-CB 3.28Å; L213-Q217 WeakPolarHBondContact O-CB 3.46Å; L213-Q217 PolarHBondContact O-OE1 3.45Å; T214-Q217 PolarHBondContact OG1-N 3.4Å; T214-Q217 VanDerWaalsContact OG1-N 3.15Å; Q217-N219 PolarHBondContact O-N 3.41Å; Q217-H220 PolarHBondContact O-N 2.72Å; Q217-I221 HydrophobicContact CB-CD1 4.42Å; Q217-I221 WeakPolarHBondContact O-CB 3.3Å; Q217-I221 WeakPolarHBondContact O-CD1 3.25Å; Q217-I221 WeakPolarHBondContact O-CG1 3.36Å; Q217-I221 PolarHBondContact O-N 2.86Å
218	L	93.9	Very high	93.1	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-55.6	-50	176.2	-176.1	66	0	0	0	111.9	P182 L183 V210 T214 L215 T216 F222 L230	P182-L218 HydrophobicContact CG-CD1 4.1Å; P182-L218 HydrophobicContact CG-CD2 4.31Å; P182-L218 HydrophobicContact CG-CG 3.75Å; L183-L218 HydrophobicContact CD1-CD1 4.47Å; L183-L218 HydrophobicContact CD1-CD2 3.88Å; L183-L218 HydrophobicContact CD2-CD1 4.35Å; L183-L218 HydrophobicContact CG-CD1 4.48Å; L183-L218 HydrophobicContact CG-CD2 4.15Å; V210-L218 HydrophobicContact CG2-CD2 4.48Å; T214-L218 VanDerWaalsContact O-CB 3.29Å; T214-L218 WeakPolarHBondContact O-CB 3.27Å; T214-L218 PolarHBondContact O-N 3.36Å; L215-L218 HydrophobicContact CD1-CD2 4.46Å; T216-L218 VanDerWaalsContact C-N 3.34Å; T216-L218 PolarHBondContact O-N 2.86Å; L218-F222 HydrophobicContact CD1-CD2 4.09Å; L218-F222 HydrophobicContact CD1-CE2 3.91Å; L218-F222 WeakPolarHBondContact O-CD2 3.39Å; L218-F222 PolarHBondContact O-N 2.99Å; L218-L230 HydrophobicContact CD1-CD1 4.04Å; L218-L230 HydrophobicContact CD1-CD2 3.71Å
219	N	94.1	Very high	92.8	Very high	52 Å²	52	52.5 Å²	52.5	28%	0.278	26%	0.258	S	S	.	.	H	α-helix	trans	-63.8	-45.3	176.6	-76.2	-15.6	0	0	0	112.2	L215 T216 Q217 I221 F222 Q223	L215-N219 VanDerWaalsContact O-CB 3.3Å; L215-N219 WeakPolarHBondContact O-CB 3.39Å; L215-N219 VanDerWaalsContact O-CG 3.26Å; L215-N219 PolarHBondContact O-N 2.71Å; L215-N219 PolarHBondContact O-ND2 3.26Å; T216-N219 PolarHBondContact O-N 2.8Å; Q217-N219 PolarHBondContact O-N 3.41Å; N219-I221 PolarHBondContact O-N 3.34Å; N219-F222 PolarHBondContact O-N 2.95Å; N219-Q223 WeakPolarHBondContact O-CB 3.11Å; N219-Q223 WeakPolarHBondContact O-CG 3.45Å; N219-Q223 PolarHBondContact O-N 2.69Å
220	H	93.2	Very high	92.6	Very high	80 Å²	80	52.3 Å²	52.3	37%	0.37	26%	0.257	S	S	.	.	H	α-helix	trans	-58.9	-47.5	178.8	177.4	-97.3	0	0	0	111.9	T216 Q217 F222 Q223 H224	T216-H220 VanDerWaalsContact O-CB 3.27Å; T216-H220 WeakPolarHBondContact O-CB 3.21Å; T216-H220 PolarHBondContact O-N 3.07Å; Q217-H220 PolarHBondContact O-N 2.72Å; H220-F222 PolarHBondContact O-N 3.31Å; H220-Q223 PolarHBondContact O-N 3.07Å; H220-H224 AromaticContact CD2-CD2 3.49Å; H220-H224 PolarHBondContact CD2-CD2 3.43Å; H220-H224 VanDerWaalsContact CD2-CD2 3.49Å; H220-H224 AromaticContact CD2-NE2 3.6Å; H220-H224 AromaticContact CE1-CD2 3.83Å; H220-H224 AromaticContact CG-CD2 3.96Å; H220-H224 AromaticContact NE2-CD2 3.41Å; H220-H224 PolarHBondContact NE2-CD2 3.28Å; H220-H224 AromaticContact NE2-NE2 3.44Å; H220-H224 PolarHBondContact NE2-NE2 2.92Å; H220-H224 PolarHBondContact O-CD2 3.42Å; H220-H224 VanDerWaalsContact O-CD2 3.28Å; H220-H224 PolarHBondContact O-N 3.14Å
221	I	92.6	Very high	92.4	Very high	19 Å²	19	55.3 Å²	55.3	10%	0.097	27%	0.268	C	S	.	.	H	α-helix	trans	-55.8	-49.7	177.8	-70.6	159.4	0	0	0	110.7	Q217 N219 K225 Y228 L233	Q217-I221 HydrophobicContact CB-CD1 4.42Å; Q217-I221 WeakPolarHBondContact O-CB 3.3Å; Q217-I221 WeakPolarHBondContact O-CD1 3.25Å; Q217-I221 WeakPolarHBondContact O-CG1 3.36Å; Q217-I221 PolarHBondContact O-N 2.86Å; N219-I221 PolarHBondContact O-N 3.34Å; I221-K225 CarbonylContact O-C 3.54Å; I221-K225 WeakPolarHBondContact O-CA 3.37Å; I221-K225 WeakPolarHBondContact O-CB 3.24Å; I221-K225 PolarHBondContact O-N 2.94Å; I221-Y228 HydrophobicContact CG2-CD1 3.62Å; I221-Y228 HydrophobicContact CG2-CD2 4.12Å; I221-Y228 HydrophobicContact CG2-CE1 4.28Å; I221-Y228 HydrophobicContact CG2-CG 3.53Å; I221-L233 HydrophobicContact CD1-CD1 3.43Å; I221-L233 VanDerWaalsContact CD1-CD1 3.43Å
222	F	92.6	Very high	92.2	Very high	17 Å²	17	62.9 Å²	62.9	8%	0.075	30%	0.295	C	S	.	.	H	α-helix	trans	-77.1	-24.8	-177.6	-79.4	-82	0	0	0	113.8	P182 L218 N219 H220 Q226 L230	P182-F222 HydrophobicContact CB-CB 3.6Å; P182-F222 HydrophobicContact CB-CD1 4.16Å; P182-F222 HydrophobicContact CB-CD2 3.74Å; P182-F222 HydrophobicContact CB-CE2 4.46Å; P182-F222 HydrophobicContact CB-CG 3.55Å; P182-F222 HydrophobicContact CG-CB 3.85Å; P182-F222 HydrophobicContact CG-CD2 3.32Å; P182-F222 HydrophobicContact CG-CE2 4.01Å; P182-F222 HydrophobicContact CG-CG 3.68Å; L218-F222 HydrophobicContact CD1-CD2 4.09Å; L218-F222 HydrophobicContact CD1-CE2 3.91Å; L218-F222 WeakPolarHBondContact O-CD2 3.39Å; L218-F222 PolarHBondContact O-N 2.99Å; N219-F222 PolarHBondContact O-N 2.95Å; H220-F222 PolarHBondContact O-N 3.31Å; F222-Q226 WeakPolarHBondContact CD1-O 3.29Å; F222-Q226 VanDerWaalsContact O-CA 3.32Å; F222-Q226 WeakPolarHBondContact O-CA 3.47Å; F222-Q226 WeakPolarHBondContact O-CG 3.27Å; F222-Q226 PolarHBondContact O-N 3.41Å; F222-L230 HydrophobicContact CE2-CD1 4.14Å; F222-L230 HydrophobicContact CE2-CD2 4.35Å; F222-L230 HydrophobicContact CZ-CB 4.46Å
223	Q	90.9	Very high	92.1	Very high	145 Å²	145	61.9 Å²	61.9	68%	0.678	29%	0.289	S	S	*	.	H	α-helix	trans	-66.8	-43.4	170.4	-76.1	171	12.8	0	0	112.1	N219 H220	N219-Q223 WeakPolarHBondContact O-CB 3.11Å; N219-Q223 WeakPolarHBondContact O-CG 3.45Å; N219-Q223 PolarHBondContact O-N 2.69Å; H220-Q223 PolarHBondContact O-N 3.07Å
224	H	90.3	Very high	92	Very high	134 Å²	134	62.4 Å²	62.4	62%	0.62	29%	0.292	S	S	*	.	H	α-helix	trans	-84.2	-34.2	179.3	-73.2	-79.6	0	0	0	113.6	H220	H220-H224 AromaticContact CD2-CD2 3.49Å; H220-H224 PolarHBondContact CD2-CD2 3.43Å; H220-H224 VanDerWaalsContact CD2-CD2 3.49Å; H220-H224 AromaticContact CD2-NE2 3.6Å; H220-H224 AromaticContact CE1-CD2 3.83Å; H220-H224 AromaticContact CG-CD2 3.96Å; H220-H224 AromaticContact NE2-CD2 3.41Å; H220-H224 PolarHBondContact NE2-CD2 3.28Å; H220-H224 AromaticContact NE2-NE2 3.44Å; H220-H224 PolarHBondContact NE2-NE2 2.92Å; H220-H224 PolarHBondContact O-CD2 3.42Å; H220-H224 VanDerWaalsContact O-CD2 3.28Å; H220-H224 PolarHBondContact O-N 3.14Å
225	K	89.3	Confident	91.7	Very high	109 Å²	109	64.2 Å²	64.2	47%	0.474	31%	0.308	S	S	.	.			trans	-137.5	72.7	-174.6	-61.9	173.8	-171.4	163.3	0	109.5	E81 I221 N227 Y228	E81-K225 IonicContact OE1-NZ 2.78Å; I221-K225 CarbonylContact O-C 3.54Å; I221-K225 WeakPolarHBondContact O-CA 3.37Å; I221-K225 WeakPolarHBondContact O-CB 3.24Å; I221-K225 PolarHBondContact O-N 2.94Å; K225-N227 PolarHBondContact O-N 3.11Å; K225-Y228 HydrophobicContact CB-CD2 4.4Å; K225-Y228 HydrophobicContact CD-CD2 3.88Å; K225-Y228 HydrophobicContact CD-CE2 4.48Å; K225-Y228 VanDerWaalsContact O-CB 3.25Å; K225-Y228 WeakPolarHBondContact O-CB 3.49Å; K225-Y228 PolarHBondContact O-N 3.22Å
226	Q	85.8	Confident	91.4	Very high	143 Å²	143	64.9 Å²	64.9	67%	0.668	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	-31.8	177.3	-69.9	179.6	-11.9	0	0	114.1	F222	F222-Q226 WeakPolarHBondContact CD1-O 3.29Å; F222-Q226 VanDerWaalsContact O-CA 3.32Å; F222-Q226 WeakPolarHBondContact O-CA 3.47Å; F222-Q226 WeakPolarHBondContact O-CG 3.27Å; F222-Q226 PolarHBondContact O-N 3.41Å
227	N	87.9	Confident	91.3	Very high	110 Å²	110	62.1 Å²	62.1	59%	0.588	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	24.3	177.7	-75	-48	0	0	0	113.8	K132 K225	K132-N227 WeakPolarHBondContact CE-O 3.18Å; K132-N227 PolarHBondContact NZ-O 2.85Å; K225-N227 PolarHBondContact O-N 3.11Å
228	Y	91.1	Very high	91.2	Very high	30 Å²	30	62.9 Å²	62.9	12%	0.118	31%	0.311	C	S	.	.			trans	-63.4	153.2	173.9	-167.3	-94.8	0	0	0	111.6	K132 I221 K225 L230 L233	K132-Y228 WeakPolarHBondContact CD-O 3.19Å; I221-Y228 HydrophobicContact CG2-CD1 3.62Å; I221-Y228 HydrophobicContact CG2-CD2 4.12Å; I221-Y228 HydrophobicContact CG2-CE1 4.28Å; I221-Y228 HydrophobicContact CG2-CG 3.53Å; K225-Y228 HydrophobicContact CB-CD2 4.4Å; K225-Y228 HydrophobicContact CD-CD2 3.88Å; K225-Y228 HydrophobicContact CD-CE2 4.48Å; K225-Y228 VanDerWaalsContact O-CB 3.25Å; K225-Y228 WeakPolarHBondContact O-CB 3.49Å; K225-Y228 PolarHBondContact O-N 3.22Å; Y228-L230 HydrophobicContact CD1-CD1 4.49Å; Y228-L233 HydrophobicContact CE1-CD1 3.85Å; Y228-L233 HydrophobicContact CE1-CG 4Å; Y228-L233 WeakPolarHBondContact OH-CG 3.42Å
229	D	90.6	Very high	91.2	Very high	33 Å²	33	67 Å²	67	18%	0.176	33%	0.327	C	S	.	.			trans	-104.2	92.2	175.4	-173	-4.8	0	0	0	109.1	R231 R232	D229-R231 PolarHBondContact O-N 2.94Å; D229-R231 VanDerWaalsContact O-N 3.1Å; D229-R231 WeakPolarHBondContact OD1-CB 3.2Å; D229-R231 WeakPolarHBondContact OD1-CG 3.41Å; D229-R231 IonicContact OD1-CZ 3.22Å; D229-R231 PolarHBondContact OD1-N 3.07Å; D229-R231 IonicContact OD1-NE 3.12Å; D229-R231 PolarHBondContact OD1-NE 3.41Å; D229-R231 IonicContact OD1-NH2 2.64Å; D229-R231 IonicContact OD2-CZ 2.65Å; D229-R231 IonicContact OD2-NE 3.94Å; D229-R231 IonicContact OD2-NH2 3.42Å; D229-R231 PolarHBondContact OD2-NH2 3.27Å; D229-R232 HydrophobicContact CB-CG 4.44Å; D229-R232 WeakPolarHBondContact O-CB 3.47Å; D229-R232 WeakPolarHBondContact O-CG 3.41Å; D229-R232 PolarHBondContact O-N 2.76Å; D229-R232 VanDerWaalsContact O-N 3.14Å
230	L	93.4	Very high	91.2	Very high	1 Å²	1	64.8 Å²	64.8	1%	0.005	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-22	-171.5	-162.7	67.9	0	0	0	113.1	I134 L183 I209 L213 L218 F222 Y228 R232 L233 L234	I134-L230 HydrophobicContact CD1-CB 4.15Å; I134-L230 HydrophobicContact CD1-CD2 3.98Å; I134-L230 HydrophobicContact CG1-CB 4.18Å; I134-L230 HydrophobicContact CG2-CB 4.34Å; I134-L230 HydrophobicContact CG2-CD2 4.13Å; L183-L230 HydrophobicContact CD2-CD2 4.16Å; I209-L230 HydrophobicContact CG2-CD2 4.42Å; L213-L230 HydrophobicContact CD1-CD1 3.71Å; L213-L230 HydrophobicContact CD1-CD2 4.28Å; L213-L230 HydrophobicContact CD1-CG 4.07Å; L218-L230 HydrophobicContact CD1-CD1 4.04Å; L218-L230 HydrophobicContact CD1-CD2 3.71Å; F222-L230 HydrophobicContact CE2-CD1 4.14Å; F222-L230 HydrophobicContact CE2-CD2 4.35Å; F222-L230 HydrophobicContact CZ-CB 4.46Å; Y228-L230 HydrophobicContact CD1-CD1 4.49Å; L230-R232 PolarHBondContact O-N 2.78Å; L230-R232 VanDerWaalsContact O-N 3.09Å; L230-L233 HydrophobicContact CD1-CD1 4.33Å; L230-L233 PolarHBondContact O-N 3.23Å; L230-L234 HydrophobicContact CD2-CD1 4.15Å; L230-L234 HydrophobicContact CG-CD1 4.22Å; L230-L234 HydrophobicContact CG-CG 4.48Å; L230-L234 PolarHBondContact O-N 2.85Å
231	R	92.9	Very high	91.3	Very high	63 Å²	63	61.4 Å²	61.4	24%	0.238	30%	0.3	C	S	.	.	H	α-helix	trans	-55.9	-27.9	176.5	-59.4	179.5	-62.4	156.7	9.7	112.5	P133 I134 E142 D229 L233 L234 A235	P133-R231 VanDerWaalsContact O-CD 3.31Å; P133-R231 WeakPolarHBondContact O-CD 3.32Å; I134-R231 WeakPolarHBondContact O-CG 3.47Å; E142-R231 IonicContact OE1-CZ 2.67Å; E142-R231 IonicContact OE1-NH1 2.63Å; E142-R231 PolarHBondContact OE1-NH1 3.01Å; E142-R231 IonicContact OE1-NH2 3.51Å; E142-R231 IonicContact OE2-NH1 2.68Å; D229-R231 PolarHBondContact O-N 2.94Å; D229-R231 VanDerWaalsContact O-N 3.1Å; D229-R231 WeakPolarHBondContact OD1-CB 3.2Å; D229-R231 WeakPolarHBondContact OD1-CG 3.41Å; D229-R231 IonicContact OD1-CZ 3.22Å; D229-R231 PolarHBondContact OD1-N 3.07Å; D229-R231 IonicContact OD1-NE 3.12Å; D229-R231 PolarHBondContact OD1-NE 3.41Å; D229-R231 IonicContact OD1-NH2 2.64Å; D229-R231 IonicContact OD2-CZ 2.65Å; D229-R231 IonicContact OD2-NE 3.94Å; D229-R231 IonicContact OD2-NH2 3.42Å; D229-R231 PolarHBondContact OD2-NH2 3.27Å; R231-L233 VanDerWaalsContact C-N 3.29Å; R231-L233 PolarHBondContact O-N 3.05Å; R231-L234 PolarHBondContact O-N 3.11Å; R231-A235 WeakPolarHBondContact O-CB 3.32Å; R231-A235 PolarHBondContact O-N 2.84Å
232	R	91.9	Very high	91.4	Very high	174 Å²	174	62 Å²	62	66%	0.657	30%	0.303	S	S	*	.	H	α-helix	trans	-63.5	-32.2	176.1	-63.5	178.5	178	-151.8	-3.8	113.5	D229 L230	D229-R232 HydrophobicContact CB-CG 4.44Å; D229-R232 WeakPolarHBondContact O-CB 3.47Å; D229-R232 WeakPolarHBondContact O-CG 3.41Å; D229-R232 PolarHBondContact O-N 2.76Å; D229-R232 VanDerWaalsContact O-N 3.14Å; L230-R232 PolarHBondContact O-N 2.78Å; L230-R232 VanDerWaalsContact O-N 3.09Å
233	L	91.5	Very high	91.6	Very high	18 Å²	18	63.4 Å²	63.4	9%	0.094	31%	0.311	C	S	.	.	H	α-helix	trans	-93.8	-15.7	178.5	-60.5	176.6	0	0	0	112.7	F84 L213 I221 Y228 L230 R231	F84-L233 VanDerWaalsContact CE1-O 3.23Å; F84-L233 WeakPolarHBondContact CE1-O 3.43Å; F84-L233 WeakPolarHBondContact CZ-O 3.36Å; L213-L233 HydrophobicContact CD1-CB 4.28Å; L213-L233 HydrophobicContact CD2-CB 3.86Å; I221-L233 HydrophobicContact CD1-CD1 3.43Å; I221-L233 VanDerWaalsContact CD1-CD1 3.43Å; Y228-L233 HydrophobicContact CE1-CD1 3.85Å; Y228-L233 HydrophobicContact CE1-CG 4Å; Y228-L233 WeakPolarHBondContact OH-CG 3.42Å; L230-L233 HydrophobicContact CD1-CD1 4.33Å; L230-L233 PolarHBondContact O-N 3.23Å; R231-L233 VanDerWaalsContact C-N 3.29Å; R231-L233 PolarHBondContact O-N 3.05Å
234	L	91.9	Very high	91.8	Very high	15 Å²	15	56.5 Å²	56.5	8%	0.079	28%	0.279	C	S	.	.	H	α-helix	trans	-98.8	-3.3	175	-61.4	176.7	0	0	0	112.8	I134 I209 L212 L213 L230 R231 G236 S237	I134-L234 HydrophobicContact CG2-CD1 3.75Å; I209-L234 HydrophobicContact CG1-CD1 4.4Å; I209-L234 HydrophobicContact CG2-CD1 4.23Å; I209-L234 HydrophobicContact CG2-CD2 4.45Å; L212-L234 HydrophobicContact CB-CD2 4.28Å; L212-L234 HydrophobicContact CD1-CD2 3.99Å; L213-L234 HydrophobicContact CD1-CD2 3.79Å; L213-L234 HydrophobicContact CD1-CG 4.22Å; L213-L234 HydrophobicContact CD2-CD2 4.49Å; L213-L234 HydrophobicContact CG-CD2 4Å; L230-L234 HydrophobicContact CD2-CD1 4.15Å; L230-L234 HydrophobicContact CG-CD1 4.22Å; L230-L234 HydrophobicContact CG-CG 4.48Å; L230-L234 PolarHBondContact O-N 2.85Å; R231-L234 PolarHBondContact O-N 3.11Å; L234-G236 PolarHBondContact O-N 2.76Å; L234-S237 WeakPolarHBondContact O-CB 3.29Å; L234-S237 PolarHBondContact O-N 3.33Å; L234-S237 PolarHBondContact O-OG 3.39Å
235	A	90	Very high	92.1	Very high	42 Å²	42	50.1 Å²	50.1	35%	0.347	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	125.7	-178.6	0	0	0	0	0	111.5	R231 S237 E238	R231-A235 WeakPolarHBondContact O-CB 3.32Å; R231-A235 PolarHBondContact O-N 2.84Å; A235-S237 VanDerWaalsContact C-N 3.31Å; A235-E238 WeakPolarHBondContact CA-OE1 3.4Å
236	G	88.4	Confident	92.3	Very high	51 Å²	51	48.9 Å²	48.9	53%	0.526	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	2.1	-177.1	0	0	0	0	0	114.9	L234 E238 Y239	L234-G236 PolarHBondContact O-N 2.76Å; G236-E238 VanDerWaalsContact C-OE2 3.27Å; G236-E238 WeakPolarHBondContact CA-OE2 3.29Å; G236-E238 VanDerWaalsContact N-CD 3.33Å; G236-E238 PolarHBondContact N-OE1 3.12Å; G236-E238 VanDerWaalsContact N-OE1 3.13Å; G236-E238 PolarHBondContact N-OE2 2.89Å; G236-Y239 WeakPolarHBondContact O-CD1 3.5Å; G236-Y239 WeakPolarHBondContact O-CE1 3.48Å
237	S	91.5	Very high	92.7	Very high	16 Å²	16	43.5 Å²	43.5	11%	0.112	22%	0.219	C	C	.	.			trans	-110.2	0.3	174.9	74.6	0	0	0	0	113.7	L212 L234 A235 Y239 L240	L212-S237 WeakPolarHBondContact CD1-OG 3.27Å; L234-S237 WeakPolarHBondContact O-CB 3.29Å; L234-S237 PolarHBondContact O-N 3.33Å; L234-S237 PolarHBondContact O-OG 3.39Å; A235-S237 VanDerWaalsContact C-N 3.31Å; S237-Y239 PolarHBondContact O-N 3.29Å; S237-L240 WeakPolarHBondContact O-CB 3.23Å; S237-L240 PolarHBondContact O-N 3.45Å
238	E	91.7	Very high	92.9	Very high	69 Å²	69	38.7 Å²	38.7	32%	0.322	19%	0.193	S	C	.	.	H	α-helix	trans	-59	-36.2	-175	-51.6	85.1	167	0	0	111.5	A235 G236 L240 T241 D242	A235-E238 WeakPolarHBondContact CA-OE1 3.4Å; G236-E238 VanDerWaalsContact C-OE2 3.27Å; G236-E238 WeakPolarHBondContact CA-OE2 3.29Å; G236-E238 VanDerWaalsContact N-CD 3.33Å; G236-E238 PolarHBondContact N-OE1 3.12Å; G236-E238 VanDerWaalsContact N-OE1 3.13Å; G236-E238 PolarHBondContact N-OE2 2.89Å; E238-L240 PolarHBondContact O-N 2.81Å; E238-L240 VanDerWaalsContact O-N 3.13Å; E238-T241 WeakPolarHBondContact O-CB 3.5Å; E238-T241 PolarHBondContact O-N 3.06Å; E238-D242 PolarHBondContact O-N 3.18Å
239	Y	92.9	Very high	92.8	Very high	87 Å²	87	39.5 Å²	39.5	34%	0.341	20%	0.198	S	C	.	.	H	α-helix	trans	-56.8	-27.4	177.6	76.9	-85.1	0	0	0	113.1	G236 S237 N243 S321	G236-Y239 WeakPolarHBondContact O-CD1 3.5Å; G236-Y239 WeakPolarHBondContact O-CE1 3.48Å; S237-Y239 PolarHBondContact O-N 3.29Å; Y239-N243 VanDerWaalsContact O-CB 3.3Å; Y239-N243 WeakPolarHBondContact O-CB 3.17Å; Y239-N243 PolarHBondContact O-N 3.37Å; Y239-N243 PolarHBondContact O-ND2 2.95Å; Y239-S321 PolarHBondContact OH-OG 3.49Å
240	L	95.1	Very high	92.8	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.026	21%	0.208	C	C	.	.	H	α-helix	trans	-68.9	-41.6	174.8	-63.1	173.8	0	0	0	111.1	L212 S237 E238 L244 N316 L317	L212-L240 HydrophobicContact CD2-CD1 3.82Å; S237-L240 WeakPolarHBondContact O-CB 3.23Å; S237-L240 PolarHBondContact O-N 3.45Å; E238-L240 PolarHBondContact O-N 2.81Å; E238-L240 VanDerWaalsContact O-N 3.13Å; L240-L244 VanDerWaalsContact O-CB 3.3Å; L240-L244 WeakPolarHBondContact O-CB 3.38Å; L240-L244 PolarHBondContact O-N 3.12Å; L240-N316 PolarHBondContact O-ND2 2.85Å; L240-L317 HydrophobicContact CD1-CD1 4.17Å; L240-L317 HydrophobicContact CD2-CD1 4.17Å
241	T	95.9	Very high	92.8	Very high	9 Å²	9	44.2 Å²	44.2	6%	0.055	22%	0.216	C	C	.	.	H	α-helix	trans	-70.8	-40.1	176.3	-54.6	0	0	0	0	110.9	Y135 I205 E238 L244 L245	Y135-T241 HydrophobicContact CD1-CG2 4.15Å; Y135-T241 HydrophobicContact CD2-CG2 4.32Å; Y135-T241 HydrophobicContact CE1-CG2 3.76Å; Y135-T241 HydrophobicContact CE2-CG2 3.94Å; Y135-T241 HydrophobicContact CG-CG2 4.42Å; I205-T241 HydrophobicContact CG2-CG2 4.06Å; E238-T241 WeakPolarHBondContact O-CB 3.5Å; E238-T241 PolarHBondContact O-N 3.06Å; T241-L244 PolarHBondContact O-N 3.26Å; T241-L245 HydrophobicContact CG2-CD1 4.43Å; T241-L245 PolarHBondContact O-N 2.89Å
242	D	94.7	Very high	92.8	Very high	30 Å²	30	42.3 Å²	42.3	16%	0.16	21%	0.211	C	C	.	.	H	α-helix	trans	-61.1	-46.3	175.3	-65.5	-36	0	0	0	110.9	K108 Y135 E238 L245 H246	K108-D242 IonicContact NZ-OD2 2.83Å; K108-D242 PolarHBondContact NZ-OD2 3.06Å; K108-D242 VanDerWaalsContact NZ-OD2 3.13Å; Y135-D242 VanDerWaalsContact CE2-OD1 3.32Å; Y135-D242 WeakPolarHBondContact CE2-OD1 3.41Å; Y135-D242 PolarHBondContact OH-OD1 3.21Å; E238-D242 PolarHBondContact O-N 3.18Å; D242-L245 PolarHBondContact O-N 3.26Å; D242-H246 PolarHBondContact O-N 3.46Å; D242-H246 PolarHBondContact O-ND1 2.9Å
243	N	95.5	Very high	92.9	Very high	47 Å²	47	34 Å²	34	25%	0.251	18%	0.18	S	C	.	.	H	α-helix	trans	-65	-42.8	174.6	-84.7	-75.8	0	0	0	112.6	Y239 L245 H246 R247 S320	Y239-N243 VanDerWaalsContact O-CB 3.3Å; Y239-N243 WeakPolarHBondContact O-CB 3.17Å; Y239-N243 PolarHBondContact O-N 3.37Å; Y239-N243 PolarHBondContact O-ND2 2.95Å; N243-L245 PolarHBondContact O-N 3.45Å; N243-H246 PolarHBondContact O-N 3.36Å; N243-H246 VanDerWaalsContact O-N 3.16Å; N243-R247 WeakPolarHBondContact O-CG 3.36Å; N243-R247 PolarHBondContact O-N 3.39Å; N243-S320 VanDerWaalsContact CB-OG 3.32Å; N243-S320 WeakPolarHBondContact CB-OG 3.3Å
244	L	96.6	Very high	93	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.1	-37.5	177.4	-176.4	58.3	0	0	0	111.8	Q208 L240 T241 R247 L248 L254 L313 N316	Q208-L244 HydrophobicContact CB-CD2 3.65Å; Q208-L244 HydrophobicContact CG-CD2 4.03Å; L240-L244 VanDerWaalsContact O-CB 3.3Å; L240-L244 WeakPolarHBondContact O-CB 3.38Å; L240-L244 PolarHBondContact O-N 3.12Å; T241-L244 PolarHBondContact O-N 3.26Å; L244-R247 PolarHBondContact O-N 2.99Å; L244-L248 HydrophobicContact CG-CD1 4.27Å; L244-L248 VanDerWaalsContact O-CG 3.27Å; L244-L248 WeakPolarHBondContact O-CG 3.35Å; L244-L248 PolarHBondContact O-N 3.23Å; L244-L254 HydrophobicContact CD1-CD2 3.75Å; L244-L313 HydrophobicContact CD2-CD2 3.91Å; L244-N316 PolarHBondContact N-OD1 3.3Å
245	L	95.1	Very high	93.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.3	-41.3	176.2	-89.5	162.2	0	0	0	113.1	V124 Y135 R137 I205 T241 D242 N243 R247 L248 E249	V124-L245 HydrophobicContact CB-CD1 4.36Å; V124-L245 HydrophobicContact CG2-CD1 4.39Å; V124-L245 HydrophobicContact CG2-CD2 3.9Å; Y135-L245 HydrophobicContact CE1-CD1 3.97Å; Y135-L245 WeakPolarHBondContact OH-CD1 3.4Å; R137-L245 HydrophobicContact CB-CD1 4.42Å; R137-L245 HydrophobicContact CG-CD1 4.16Å; I205-L245 HydrophobicContact CD1-CD2 4.15Å; I205-L245 HydrophobicContact CD1-CG 4.42Å; T241-L245 HydrophobicContact CG2-CD1 4.43Å; T241-L245 PolarHBondContact O-N 2.89Å; D242-L245 PolarHBondContact O-N 3.26Å; N243-L245 PolarHBondContact O-N 3.45Å; L245-R247 VanDerWaalsContact C-N 3.33Å; L245-L248 HydrophobicContact CD2-CD1 4.37Å; L245-L248 PolarHBondContact O-N 3.23Å; L245-E249 PolarHBondContact O-N 2.43Å
246	H	93.4	Very high	93.3	Very high	83 Å²	83	30.9 Å²	30.9	38%	0.384	16%	0.157	S	C	.	.	H	α-helix	trans	-64.8	-37.3	172.2	-68.2	97	0	0	0	111.9	D242 N243 E249 R250	D242-H246 PolarHBondContact O-N 3.46Å; D242-H246 PolarHBondContact O-ND1 2.9Å; N243-H246 PolarHBondContact O-N 3.36Å; N243-H246 VanDerWaalsContact O-N 3.16Å; H246-E249 PolarHBondContact O-N 3.34Å; H246-R250 PolarHBondContact O-N 3.16Å
247	R	94.2	Very high	93.5	Very high	31 Å²	31	29.8 Å²	29.8	12%	0.117	14%	0.142	C	C	.	.	H	α-helix	trans	-65	-43.2	174	-70.3	-172.9	68.6	133.4	12.8	112.8	N243 L244 L245 E249 R250 D251 L254 D293	N243-R247 WeakPolarHBondContact O-CG 3.36Å; N243-R247 PolarHBondContact O-N 3.39Å; L244-R247 PolarHBondContact O-N 2.99Å; L245-R247 VanDerWaalsContact C-N 3.33Å; R247-E249 PolarHBondContact O-N 2.05Å; R247-E249 VanDerWaalsContact O-N 3.16Å; R247-R250 PolarHBondContact O-N 2.99Å; R247-R250 VanDerWaalsContact O-N 3.08Å; R247-D251 IonicContact CZ-OD2 2.73Å; R247-D251 IonicContact NE-OD2 3.65Å; R247-D251 IonicContact NH2-OD2 3.61Å; R247-D251 PolarHBondContact NH2-OD2 3.35Å; R247-D251 WeakPolarHBondContact O-CB 3.45Å; R247-D251 PolarHBondContact O-N 2.88Å; R247-L254 HydrophobicContact CB-CD1 4.31Å; R247-D293 IonicContact CZ-OD1 3.76Å; R247-D293 IonicContact NH1-OD1 3.65Å; R247-D293 PolarHBondContact NH1-OD1 3.19Å; R247-D293 IonicContact NH1-OD2 3.5Å; R247-D293 IonicContact NH2-OD1 2.75Å; R247-D293 PolarHBondContact NH2-OD1 2.88Å; R247-D293 IonicContact NH2-OD2 3.56Å
248	L	92.9	Very high	93.7	Very high	9 Å²	9	29 Å²	29	5%	0.047	14%	0.137	C	C	.	.	H	α-helix	trans	-57.7	-28	177.1	-76.3	164.6	0	0	0	112.6	E201 Y204 L244 L245 L254	E201-L248 HydrophobicContact CB-CD1 4.05Å; E201-L248 HydrophobicContact CG-CB 4.28Å; E201-L248 HydrophobicContact CG-CD1 4.16Å; E201-L248 HydrophobicContact CG-CD2 4.11Å; E201-L248 HydrophobicContact CG-CG 4.42Å; Y204-L248 HydrophobicContact CD2-CD2 3.66Å; Y204-L248 HydrophobicContact CE2-CD2 4.29Å; Y204-L248 HydrophobicContact CG-CD2 4Å; L244-L248 HydrophobicContact CG-CD1 4.27Å; L244-L248 VanDerWaalsContact O-CG 3.27Å; L244-L248 WeakPolarHBondContact O-CG 3.35Å; L244-L248 PolarHBondContact O-N 3.23Å; L245-L248 HydrophobicContact CD2-CD1 4.37Å; L245-L248 PolarHBondContact O-N 3.23Å; L248-L254 HydrophobicContact CD2-CB 3.83Å; L248-L254 HydrophobicContact CD2-CD2 3.45Å; L248-L254 VanDerWaalsContact CD2-CD2 3.45Å; L248-L254 HydrophobicContact CD2-CG 4.27Å; L248-L254 HydrophobicContact CG-CD2 3.82Å
249	E	89.3	Confident	93.8	Very high	47 Å²	47	25.9 Å²	25.9	22%	0.22	12%	0.122	C	C	.	.	H	α-helix	trans	-85.1	-20.1	178.6	-70.5	176.9	160.2	0	0	114.2	K122 R137 L245 H246 R247 M443	K122-E249 WeakPolarHBondContact CE-OE1 3.31Å; K122-E249 IonicContact NZ-OE1 3.85Å; K122-E249 PolarHBondContact NZ-OE1 2.98Å; K122-E249 VanDerWaalsContact NZ-OE1 3.15Å; R137-E249 IonicContact CZ-OE1 3.57Å; R137-E249 IonicContact CZ-OE2 3.65Å; R137-E249 IonicContact NH1-OE1 3.86Å; R137-E249 PolarHBondContact NH1-OE1 2.94Å; R137-E249 IonicContact NH1-OE2 3.61Å; R137-E249 VanDerWaalsContact NH2-CD 3.3Å; R137-E249 IonicContact NH2-OE1 2.83Å; R137-E249 PolarHBondContact NH2-OE1 3.49Å; R137-E249 IonicContact NH2-OE2 3.63Å; R137-E249 PolarHBondContact NH2-OE2 2.84Å; L245-E249 PolarHBondContact O-N 2.43Å; H246-E249 PolarHBondContact O-N 3.34Å; R247-E249 PolarHBondContact O-N 2.05Å; R247-E249 VanDerWaalsContact O-N 3.16Å; E249-M443 VanDerWaalsContact O-CG 3.31Å; E249-M443 WeakPolarHBondContact O-CG 3.15Å
250	R	89.9	Confident	93.8	Very high	103 Å²	103	22.7 Å²	22.7	39%	0.389	11%	0.111	S	C	.	.	H	α-helix	trans	-124.4	-30.1	-169.4	-66.6	-174.8	170.7	-140.1	-5.9	115.8	H246 R247 P252 D436 E440	H246-R250 PolarHBondContact O-N 3.16Å; R247-R250 PolarHBondContact O-N 2.99Å; R247-R250 VanDerWaalsContact O-N 3.08Å; R250-P252 WeakPolarHBondContact O-CD 3.13Å; R250-D436 IonicContact CZ-OD1 2.69Å; R250-D436 VanDerWaalsContact CZ-OD1 3.24Å; R250-D436 IonicContact NH1-OD1 2.72Å; R250-D436 PolarHBondContact NH1-OD1 3.29Å; R250-D436 IonicContact NH2-OD1 3.81Å; R250-D436 PolarHBondContact NH2-OD1 3.28Å; R250-E440 IonicContact NH2-OE1 3.51Å; R250-E440 PolarHBondContact NH2-OE1 3.13Å
251	D	92.7	Very high	93.7	Very high	30 Å²	30	22.7 Å²	22.7	16%	0.16	11%	0.112	C	C	.	.			trans	-92.6	114	-174.9	178.5	-7.1	0	0	0	111	R247 G253 L254 Y424	R247-D251 IonicContact CZ-OD2 2.73Å; R247-D251 IonicContact NE-OD2 3.65Å; R247-D251 IonicContact NH2-OD2 3.61Å; R247-D251 PolarHBondContact NH2-OD2 3.35Å; R247-D251 WeakPolarHBondContact O-CB 3.45Å; R247-D251 PolarHBondContact O-N 2.88Å; D251-G253 PolarHBondContact O-N 2.82Å; D251-G253 WeakPolarHBondContact OD1-CA 3.44Å; D251-G253 PolarHBondContact OD1-N 3.27Å; D251-L254 HydrophobicContact CB-CD1 3.6Å; D251-L254 PolarHBondContact O-N 3.22Å; D251-L254 WeakPolarHBondContact OD2-CD1 3.09Å; D251-Y424 PolarHBondContact OD1-OH 2.89Å
252	P	93.8	Very high	93.6	Very high	23 Å²	23	22.3 Å²	22.3	15%	0.149	11%	0.109	C	C	.	.	H	α-helix	trans	-60.2	-17.9	178.5	-22.8	34	0	0	0	114.2	R250 L255 L256 L415 Y424 M443	R250-P252 WeakPolarHBondContact O-CD 3.13Å; P252-L255 PolarHBondContact O-N 3.1Å; P252-L256 HydrophobicContact CB-CD1 4.4Å; P252-L256 VanDerWaalsContact O-CB 3.27Å; P252-L256 WeakPolarHBondContact O-CB 3.43Å; P252-L256 WeakPolarHBondContact O-CG 3.32Å; P252-L256 PolarHBondContact O-N 3.04Å; P252-L415 HydrophobicContact CB-CD1 3.79Å; P252-L415 HydrophobicContact CB-CD2 3.76Å; P252-L415 HydrophobicContact CB-CG 4.43Å; P252-L415 HydrophobicContact CG-CD1 4.32Å; P252-L415 HydrophobicContact CG-CD2 3.85Å; P252-Y424 HydrophobicContact CB-CE2 3.88Å; P252-Y424 HydrophobicContact CG-CE2 4.46Å; P252-M443 HydrophobicContact CG-SD 4.35Å
253	G	94.1	Very high	93.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-64	-39.9	179	0	0	0	0	0	113.2	D251 L256 S257 A258 H312 Y424	D251-G253 PolarHBondContact O-N 2.82Å; D251-G253 WeakPolarHBondContact OD1-CA 3.44Å; D251-G253 PolarHBondContact OD1-N 3.27Å; G253-L256 PolarHBondContact O-N 2.97Å; G253-S257 WeakPolarHBondContact O-CA 3.38Å; G253-S257 PolarHBondContact O-N 2.87Å; G253-A258 CarbonylContact C-O 3.53Å; G253-A258 WeakPolarHBondContact CA-O 3.3Å; G253-A258 PolarHBondContact O-N 2.88Å; G253-A258 VanDerWaalsContact O-O 3.13Å; G253-H312 PolarHBondContact O-CE1 3.37Å; G253-Y424 VanDerWaalsContact N-CZ 3.32Å; G253-Y424 PolarHBondContact N-OH 2.95Å; G253-Y424 VanDerWaalsContact N-OH 3.12Å
254	L	94.1	Very high	93.4	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.005	9%	0.094	C	C	.	.	H	α-helix	trans	-73.2	-31.6	178	-65	91.1	0	0	0	111.4	R200 Y204 L244 R247 L248 D251 H312	R200-L254 PolarHBondContact NE-O 3.39Å; Y204-L254 HydrophobicContact CD1-CD2 4.21Å; Y204-L254 HydrophobicContact CE1-CD2 4.16Å; Y204-L254 HydrophobicContact CE2-CB 4.34Å; Y204-L254 HydrophobicContact CG-CD2 4.46Å; L244-L254 HydrophobicContact CD1-CD2 3.75Å; R247-L254 HydrophobicContact CB-CD1 4.31Å; L248-L254 HydrophobicContact CD2-CB 3.83Å; L248-L254 HydrophobicContact CD2-CD2 3.45Å; L248-L254 VanDerWaalsContact CD2-CD2 3.45Å; L248-L254 HydrophobicContact CD2-CG 4.27Å; L248-L254 HydrophobicContact CG-CD2 3.82Å; D251-L254 HydrophobicContact CB-CD1 3.6Å; D251-L254 PolarHBondContact O-N 3.22Å; D251-L254 WeakPolarHBondContact OD2-CD1 3.09Å; L254-H312 VanDerWaalsContact CA-CE1 3.43Å; L254-H312 WeakPolarHBondContact CA-CE1 3.34Å; L254-H312 PolarHBondContact N-CE1 3.33Å
255	L	93.4	Very high	93.2	Very high	5 Å²	5	21.9 Å²	21.9	3%	0.026	12%	0.115	C	C	.	.	H	α-helix	trans	-66.6	-44.4	169.9	172.3	60.8	0	0	0	111.9	R200 P252 M443 Q447 H450	R200-L255 PolarHBondContact NH1-O 3.28Å; P252-L255 PolarHBondContact O-N 3.1Å; L255-M443 HydrophobicContact CB-CE 3.7Å; L255-M443 HydrophobicContact CD2-CE 3.78Å; L255-M443 HydrophobicContact CD2-SD 4.03Å; L255-M443 HydrophobicContact CG-CE 4.36Å; L255-Q447 HydrophobicContact CD1-CG 4.23Å; L255-Q447 HydrophobicContact CD2-CG 4.06Å; L255-H450 HydrophobicContact CD1-CB 3.82Å; L255-H450 VanDerWaalsContact CD1-CG 3.46Å; L255-H450 HydrophobicContact CD2-CB 4.49Å; L255-H450 HydrophobicContact CG-CB 4.38Å; L255-H450 PolarHBondContact O-NE2 3.08Å
256	L	94.1	Very high	93	Very high	2 Å²	2	24 Å²	24	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-84.5	-8.5	-175.6	-67.7	174.7	0	0	0	113.7	P252 G253 A258 L415 K417 Y424 Y483	P252-L256 HydrophobicContact CB-CD1 4.4Å; P252-L256 VanDerWaalsContact O-CB 3.27Å; P252-L256 WeakPolarHBondContact O-CB 3.43Å; P252-L256 WeakPolarHBondContact O-CG 3.32Å; P252-L256 PolarHBondContact O-N 3.04Å; G253-L256 PolarHBondContact O-N 2.97Å; L256-A258 VanDerWaalsContact C-N 3.3Å; L256-A258 HydrophobicContact CB-CB 4.18Å; L256-A258 PolarHBondContact O-N 2.84Å; L256-L415 HydrophobicContact CD1-CB 4.11Å; L256-L415 HydrophobicContact CD1-CD1 4.28Å; L256-K417 HydrophobicContact CB-CD 4.28Å; L256-K417 HydrophobicContact CD1-CB 4.5Å; L256-K417 VanDerWaalsContact O-CD 3.3Å; L256-K417 WeakPolarHBondContact O-CD 3.43Å; L256-K417 WeakPolarHBondContact O-CE 3.21Å; L256-K417 PolarHBondContact O-NZ 3.39Å; L256-Y424 HydrophobicContact CD1-CD2 3.84Å; L256-Y424 HydrophobicContact CD1-CE2 4.46Å; L256-Y424 HydrophobicContact CD1-CG 3.91Å; L256-Y483 HydrophobicContact CD2-CD2 3.95Å; L256-Y483 HydrophobicContact CD2-CE2 3.36Å
257	S	93.7	Very high	92.9	Very high	29 Å²	29	24 Å²	24	20%	0.203	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	47.4	-169.6	-68.4	0	0	0	0	111.7	G253 H308	G253-S257 WeakPolarHBondContact O-CA 3.38Å; G253-S257 PolarHBondContact O-N 2.87Å; S257-H308 WeakPolarHBondContact CB-CE1 3.43Å; S257-H308 PolarHBondContact OG-CE1 3.23Å
258	A	94.7	Very high	92.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.141	C	C	.	.			trans	-149.3	161.9	-173.9	0	0	0	0	0	111.9	G253 L256 H312 K417 G422 Y424	G253-A258 CarbonylContact C-O 3.53Å; G253-A258 WeakPolarHBondContact CA-O 3.3Å; G253-A258 PolarHBondContact O-N 2.88Å; G253-A258 VanDerWaalsContact O-O 3.13Å; L256-A258 VanDerWaalsContact C-N 3.3Å; L256-A258 HydrophobicContact CB-CB 4.18Å; L256-A258 PolarHBondContact O-N 2.84Å; A258-H312 PolarHBondContact N-CE1 3.17Å; A258-H312 PolarHBondContact O-CE1 3.41Å; A258-H312 VanDerWaalsContact O-CE1 3.23Å; A258-H312 PolarHBondContact O-NE2 2.93Å; A258-K417 HydrophobicContact CB-CD 4.41Å; A258-K417 HydrophobicContact CB-CG 4.08Å; A258-G422 VanDerWaalsContact CA-O 3.24Å; A258-G422 WeakPolarHBondContact CA-O 3.49Å; A258-G422 WeakPolarHBondContact CB-O 3.34Å; A258-Y424 HydrophobicContact CB-CD1 3.9Å; A258-Y424 HydrophobicContact CB-CG 4.38Å
259	V	93.9	Very high	92.8	Very high	3 Å²	3	23.7 Å²	23.7	2%	0.018	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	147	-177.6	-168.3	0	0	0	0	110.7	L295 H308 L311 H312 F315 G422 L423 Y424	V259-L295 HydrophobicContact CG1-CB 4.32Å; V259-H308 HydrophobicContact CG2-CB 4.48Å; V259-L311 HydrophobicContact CG2-CB 4.1Å; V259-L311 HydrophobicContact CG2-CD1 3.95Å; V259-H312 WeakPolarHBondContact CA-NE2 3.44Å; V259-H312 VanDerWaalsContact CG2-NE2 3.32Å; V259-H312 WeakPolarHBondContact CG2-NE2 3.4Å; V259-H312 PolarHBondContact N-NE2 2.86Å; V259-F315 HydrophobicContact CG1-CD2 4.44Å; V259-F315 HydrophobicContact CG1-CE2 3.36Å; V259-F315 HydrophobicContact CG1-CZ 3.45Å; V259-F315 VanDerWaalsContact CG1-CZ 3.45Å; V259-G422 PolarHBondContact N-O 3.35Å; V259-G422 VanDerWaalsContact N-O 3.13Å; V259-L423 HydrophobicContact CB-CD2 4.12Å; V259-L423 CarbonylContact O-C 3.44Å; V259-L423 VanDerWaalsContact O-CA 3.25Å; V259-L423 WeakPolarHBondContact O-CA 3.47Å; V259-L423 WeakPolarHBondContact O-CD2 3.5Å; V259-Y424 PolarHBondContact O-N 2.94Å
260	T	93	Very high	93	Very high	19 Å²	19	25.1 Å²	25.1	12%	0.117	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	155.3	170.8	68.8	0	0	0	0	111.6	D293 L295 Y424	T260-D293 PolarHBondContact OG1-O 3.04Å; T260-L295 WeakPolarHBondContact O-CB 3.38Å; T260-L295 PolarHBondContact O-N 3.35Å; T260-Y424 HydrophobicContact CG2-CD1 3.99Å; T260-Y424 HydrophobicContact CG2-CD2 4.32Å; T260-Y424 HydrophobicContact CG2-CE1 3.31Å; T260-Y424 HydrophobicContact CG2-CE2 3.7Å; T260-Y424 HydrophobicContact CG2-CG 4.46Å; T260-Y424 WeakPolarHBondContact CG2-OH 3.3Å
261	C	93	Very high	93.2	Very high	6 Å²	6	22.3 Å²	22.3	4%	0.041	14%	0.143	C	C	.	.	B	Isolated β-bridge	trans	-116.9	146.8	173.5	-172	0	0	0	0	110.5	P263 R269 L295 L423 L513	C261-P263 WeakPolarHBondContact O-CD 3.45Å; C261-R269 VanDerWaalsContact SG-CZ 3.53Å; C261-R269 PolarHBondContact SG-NH1 3.17Å; C261-R269 PolarHBondContact SG-NH2 3.33Å; C261-R269 VanDerWaalsContact SG-NH2 3.39Å; C261-L295 CarbonylContact C-O 3.59Å; C261-L295 VanDerWaalsContact CA-O 3.29Å; C261-L295 WeakPolarHBondContact CA-O 3.32Å; C261-L295 PolarHBondContact SG-O 2.79Å; C261-L423 HydrophobicContact CB-CD1 4.43Å; C261-L513 WeakPolarHBondContact CB-O 3.49Å
262	L	93.9	Very high	93.3	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	14%	0.136	C	C	.	.			trans	-69.7	126	169.5	-173.3	68.4	0	0	0	108.9	L264 R269 A291 R294 L295 V296 A395 L396 Q399	L262-L264 HydrophobicContact CB-CD1 4.45Å; L262-L264 HydrophobicContact CD2-CD1 4.02Å; L262-L264 HydrophobicContact CD2-CD2 4.39Å; L262-L264 HydrophobicContact CD2-CG 4.1Å; L262-L264 HydrophobicContact CG-CD1 4.41Å; L262-L264 HydrophobicContact CG-CG 4.18Å; L262-L264 PolarHBondContact O-N 2.87Å; L262-R269 PolarHBondContact O-NH2 2.76Å; L262-A291 HydrophobicContact CB-CB 4.48Å; L262-A291 HydrophobicContact CD1-CB 4.39Å; L262-A291 HydrophobicContact CD2-CB 3.86Å; L262-A291 HydrophobicContact CG-CB 4.48Å; L262-R294 HydrophobicContact CB-CB 4.17Å; L262-L295 PolarHBondContact N-O 2.96Å; L262-V296 HydrophobicContact CB-CG2 4.19Å; L262-V296 HydrophobicContact CD2-CG2 4.02Å; L262-A395 HydrophobicContact CD2-CB 4.13Å; L262-A395 HydrophobicContact CG-CB 4.46Å; L262-L396 HydrophobicContact CD2-CD2 4.44Å; L262-Q399 HydrophobicContact CD1-CB 4.19Å; L262-Q399 HydrophobicContact CD1-CG 4.41Å
263	P	92.9	Very high	93.3	Very high	8 Å²	8	20 Å²	20	5%	0.052	13%	0.131	C	C	.	.			trans	-64.3	106.1	177.8	-23.9	36.1	0	0	0	111.7	C261 Q399 R512 L513	C261-P263 WeakPolarHBondContact O-CD 3.45Å; P263-Q399 VanDerWaalsContact CD-O 3.27Å; P263-Q399 WeakPolarHBondContact CD-O 3.47Å; P263-R512 WeakPolarHBondContact CA-O 3.42Å; P263-R512 HydrophobicContact CB-CG 4.17Å; P263-L513 HydrophobicContact CB-CD2 4.16Å; P263-L513 HydrophobicContact CG-CD2 4.12Å
264	L	92.5	Very high	93.3	Very high	7 Å²	7	22.3 Å²	22.3	4%	0.037	15%	0.146	C	C	.	.			trans	-139.8	136.8	-174.4	-77.3	173	0	0	0	110.7	L262 S266 V268 R269 V296 M392 A395 R512	L262-L264 HydrophobicContact CB-CD1 4.45Å; L262-L264 HydrophobicContact CD2-CD1 4.02Å; L262-L264 HydrophobicContact CD2-CD2 4.39Å; L262-L264 HydrophobicContact CD2-CG 4.1Å; L262-L264 HydrophobicContact CG-CD1 4.41Å; L262-L264 HydrophobicContact CG-CG 4.18Å; L262-L264 PolarHBondContact O-N 2.87Å; L264-S266 PolarHBondContact O-N 3.21Å; L264-V268 HydrophobicContact CD2-CG1 4.44Å; L264-R269 PolarHBondContact O-NH2 3.38Å; L264-V296 HydrophobicContact CD1-CG1 3.71Å; L264-M392 HydrophobicContact CD1-CG 4.26Å; L264-M392 HydrophobicContact CD2-CG 4.31Å; L264-A395 HydrophobicContact CD2-CB 3.42Å; L264-A395 VanDerWaalsContact CD2-CB 3.42Å; L264-A395 HydrophobicContact CG-CB 4.35Å; L264-R512 PolarHBondContact N-O 3.11Å; L264-R512 VanDerWaalsContact O-CA 3.32Å; L264-R512 WeakPolarHBondContact O-CA 3.28Å
265	A	91.7	Very high	93.3	Very high	53 Å²	53	22.3 Å²	22.3	44%	0.438	15%	0.147	S	C	.	.			trans	-57.7	137.3	174	0	0	0	0	0	111.4	S267 V268 R269	A265-S267 VanDerWaalsContact C-N 3.27Å; A265-S267 PolarHBondContact O-N 3.41Å; A265-V268 HydrophobicContact CB-CG2 4.43Å; A265-V268 WeakPolarHBondContact O-CB 3.47Å; A265-V268 PolarHBondContact O-N 3.41Å; A265-R269 PolarHBondContact O-N 2.94Å; A265-R269 VanDerWaalsContact O-N 3.14Å
266	S	91.1	Very high	93.3	Very high	46 Å²	46	22.2 Å²	22.2	32%	0.322	15%	0.146	S	C	.	.	H	α-helix	trans	-49.6	-47.1	-176.7	-167.7	0	0	0	0	112.1	L264 V268 R269 D270	L264-S266 PolarHBondContact O-N 3.21Å; S266-V268 PolarHBondContact O-N 2.89Å; S266-V268 VanDerWaalsContact O-N 3.13Å; S266-R269 CarbonylContact O-C 3.59Å; S266-R269 WeakPolarHBondContact O-CA 3.47Å; S266-R269 WeakPolarHBondContact O-CB 3.31Å; S266-R269 PolarHBondContact O-N 3.42Å; S266-D270 WeakPolarHBondContact O-CB 3.28Å; S266-D270 PolarHBondContact O-N 2.78Å; S266-D270 PolarHBondContact OG-OD2 2.66Å
267	S	91.9	Very high	93.3	Very high	83 Å²	83	25 Å²	25	58%	0.58	16%	0.159	S	C	*	.	H	α-helix	trans	-57.1	-32.5	-180	57	0	0	0	0	114.4	A265 V271	A265-S267 VanDerWaalsContact C-N 3.27Å; A265-S267 PolarHBondContact O-N 3.41Å; S267-V271 WeakPolarHBondContact O-CB 3.19Å; S267-V271 VanDerWaalsContact O-CG2 3.27Å; S267-V271 WeakPolarHBondContact O-CG2 3.3Å; S267-V271 PolarHBondContact O-N 2.81Å
268	V	92.9	Very high	93.2	Very high	24 Å²	24	26.1 Å²	26.1	15%	0.145	17%	0.17	C	C	.	.	H	α-helix	trans	-73.8	-46.4	173.5	179	0	0	0	0	109.7	L264 A265 S266 D270 V271 V272 A388 A391 M392	L264-V268 HydrophobicContact CD2-CG1 4.44Å; A265-V268 HydrophobicContact CB-CG2 4.43Å; A265-V268 WeakPolarHBondContact O-CB 3.47Å; A265-V268 PolarHBondContact O-N 3.41Å; S266-V268 PolarHBondContact O-N 2.89Å; S266-V268 VanDerWaalsContact O-N 3.13Å; V268-D270 VanDerWaalsContact C-N 3.35Å; V268-D270 PolarHBondContact O-N 3.22Å; V268-V271 PolarHBondContact O-N 2.98Å; V268-V272 HydrophobicContact CG1-CG2 4.45Å; V268-V272 VanDerWaalsContact O-CG2 3.27Å; V268-V272 WeakPolarHBondContact O-CG2 3.35Å; V268-V272 PolarHBondContact O-N 2.95Å; V268-A388 HydrophobicContact CG1-CB 4.1Å; V268-A391 HydrophobicContact CG1-CB 3.91Å; V268-A391 HydrophobicContact CG2-CB 3.86Å; V268-M392 HydrophobicContact CG1-CG 4.36Å
269	R	93.2	Very high	93.1	Very high	9 Å²	9	26.2 Å²	26.2	3%	0.034	17%	0.17	C	C	.	.	H	α-helix	trans	-60.8	-41.2	178.5	-165.3	-171.7	-59.4	-73.7	5	112.2	C261 L262 L264 A265 S266 V272 S273 V296 R512	C261-R269 VanDerWaalsContact SG-CZ 3.53Å; C261-R269 PolarHBondContact SG-NH1 3.17Å; C261-R269 PolarHBondContact SG-NH2 3.33Å; C261-R269 VanDerWaalsContact SG-NH2 3.39Å; L262-R269 PolarHBondContact O-NH2 2.76Å; L264-R269 PolarHBondContact O-NH2 3.38Å; A265-R269 PolarHBondContact O-N 2.94Å; A265-R269 VanDerWaalsContact O-N 3.14Å; S266-R269 CarbonylContact O-C 3.59Å; S266-R269 WeakPolarHBondContact O-CA 3.47Å; S266-R269 WeakPolarHBondContact O-CB 3.31Å; S266-R269 PolarHBondContact O-N 3.42Å; R269-V272 PolarHBondContact O-N 2.87Å; R269-S273 VanDerWaalsContact O-CB 3.29Å; R269-S273 WeakPolarHBondContact O-CB 3.47Å; R269-S273 PolarHBondContact O-N 3.29Å; R269-S273 PolarHBondContact O-OG 3.21Å; R269-V296 PolarHBondContact NH1-O 2.88Å; R269-R512 PolarHBondContact NH2-O 2.83Å
270	D	92.5	Very high	92.9	Very high	76 Å²	76	31.3 Å²	31.3	41%	0.406	19%	0.193	S	C	.	.	H	α-helix	trans	-62.9	-44.3	176.4	-64.8	-37.2	0	0	0	110.9	S266 V268 S274	S266-D270 WeakPolarHBondContact O-CB 3.28Å; S266-D270 PolarHBondContact O-N 2.78Å; S266-D270 PolarHBondContact OG-OD2 2.66Å; V268-D270 VanDerWaalsContact C-N 3.35Å; V268-D270 PolarHBondContact O-N 3.22Å; D270-S274 WeakPolarHBondContact O-CB 3.4Å; D270-S274 PolarHBondContact O-N 3.34Å; D270-S274 PolarHBondContact O-OG 2.85Å
271	V	93.5	Very high	92.9	Very high	44 Å²	44	31.6 Å²	31.6	27%	0.267	20%	0.197	S	C	.	.	H	α-helix	trans	-63.4	-44.8	175.8	162	0	0	0	0	111.9	S267 V268 S275 R386 A388	S267-V271 WeakPolarHBondContact O-CB 3.19Å; S267-V271 VanDerWaalsContact O-CG2 3.27Å; S267-V271 WeakPolarHBondContact O-CG2 3.3Å; S267-V271 PolarHBondContact O-N 2.81Å; V268-V271 PolarHBondContact O-N 2.98Å; V271-S275 WeakPolarHBondContact O-CB 3.23Å; V271-S275 PolarHBondContact O-N 2.9Å; V271-S275 PolarHBondContact O-OG 2.91Å; V271-R386 HydrophobicContact CG1-CB 4.16Å; V271-R386 VanDerWaalsContact CG1-CD 3.42Å; V271-R386 HydrophobicContact CG1-CG 4.41Å; V271-R386 PolarHBondContact O-NH1 3.3Å; V271-A388 HydrophobicContact CB-CB 4.21Å; V271-A388 HydrophobicContact CG1-CB 3.47Å; V271-A388 VanDerWaalsContact CG1-CB 3.47Å
272	V	94.4	Very high	92.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.6	-49.5	178	174.2	0	0	0	0	110.3	V268 R269 S274 S275 L276 L289 V296 T297 F379 L383 A388 M392	V268-V272 HydrophobicContact CG1-CG2 4.45Å; V268-V272 VanDerWaalsContact O-CG2 3.27Å; V268-V272 WeakPolarHBondContact O-CG2 3.35Å; V268-V272 PolarHBondContact O-N 2.95Å; R269-V272 PolarHBondContact O-N 2.87Å; V272-S274 PolarHBondContact O-N 3.35Å; V272-S275 PolarHBondContact O-N 2.92Å; V272-L276 WeakPolarHBondContact O-CB 3.34Å; V272-L276 PolarHBondContact O-N 3.22Å; V272-L289 HydrophobicContact CG1-CD2 3.62Å; V272-V296 HydrophobicContact CG1-CG1 4.49Å; V272-T297 HydrophobicContact CG1-CG2 3.91Å; V272-F379 HydrophobicContact CG1-CE2 4.4Å; V272-F379 HydrophobicContact CG1-CZ 4.24Å; V272-L383 HydrophobicContact CG2-CD1 4.01Å; V272-A388 HydrophobicContact CG2-CB 4.16Å; V272-M392 HydrophobicContact CG1-SD 4.21Å; V272-M392 HydrophobicContact CG2-CE 3.83Å; V272-M392 HydrophobicContact CG2-CG 4.39Å; V272-M392 HydrophobicContact CG2-SD 3.61Å
273	S	94.1	Very high	92.8	Very high	6 Å²	6	41.4 Å²	41.4	4%	0.042	24%	0.24	C	C	.	.	H	α-helix	trans	-62.6	-42.2	-179.3	-52	0	0	0	0	111.5	R269 L276 Q277 T297	R269-S273 VanDerWaalsContact O-CB 3.29Å; R269-S273 WeakPolarHBondContact O-CB 3.47Å; R269-S273 PolarHBondContact O-N 3.29Å; R269-S273 PolarHBondContact O-OG 3.21Å; S273-L276 PolarHBondContact O-N 3.16Å; S273-Q277 WeakPolarHBondContact O-CB 3.1Å; S273-Q277 PolarHBondContact O-N 2.91Å; S273-T297 WeakPolarHBondContact OG-CB 3.27Å; S273-T297 PolarHBondContact OG-OG1 2.94Å
274	S	94	Very high	92.9	Very high	47 Å²	47	41.1 Å²	41.1	33%	0.329	24%	0.238	S	C	.	.	H	α-helix	trans	-66.5	-38.7	176.7	-58.2	0	0	0	0	112.3	D270 V272 L276 A278	D270-S274 WeakPolarHBondContact O-CB 3.4Å; D270-S274 PolarHBondContact O-N 3.34Å; D270-S274 PolarHBondContact O-OG 2.85Å; V272-S274 PolarHBondContact O-N 3.35Å; S274-L276 VanDerWaalsContact C-N 3.27Å; S274-L276 PolarHBondContact O-N 3.43Å; S274-A278 WeakPolarHBondContact O-CB 3.45Å; S274-A278 PolarHBondContact O-N 2.96Å
275	S	94.3	Very high	92.9	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.014	24%	0.237	C	C	.	.	H	α-helix	trans	-63.1	-36.2	174.9	-69.7	0	0	0	0	111.8	V271 V272 A279 R386	V271-S275 WeakPolarHBondContact O-CB 3.23Å; V271-S275 PolarHBondContact O-N 2.9Å; V271-S275 PolarHBondContact O-OG 2.91Å; V272-S275 PolarHBondContact O-N 2.92Å; S275-A279 PolarHBondContact O-N 3.2Å; S275-R386 PolarHBondContact OG-NH1 3.41Å
276	L	93.7	Very high	93.2	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-75.9	-43.7	179.4	-166.7	57.5	0	0	0	111.8	V272 S273 S274 A278 A279 T297 V299 L359 L361 F379	V272-L276 WeakPolarHBondContact O-CB 3.34Å; V272-L276 PolarHBondContact O-N 3.22Å; S273-L276 PolarHBondContact O-N 3.16Å; S274-L276 VanDerWaalsContact C-N 3.27Å; S274-L276 PolarHBondContact O-N 3.43Å; L276-A278 VanDerWaalsContact C-N 3.27Å; L276-A278 PolarHBondContact O-N 3.3Å; L276-A279 CarbonylContact O-C 3.58Å; L276-A279 WeakPolarHBondContact O-CA 3.43Å; L276-A279 WeakPolarHBondContact O-CB 3.36Å; L276-A279 PolarHBondContact O-N 2.95Å; L276-T297 HydrophobicContact CD2-CG2 3.89Å; L276-V299 HydrophobicContact CB-CG2 4.22Å; L276-V299 HydrophobicContact CD2-CB 4.48Å; L276-V299 HydrophobicContact CD2-CG2 4.02Å; L276-V299 HydrophobicContact CG-CG2 4.24Å; L276-L359 HydrophobicContact CD1-CD1 3.9Å; L276-L361 HydrophobicContact CD1-CD2 4.5Å; L276-F379 HydrophobicContact CB-CD2 3.95Å; L276-F379 HydrophobicContact CB-CE2 3.86Å; L276-F379 HydrophobicContact CD1-CD1 4.49Å; L276-F379 HydrophobicContact CD1-CD2 3.77Å; L276-F379 HydrophobicContact CD1-CE2 4.05Å; L276-F379 HydrophobicContact CD1-CG 4.01Å; L276-F379 HydrophobicContact CG-CD2 4.47Å; L276-F379 HydrophobicContact CG-CE2 4.45Å
277	Q	94.2	Very high	93.4	Very high	62 Å²	62	36.1 Å²	36.1	29%	0.29	20%	0.201	S	C	.	.	H	α-helix	trans	-57.2	-39.1	171.6	-171.3	-164.8	31.2	0	0	112.1	S273 A279 V299 L519 T520	S273-Q277 WeakPolarHBondContact O-CB 3.1Å; S273-Q277 PolarHBondContact O-N 2.91Å; Q277-A279 PolarHBondContact O-N 3.46Å; Q277-V299 HydrophobicContact CB-CG1 4.22Å; Q277-L519 HydrophobicContact CB-CD1 4.46Å; Q277-T520 PolarHBondContact NE2-O 3.45Å
278	A	92.8	Very high	93.7	Very high	51 Å²	51	32.2 Å²	32.2	42%	0.421	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-12.4	175.3	0	0	0	0	0	113.9	S274 L276 K280 R382	S274-A278 WeakPolarHBondContact O-CB 3.45Å; S274-A278 PolarHBondContact O-N 2.96Å; L276-A278 VanDerWaalsContact C-N 3.27Å; L276-A278 PolarHBondContact O-N 3.3Å; A278-K280 VanDerWaalsContact C-N 3.35Å; A278-R382 VanDerWaalsContact O-CZ 3.23Å; A278-R382 PolarHBondContact O-NH1 3.45Å; A278-R382 PolarHBondContact O-NH2 2.88Å
279	A	91.1	Very high	93.8	Very high	2 Å²	2	31 Å²	31	2%	0.017	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	35.1	176.8	0	0	0	0	0	112	S275 L276 Q277 C375 R378 F379	S275-A279 PolarHBondContact O-N 3.2Å; L276-A279 CarbonylContact O-C 3.58Å; L276-A279 WeakPolarHBondContact O-CA 3.43Å; L276-A279 WeakPolarHBondContact O-CB 3.36Å; L276-A279 PolarHBondContact O-N 2.95Å; Q277-A279 PolarHBondContact O-N 3.46Å; A279-C375 WeakPolarHBondContact O-CB 3.48Å; A279-C375 PolarHBondContact O-SG 3.46Å; A279-R378 HydrophobicContact CB-CB 4.49Å; A279-F379 HydrophobicContact CB-CB 3.98Å
280	K	90.5	Very high	94	Very high	111 Å²	111	30.7 Å²	30.7	48%	0.483	17%	0.165	S	C	.	.			trans	-76.6	145.6	-178.8	67.4	178.9	175.5	-178.7	0	114.1	A278 Y521	A278-K280 VanDerWaalsContact C-N 3.35Å; K280-Y521 HydrophobicContact CB-CD1 3.65Å; K280-Y521 HydrophobicContact CB-CE1 3.96Å; K280-Y521 HydrophobicContact CB-CG 4.39Å; K280-Y521 HydrophobicContact CD-CD1 4.24Å; K280-Y521 PolarHBondContact NZ-OXT 2.85Å
281	A	92.1	Very high	94	Very high	25 Å²	25	27 Å²	27	21%	0.207	15%	0.145	C	C	.	.			trans	-112.6	170.9	163.3	0	0	0	0	0	110.9	L284 M372	A281-L284 HydrophobicContact CB-CB 4.16Å; A281-M372 HydrophobicContact CB-CE 3.48Å; A281-M372 VanDerWaalsContact CB-CE 3.48Å
282	K	91.2	Very high	93.8	Very high	184 Å²	184	26.9 Å²	26.9	80%	0.8	15%	0.152	S	C	*	.	S	Bend	trans	-64.2	-49.8	-177.3	-176.7	-170.8	173.2	-164.2	0	112.3	K301	K282-K301 PolarHBondContact O-NZ 3.35Å
283	N	93.5	Very high	93.5	Very high	28 Å²	28	30.5 Å²	30.5	15%	0.15	17%	0.172	C	C	.	.	S	Bend	trans	-89.6	-17.2	-171.4	-58.6	-24.4	0	0	0	112.7	V285 K301 S363 T364 D365 D368	N283-V285 WeakPolarHBondContact O-CG2 3.12Å; N283-V285 PolarHBondContact O-N 2.79Å; N283-K301 PolarHBondContact O-NZ 2.91Å; N283-S363 WeakPolarHBondContact CB-OG 3.32Å; N283-T364 PolarHBondContact O-N 2.81Å; N283-D365 HydrophobicContact CB-CB 4Å; N283-D365 VanDerWaalsContact ND2-CB 3.32Å; N283-D365 WeakPolarHBondContact ND2-CB 3.44Å; N283-D365 PolarHBondContact ND2-OD2 2.92Å; N283-D368 WeakPolarHBondContact CB-OD2 3.47Å
284	L	94.8	Very high	93.5	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-48.8	127.4	173.9	-177.5	64.1	0	0	0	113.2	A281 F286 K301 L361 M372 Y521	A281-L284 HydrophobicContact CB-CB 4.16Å; L284-F286 WeakPolarHBondContact CD1-O 3.4Å; L284-K301 WeakPolarHBondContact O-CD 3.32Å; L284-K301 WeakPolarHBondContact O-CE 3.33Å; L284-K301 PolarHBondContact O-NZ 2.72Å; L284-L361 HydrophobicContact CD1-CB 3.87Å; L284-L361 HydrophobicContact CD1-CD2 4.26Å; L284-M372 HydrophobicContact CB-CE 4.4Å; L284-M372 HydrophobicContact CB-SD 4.45Å; L284-M372 HydrophobicContact CD1-SD 3.87Å; L284-Y521 HydrophobicContact CD2-CE1 4Å; L284-Y521 HydrophobicContact CD2-CE2 4.33Å; L284-Y521 WeakPolarHBondContact CD2-OH 3.45Å; L284-Y521 HydrophobicContact CG-CE2 4.2Å
285	V	94.5	Very high	93.5	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.012	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-52.9	-176	-174.3	0	0	0	0	110.3	N283 R300 K301 Q304 F338 F344 V362 T364	N283-V285 WeakPolarHBondContact O-CG2 3.12Å; N283-V285 PolarHBondContact O-N 2.79Å; V285-R300 CarbonylContact O-C 3.58Å; V285-R300 WeakPolarHBondContact O-CA 3.23Å; V285-K301 PolarHBondContact O-N 2.57Å; V285-Q304 VanDerWaalsContact CG1-OE1 3.3Å; V285-F338 HydrophobicContact CG1-CE1 4.09Å; V285-F338 HydrophobicContact CG1-CZ 4.16Å; V285-F344 HydrophobicContact CG2-CD1 4.31Å; V285-F344 HydrophobicContact CG2-CE1 4.4Å; V285-V362 WeakPolarHBondContact CB-O 3.32Å; V285-V362 PolarHBondContact N-O 2.84Å; V285-T364 HydrophobicContact CG2-CG2 3.39Å
286	F	96.3	Very high	93.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	138.4	-178.6	-56.1	-65.5	0	0	0	109.8	L284 I288 L298 V299 R300 Q304 L306 L335 F338 V362	L284-F286 WeakPolarHBondContact CD1-O 3.4Å; F286-I288 HydrophobicContact CB-CG1 4.31Å; F286-L298 HydrophobicContact CB-CD1 4.45Å; F286-L298 HydrophobicContact CD1-CD1 4.49Å; F286-V299 CarbonylContact C-O 3.55Å; F286-V299 WeakPolarHBondContact CA-O 3.09Å; F286-R300 HydrophobicContact CD1-CB 3.6Å; F286-R300 HydrophobicContact CE1-CB 3.87Å; F286-Q304 HydrophobicContact CE1-CB 4.37Å; F286-Q304 HydrophobicContact CZ-CB 4.48Å; F286-L306 HydrophobicContact CD1-CB 4.33Å; F286-L306 HydrophobicContact CD2-CD1 4.36Å; F286-L306 HydrophobicContact CD2-CD2 4.36Å; F286-L306 HydrophobicContact CE1-CB 3.91Å; F286-L306 HydrophobicContact CE2-CB 4.39Å; F286-L306 HydrophobicContact CE2-CD1 3.91Å; F286-L306 HydrophobicContact CG-CD2 4.38Å; F286-L306 HydrophobicContact CZ-CB 3.94Å; F286-L306 HydrophobicContact CZ-CD1 4.2Å; F286-L335 HydrophobicContact CD2-CD1 4.2Å; F286-L335 HydrophobicContact CE2-CD1 3.96Å; F286-F338 AromaticContact CE2-CD1 3.92Å; F286-F338 HydrophobicContact CE2-CD1 3.92Å; F286-F338 AromaticContact CE2-CE1 3.78Å; F286-F338 HydrophobicContact CE2-CE1 3.78Å; F286-F338 HydrophobicContact CE2-CE2 4.4Å; F286-F338 HydrophobicContact CE2-CG 4.28Å; F286-F338 HydrophobicContact CE2-CZ 4.03Å; F286-F338 HydrophobicContact CZ-CD1 4.22Å; F286-F338 HydrophobicContact CZ-CD2 4.02Å; F286-F338 AromaticContact CZ-CE1 3.97Å; F286-F338 HydrophobicContact CZ-CE1 3.97Å; F286-F338 AromaticContact CZ-CE2 3.77Å; F286-F338 HydrophobicContact CZ-CE2 3.77Å; F286-F338 HydrophobicContact CZ-CG 4.24Å; F286-F338 AromaticContact CZ-CZ 3.74Å; F286-F338 HydrophobicContact CZ-CZ 3.74Å; F286-V362 HydrophobicContact CB-CB 4.16Å; F286-V362 HydrophobicContact CB-CG2 4.21Å; F286-V362 HydrophobicContact CD2-CB 4.22Å; F286-V362 HydrophobicContact CD2-CG1 4.33Å; F286-V362 HydrophobicContact CD2-CG2 4.47Å; F286-V362 PolarHBondContact O-N 3.45Å
287	S	96.8	Very high	93.6	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	121.6	159.1	-63.2	0	0	0	0	108.6	L298 V299 I360 L361 Y521	S287-L298 WeakPolarHBondContact O-CA 3.41Å; S287-V299 PolarHBondContact N-O 2.98Å; S287-V299 PolarHBondContact O-N 3.16Å; S287-I360 CarbonylContact C-O 3.49Å; S287-I360 WeakPolarHBondContact CA-O 3.42Å; S287-L361 WeakPolarHBondContact OG-CD2 3.42Å; S287-Y521 VanDerWaalsContact CB-OH 3.23Å; S287-Y521 WeakPolarHBondContact CB-OH 3.47Å; S287-Y521 PolarHBondContact N-OH 3.04Å; S287-Y521 PolarHBondContact OG-OH 3.05Å
288	I	96.8	Very high	93.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	126.3	-177.9	-32.6	-174.6	0	0	0	107.4	F286 L290 L295 L298 L306 L311 V314 I360	F286-I288 HydrophobicContact CB-CG1 4.31Å; I288-L290 HydrophobicContact CG2-CD2 3.79Å; I288-L290 HydrophobicContact CG2-CG 4.41Å; I288-L295 HydrophobicContact CG2-CD1 3.55Å; I288-L298 HydrophobicContact CB-CD1 4.39Å; I288-L298 HydrophobicContact CD1-CD1 4.34Å; I288-L298 HydrophobicContact CG1-CD1 3.79Å; I288-L298 HydrophobicContact CG2-CD1 4.33Å; I288-L306 HydrophobicContact CD1-CD2 3.62Å; I288-L311 HydrophobicContact CD1-CD2 4.12Å; I288-L311 HydrophobicContact CG2-CD2 4.36Å; I288-V314 HydrophobicContact CD1-CG1 4.42Å; I288-I360 HydrophobicContact CB-CB 4.16Å; I288-I360 HydrophobicContact CG1-CB 4.42Å; I288-I360 PolarHBondContact N-O 3.45Å; I288-I360 PolarHBondContact O-N 3.13Å
289	L	96.7	Very high	93.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	122.2	173	-177.8	66.5	0	0	0	108.7	V272 V296 T297 L351 L359 F379 M392	V272-L289 HydrophobicContact CG1-CD2 3.62Å; L289-V296 HydrophobicContact CB-CB 4.18Å; L289-V296 HydrophobicContact CD2-CB 4.02Å; L289-V296 HydrophobicContact CD2-CG1 3.7Å; L289-V296 HydrophobicContact CG-CB 3.92Å; L289-V296 HydrophobicContact CG-CG1 4.19Å; L289-V296 HydrophobicContact CG-CG2 4.33Å; L289-V296 WeakPolarHBondContact O-CA 2.95Å; L289-V296 VanDerWaalsContact O-CB 3.3Å; L289-V296 WeakPolarHBondContact O-CB 3.33Å; L289-V296 PolarHBondContact O-N 3.01Å; L289-T297 HydrophobicContact CB-CG2 4.14Å; L289-T297 PolarHBondContact N-O 3.47Å; L289-T297 PolarHBondContact O-N 3.34Å; L289-L351 HydrophobicContact CD1-CD1 3.99Å; L289-L351 HydrophobicContact CD1-CG 4.37Å; L289-L359 HydrophobicContact CD1-CB 4.36Å; L289-L359 HydrophobicContact CD1-CD1 4.43Å; L289-F379 HydrophobicContact CD2-CZ 4.15Å; L289-M392 HydrophobicContact CD2-CE 4.42Å; L289-M392 HydrophobicContact CD2-SD 4.06Å
290	L	95.7	Very high	93.9	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	155.4	-178.4	-55	-173.4	0	0	0	111.4	I288 R294 L295 F315 L357 C358 I360	I288-L290 HydrophobicContact CG2-CD2 3.79Å; I288-L290 HydrophobicContact CG2-CG 4.41Å; L290-R294 CarbonylContact C-O 3.52Å; L290-R294 WeakPolarHBondContact CA-O 3.48Å; L290-L295 HydrophobicContact CD2-CD1 3.76Å; L290-F315 HydrophobicContact CD1-CD1 3.62Å; L290-F315 HydrophobicContact CD1-CE1 3.76Å; L290-F315 HydrophobicContact CD1-CG 4.24Å; L290-F315 HydrophobicContact CD1-CZ 4.41Å; L290-F315 HydrophobicContact CD2-CD1 4.09Å; L290-F315 HydrophobicContact CD2-CE1 3.33Å; L290-F315 HydrophobicContact CD2-CE2 4.33Å; L290-F315 HydrophobicContact CD2-CZ 3.46Å; L290-F315 VanDerWaalsContact CD2-CZ 3.46Å; L290-F315 HydrophobicContact CG-CE1 4.2Å; L290-L357 VanDerWaalsContact O-CA 3.29Å; L290-L357 WeakPolarHBondContact O-CA 3.46Å; L290-C358 HydrophobicContact CB-CB 4.48Å; L290-C358 PolarHBondContact N-O 3.32Å; L290-C358 PolarHBondContact O-N 2.96Å; L290-I360 HydrophobicContact CD1-CD1 3.7Å; L290-I360 HydrophobicContact CG-CD1 4.23Å
291	A	93.6	Very high	93.9	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	91	171.5	0	0	0	0	0	107.3	L262 D293 R294 V296 L357 L396	L262-A291 HydrophobicContact CB-CB 4.48Å; L262-A291 HydrophobicContact CD1-CB 4.39Å; L262-A291 HydrophobicContact CD2-CB 3.86Å; L262-A291 HydrophobicContact CG-CB 4.48Å; A291-D293 PolarHBondContact O-N 2.99Å; A291-R294 PolarHBondContact N-O 3.46Å; A291-R294 WeakPolarHBondContact O-CB 3.43Å; A291-R294 PolarHBondContact O-N 2.89Å; A291-V296 HydrophobicContact CB-CG2 3.67Å; A291-L357 HydrophobicContact CB-CD2 3.98Å; A291-L396 HydrophobicContact CB-CD2 3.67Å
292	G	89.3	Confident	93.7	Very high	40 Å²	40	30.6 Å²	30.6	41%	0.412	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	-126.2	-161.6	0	0	0	0	0	110.6	R294 E356	G292-R294 VanDerWaalsContact C-N 3.29Å; G292-R294 PolarHBondContact O-N 3.16Å; G292-E356 PolarHBondContact N-O 3.08Å
293	D	88.6	Confident	93.4	Very high	77 Å²	77	27.5 Å²	27.5	41%	0.412	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	10	176.7	-82.8	-55.8	0	0	0	115.6	R247 T260 A291 F315	R247-D293 IonicContact CZ-OD1 3.76Å; R247-D293 IonicContact NH1-OD1 3.65Å; R247-D293 PolarHBondContact NH1-OD1 3.19Å; R247-D293 IonicContact NH1-OD2 3.5Å; R247-D293 IonicContact NH2-OD1 2.75Å; R247-D293 PolarHBondContact NH2-OD1 2.88Å; R247-D293 IonicContact NH2-OD2 3.56Å; T260-D293 PolarHBondContact OG1-O 3.04Å; A291-D293 PolarHBondContact O-N 2.99Å; D293-F315 WeakPolarHBondContact O-CE2 3.35Å
294	R	92.9	Very high	93.2	Very high	61 Å²	61	29.2 Å²	29.2	23%	0.23	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	131.5	-177.4	-55.2	-177	-177.7	-99	-2.7	111.6	L262 L290 A291 G292 V296 Q399	L262-R294 HydrophobicContact CB-CB 4.17Å; L290-R294 CarbonylContact C-O 3.52Å; L290-R294 WeakPolarHBondContact CA-O 3.48Å; A291-R294 PolarHBondContact N-O 3.46Å; A291-R294 WeakPolarHBondContact O-CB 3.43Å; A291-R294 PolarHBondContact O-N 2.89Å; G292-R294 VanDerWaalsContact C-N 3.29Å; G292-R294 PolarHBondContact O-N 3.16Å; R294-V296 PolarHBondContact O-N 2.88Å; R294-Q399 PolarHBondContact NH1-O 3.16Å
295	L	95.1	Very high	93	Very high	6 Å²	6	34 Å²	34	3%	0.031	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	125.7	174.6	-174.1	61.4	0	0	0	111.1	V259 T260 C261 L262 I288 L290 T297 L298 F315 L423 I515	V259-L295 HydrophobicContact CG1-CB 4.32Å; T260-L295 WeakPolarHBondContact O-CB 3.38Å; T260-L295 PolarHBondContact O-N 3.35Å; C261-L295 CarbonylContact C-O 3.59Å; C261-L295 VanDerWaalsContact CA-O 3.29Å; C261-L295 WeakPolarHBondContact CA-O 3.32Å; C261-L295 PolarHBondContact SG-O 2.79Å; L262-L295 PolarHBondContact N-O 2.96Å; I288-L295 HydrophobicContact CG2-CD1 3.55Å; L290-L295 HydrophobicContact CD2-CD1 3.76Å; L295-T297 WeakPolarHBondContact CD1-O 3.31Å; L295-L298 HydrophobicContact CD1-CB 4.46Å; L295-L298 HydrophobicContact CD2-CB 4.38Å; L295-F315 HydrophobicContact CB-CZ 4.31Å; L295-L423 HydrophobicContact CD2-CD2 4.46Å; L295-I515 HydrophobicContact CD2-CD1 3.76Å; L295-I515 HydrophobicContact CG-CD1 3.91Å
296	V	95.1	Very high	92.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-52.2	173.3	178.8	0	0	0	0	110.4	L262 L264 R269 V272 L289 A291 R294 L357 M392	L262-V296 HydrophobicContact CB-CG2 4.19Å; L262-V296 HydrophobicContact CD2-CG2 4.02Å; L264-V296 HydrophobicContact CD1-CG1 3.71Å; R269-V296 PolarHBondContact NH1-O 2.88Å; V272-V296 HydrophobicContact CG1-CG1 4.49Å; L289-V296 HydrophobicContact CB-CB 4.18Å; L289-V296 HydrophobicContact CD2-CB 4.02Å; L289-V296 HydrophobicContact CD2-CG1 3.7Å; L289-V296 HydrophobicContact CG-CB 3.92Å; L289-V296 HydrophobicContact CG-CG1 4.19Å; L289-V296 HydrophobicContact CG-CG2 4.33Å; L289-V296 WeakPolarHBondContact O-CA 2.95Å; L289-V296 VanDerWaalsContact O-CB 3.3Å; L289-V296 WeakPolarHBondContact O-CB 3.33Å; L289-V296 PolarHBondContact O-N 3.01Å; A291-V296 HydrophobicContact CB-CG2 3.67Å; R294-V296 PolarHBondContact O-N 2.88Å; V296-L357 HydrophobicContact CG2-CD2 4.29Å; V296-M392 HydrophobicContact CG1-SD 3.73Å
297	T	94.7	Very high	92.7	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	157.9	171.1	-168	0	0	0	0	111.7	V272 S273 L276 L289 L295	V272-T297 HydrophobicContact CG1-CG2 3.91Å; S273-T297 WeakPolarHBondContact OG-CB 3.27Å; S273-T297 PolarHBondContact OG-OG1 2.94Å; L276-T297 HydrophobicContact CD2-CG2 3.89Å; L289-T297 HydrophobicContact CB-CG2 4.14Å; L289-T297 PolarHBondContact N-O 3.47Å; L289-T297 PolarHBondContact O-N 3.34Å; L295-T297 WeakPolarHBondContact CD1-O 3.31Å
298	L	94.8	Very high	92.6	Very high	14 Å²	14	34.7 Å²	34.7	7%	0.073	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	118	173.1	173.9	63.9	0	0	0	108.2	F286 S287 I288 L295	F286-L298 HydrophobicContact CB-CD1 4.45Å; F286-L298 HydrophobicContact CD1-CD1 4.49Å; S287-L298 WeakPolarHBondContact O-CA 3.41Å; I288-L298 HydrophobicContact CB-CD1 4.39Å; I288-L298 HydrophobicContact CD1-CD1 4.34Å; I288-L298 HydrophobicContact CG1-CD1 3.79Å; I288-L298 HydrophobicContact CG2-CD1 4.33Å; L295-L298 HydrophobicContact CD1-CB 4.46Å; L295-L298 HydrophobicContact CD2-CB 4.38Å
299	V	95.2	Very high	92.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	137.1	170.8	-176.6	0	0	0	0	108.4	L276 Q277 F286 S287 L519 Y521	L276-V299 HydrophobicContact CB-CG2 4.22Å; L276-V299 HydrophobicContact CD2-CB 4.48Å; L276-V299 HydrophobicContact CD2-CG2 4.02Å; L276-V299 HydrophobicContact CG-CG2 4.24Å; Q277-V299 HydrophobicContact CB-CG1 4.22Å; F286-V299 CarbonylContact C-O 3.55Å; F286-V299 WeakPolarHBondContact CA-O 3.09Å; S287-V299 PolarHBondContact N-O 2.98Å; S287-V299 PolarHBondContact O-N 3.16Å; V299-L519 WeakPolarHBondContact CA-O 3.24Å; V299-L519 HydrophobicContact CG2-CB 4.4Å; V299-Y521 HydrophobicContact CB-CE1 4.38Å; V299-Y521 HydrophobicContact CG1-CD1 3.87Å; V299-Y521 HydrophobicContact CG1-CE1 3.49Å; V299-Y521 VanDerWaalsContact CG1-CE1 3.49Å; V299-Y521 HydrophobicContact CG1-CE2 4.23Å; V299-Y521 HydrophobicContact CG1-CG 4.38Å
300	R	93.1	Very high	92.5	Very high	32 Å²	32	35.3 Å²	35.3	12%	0.121	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	159.1	-170.1	64.9	-158	-169.2	161.2	7.3	112.6	V285 F286 Q304 F305 L519 T520 Y521	V285-R300 CarbonylContact O-C 3.58Å; V285-R300 WeakPolarHBondContact O-CA 3.23Å; F286-R300 HydrophobicContact CD1-CB 3.6Å; F286-R300 HydrophobicContact CE1-CB 3.87Å; R300-Q304 WeakPolarHBondContact CD-O 3.31Å; R300-F305 VanDerWaalsContact NH1-CD1 3.26Å; R300-F305 VanDerWaalsContact NH2-CD1 3.32Å; R300-L519 PolarHBondContact N-O 3.17Å; R300-T520 HydrophobicContact CG-CG2 4.08Å; R300-T520 CarbonylContact O-C 3.59Å; R300-T520 WeakPolarHBondContact O-CA 3.3Å; R300-T520 WeakPolarHBondContact O-CB 3.39Å; R300-Y521 WeakPolarHBondContact O-CD2 3.39Å; R300-Y521 PolarHBondContact O-N 3.2Å
301	K	90.4	Very high	92.5	Very high	55 Å²	55	35.8 Å²	35.8	24%	0.239	18%	0.177	C	C	.	.			trans	-62.2	148.9	165.9	-85.3	176.6	168.5	144.9	0	110	K282 N283 L284 V285 Q304 Y521	K282-K301 PolarHBondContact O-NZ 3.35Å; N283-K301 PolarHBondContact O-NZ 2.91Å; L284-K301 WeakPolarHBondContact O-CD 3.32Å; L284-K301 WeakPolarHBondContact O-CE 3.33Å; L284-K301 PolarHBondContact O-NZ 2.72Å; V285-K301 PolarHBondContact O-N 2.57Å; K301-Q304 HydrophobicContact CB-CB 4.41Å; K301-Q304 HydrophobicContact CB-CG 4.31Å; K301-Q304 VanDerWaalsContact CB-OE1 3.3Å; K301-Q304 PolarHBondContact O-N 2.97Å; K301-Y521 HydrophobicContact CB-CD2 4.48Å; K301-Y521 HydrophobicContact CG-CD2 3.89Å
302	K	87.9	Confident	92.7	Very high	142 Å²	142	36 Å²	36	62%	0.617	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	141.4	179.1	-162.2	-162.5	166.5	-163.4	0	110	Q304	K302-Q304 PolarHBondContact O-N 3.43Å
303	D	86.2	Confident	93	Very high	118 Å²	118	34.5 Å²	34.5	63%	0.631	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.8	10.8	178.2	-48	-44	0	0	0	114.9
304	Q	89.5	Confident	93.4	Very high	65 Å²	65	31 Å²	31	30%	0.304	14%	0.142	S	C	.	.			trans	-106.8	122.9	173.3	-65.2	-174.8	-13.2	0	0	110.6	V285 F286 R300 K301 K302 F338	V285-Q304 VanDerWaalsContact CG1-OE1 3.3Å; F286-Q304 HydrophobicContact CE1-CB 4.37Å; F286-Q304 HydrophobicContact CZ-CB 4.48Å; R300-Q304 WeakPolarHBondContact CD-O 3.31Å; K301-Q304 HydrophobicContact CB-CB 4.41Å; K301-Q304 HydrophobicContact CB-CG 4.31Å; K301-Q304 VanDerWaalsContact CB-OE1 3.3Å; K301-Q304 PolarHBondContact O-N 2.97Å; K302-Q304 PolarHBondContact O-N 3.43Å; Q304-F338 HydrophobicContact CB-CE2 3.97Å; Q304-F338 HydrophobicContact CB-CZ 4.13Å; Q304-F338 HydrophobicContact CG-CE2 4.3Å; Q304-F338 HydrophobicContact CG-CZ 4.19Å
305	F	89.5	Confident	93.5	Very high	100 Å²	100	28.2 Å²	28.2	44%	0.439	13%	0.131	S	C	.	.			trans	-119.5	129	-173.8	-63.7	-111.5	0	0	0	109.4	R300 F338	R300-F305 VanDerWaalsContact NH1-CD1 3.26Å; R300-F305 VanDerWaalsContact NH2-CD1 3.32Å; F305-F338 WeakPolarHBondContact O-CD2 3.47Å
306	L	91.8	Very high	93.6	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.13	C	C	.	.			trans	-96	124.8	179.7	-174	59.4	0	0	0	109.9	Y56 F286 I288 D310 L311 L335 F338	Y56-L306 PolarHBondContact OH-O 3.2Å; F286-L306 HydrophobicContact CD1-CB 4.33Å; F286-L306 HydrophobicContact CD2-CD1 4.36Å; F286-L306 HydrophobicContact CD2-CD2 4.36Å; F286-L306 HydrophobicContact CE1-CB 3.91Å; F286-L306 HydrophobicContact CE2-CB 4.39Å; F286-L306 HydrophobicContact CE2-CD1 3.91Å; F286-L306 HydrophobicContact CG-CD2 4.38Å; F286-L306 HydrophobicContact CZ-CB 3.94Å; F286-L306 HydrophobicContact CZ-CD1 4.2Å; I288-L306 HydrophobicContact CD1-CD2 3.62Å; L306-D310 HydrophobicContact CD1-CB 3.55Å; L306-D310 HydrophobicContact CG-CB 4.16Å; L306-L311 HydrophobicContact CD2-CD2 3.64Å; L306-L311 HydrophobicContact CD2-CG 3.99Å; L306-L311 HydrophobicContact CG-CD2 4.31Å; L306-L311 HydrophobicContact CG-CG 4.1Å; L306-L335 HydrophobicContact CD1-CD1 3.85Å; L306-L335 HydrophobicContact CD1-CD2 4.2Å; L306-L335 HydrophobicContact CD1-CG 4.44Å; L306-F338 HydrophobicContact CD1-CB 4.44Å
307	H	93.7	Very high	93.5	Very high	4 Å²	4	29.2 Å²	29.2	2%	0.019	14%	0.136	C	C	.	.			trans	-74.8	154.4	-170.9	-164.3	-97.2	0	0	0	112.4	I309 D310 L311 K337	H307-I309 PolarHBondContact ND1-N 3.01Å; H307-I309 PolarHBondContact O-N 3.39Å; H307-D310 VanDerWaalsContact CB-OD2 3.31Å; H307-D310 WeakPolarHBondContact CB-OD2 3.25Å; H307-D310 PolarHBondContact N-OD2 3.27Å; H307-D310 WeakPolarHBondContact O-CB 3.38Å; H307-D310 PolarHBondContact O-N 3.46Å; H307-L311 PolarHBondContact O-N 3.37Å; H307-K337 HydrophobicContact CB-CB 3.38Å; H307-K337 HydrophobicContact CB-CG 4.31Å
308	H	93.3	Very high	93.5	Very high	14 Å²	14	29.6 Å²	29.6	7%	0.065	14%	0.139	C	C	.	.	H	α-helix	trans	-60.4	-35.7	179.2	66.8	79.7	0	0	0	112.1	Y204 S257 V259 L311 H312	Y204-H308 PolarHBondContact OH-ND1 3.33Å; S257-H308 WeakPolarHBondContact CB-CE1 3.43Å; S257-H308 PolarHBondContact OG-CE1 3.23Å; V259-H308 HydrophobicContact CG2-CB 4.48Å; H308-L311 PolarHBondContact O-N 2.78Å; H308-H312 AromaticContact ND1-CE1 3.86Å; H308-H312 PolarHBondContact O-CD2 3.38Å; H308-H312 PolarHBondContact O-N 2.67Å; H308-H312 PolarHBondContact O-ND1 3.43Å
309	I	96.1	Very high	93.3	Very high	13 Å²	13	31.6 Å²	31.6	7%	0.067	16%	0.163	C	C	.	.	H	α-helix	trans	-58.6	-49.3	171.9	-62.6	179.8	0	0	0	110.5	Y204 Y207 H307 L311 H312 L313 K337	Y204-I309 HydrophobicContact CD1-CG2 4.17Å; Y204-I309 HydrophobicContact CE1-CB 4.16Å; Y204-I309 HydrophobicContact CE1-CG1 3.91Å; Y204-I309 HydrophobicContact CE1-CG2 3.99Å; Y207-I309 HydrophobicContact CD2-CD1 3.98Å; Y207-I309 HydrophobicContact CD2-CG2 3.9Å; Y207-I309 HydrophobicContact CE2-CD1 3.94Å; Y207-I309 HydrophobicContact CG-CG2 4.2Å; H307-I309 PolarHBondContact ND1-N 3.01Å; H307-I309 PolarHBondContact O-N 3.39Å; I309-L311 VanDerWaalsContact C-N 3.31Å; I309-L311 PolarHBondContact O-N 3.2Å; I309-H312 PolarHBondContact O-N 3.22Å; I309-H312 VanDerWaalsContact O-N 3.17Å; I309-L313 HydrophobicContact CG2-CD1 3.97Å; I309-L313 HydrophobicContact CG2-CG 4.38Å; I309-L313 WeakPolarHBondContact O-CG 3.2Å; I309-L313 PolarHBondContact O-N 3.27Å; I309-K337 HydrophobicContact CB-CG 4.17Å; I309-K337 HydrophobicContact CD1-CG 4.13Å; I309-K337 HydrophobicContact CG2-CG 4.46Å
310	D	97.1	Very high	93.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.6	-40.4	179.8	-55.7	-33.9	0	0	0	111.2	L306 H307 L313 V314 L335 P336 K337 F338	L306-D310 HydrophobicContact CD1-CB 3.55Å; L306-D310 HydrophobicContact CG-CB 4.16Å; H307-D310 VanDerWaalsContact CB-OD2 3.31Å; H307-D310 WeakPolarHBondContact CB-OD2 3.25Å; H307-D310 PolarHBondContact N-OD2 3.27Å; H307-D310 WeakPolarHBondContact O-CB 3.38Å; H307-D310 PolarHBondContact O-N 3.46Å; D310-L313 PolarHBondContact O-N 2.84Å; D310-V314 WeakPolarHBondContact O-CB 3.42Å; D310-V314 VanDerWaalsContact O-CG2 3.25Å; D310-V314 WeakPolarHBondContact O-CG2 3.48Å; D310-V314 PolarHBondContact O-N 3.33Å; D310-L335 HydrophobicContact CB-CB 4.43Å; D310-L335 HydrophobicContact CB-CD2 4.17Å; D310-L335 VanDerWaalsContact OD1-C 3.31Å; D310-P336 VanDerWaalsContact OD1-CD 3.27Å; D310-P336 WeakPolarHBondContact OD1-CD 3.27Å; D310-P336 VanDerWaalsContact OD1-N 3.1Å; D310-K337 PolarHBondContact OD1-N 2.99Å; D310-K337 WeakPolarHBondContact OD2-CB 3.25Å; D310-F338 PolarHBondContact OD2-N 3.18Å; D310-F338 VanDerWaalsContact OD2-N 3.1Å
311	L	95.8	Very high	92.8	Very high	11 Å²	11	31.7 Å²	31.7	6%	0.058	17%	0.168	C	C	.	.	H	α-helix	trans	-60.4	-46.6	172.8	-76	167.9	0	0	0	111.5	V259 I288 L306 H307 H308 I309 L313 V314 F315	V259-L311 HydrophobicContact CG2-CB 4.1Å; V259-L311 HydrophobicContact CG2-CD1 3.95Å; I288-L311 HydrophobicContact CD1-CD2 4.12Å; I288-L311 HydrophobicContact CG2-CD2 4.36Å; L306-L311 HydrophobicContact CD2-CD2 3.64Å; L306-L311 HydrophobicContact CD2-CG 3.99Å; L306-L311 HydrophobicContact CG-CD2 4.31Å; L306-L311 HydrophobicContact CG-CG 4.1Å; H307-L311 PolarHBondContact O-N 3.37Å; H308-L311 PolarHBondContact O-N 2.78Å; I309-L311 VanDerWaalsContact C-N 3.31Å; I309-L311 PolarHBondContact O-N 3.2Å; L311-L313 VanDerWaalsContact C-N 3.33Å; L311-L313 PolarHBondContact O-N 2.86Å; L311-V314 PolarHBondContact O-N 2.65Å; L311-F315 HydrophobicContact CB-CE1 4.31Å; L311-F315 HydrophobicContact CD2-CE1 4.08Å; L311-F315 WeakPolarHBondContact O-CD1 3.31Å; L311-F315 WeakPolarHBondContact O-CG 3.43Å; L311-F315 PolarHBondContact O-N 3.25Å
312	H	96.8	Very high	92.4	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.019	19%	0.189	C	C	.	.	H	α-helix	trans	-63.3	-37.6	178.1	-62.9	163.2	0	0	0	112.5	Y204 G253 L254 A258 V259 H308 I309 F315 N316	Y204-H312 HydrophobicContact CE1-CB 4.04Å; Y204-H312 AromaticContact CE1-ND1 3.61Å; Y204-H312 AromaticContact CZ-ND1 3.59Å; Y204-H312 PolarHBondContact OH-CE1 2.87Å; Y204-H312 PolarHBondContact OH-ND1 3.18Å; G253-H312 PolarHBondContact O-CE1 3.37Å; L254-H312 VanDerWaalsContact CA-CE1 3.43Å; L254-H312 WeakPolarHBondContact CA-CE1 3.34Å; L254-H312 PolarHBondContact N-CE1 3.33Å; A258-H312 PolarHBondContact N-CE1 3.17Å; A258-H312 PolarHBondContact O-CE1 3.41Å; A258-H312 VanDerWaalsContact O-CE1 3.23Å; A258-H312 PolarHBondContact O-NE2 2.93Å; V259-H312 WeakPolarHBondContact CA-NE2 3.44Å; V259-H312 VanDerWaalsContact CG2-NE2 3.32Å; V259-H312 WeakPolarHBondContact CG2-NE2 3.4Å; V259-H312 PolarHBondContact N-NE2 2.86Å; H308-H312 AromaticContact ND1-CE1 3.86Å; H308-H312 PolarHBondContact O-CD2 3.38Å; H308-H312 PolarHBondContact O-N 2.67Å; H308-H312 PolarHBondContact O-ND1 3.43Å; I309-H312 PolarHBondContact O-N 3.22Å; I309-H312 VanDerWaalsContact O-N 3.17Å; H312-F315 PolarHBondContact O-N 3.3Å; H312-N316 VanDerWaalsContact O-CB 3.31Å; H312-N316 WeakPolarHBondContact O-CB 3.29Å; H312-N316 PolarHBondContact O-N 2.93Å
313	L	96.7	Very high	92.3	Very high	8 Å²	8	30.7 Å²	30.7	4%	0.042	19%	0.187	C	C	.	.	H	α-helix	trans	-67.6	-40.5	174.9	-66.3	173.1	0	0	0	111.9	Q208 L244 I309 D310 L311 N316 L317 P336	Q208-L313 HydrophobicContact CB-CD2 3.9Å; Q208-L313 HydrophobicContact CG-CD2 4.49Å; L244-L313 HydrophobicContact CD2-CD2 3.91Å; I309-L313 HydrophobicContact CG2-CD1 3.97Å; I309-L313 HydrophobicContact CG2-CG 4.38Å; I309-L313 WeakPolarHBondContact O-CG 3.2Å; I309-L313 PolarHBondContact O-N 3.27Å; D310-L313 PolarHBondContact O-N 2.84Å; L311-L313 VanDerWaalsContact C-N 3.33Å; L311-L313 PolarHBondContact O-N 2.86Å; L313-N316 PolarHBondContact O-N 3.02Å; L313-L317 WeakPolarHBondContact O-CB 3.3Å; L313-L317 PolarHBondContact O-N 2.94Å; L313-P336 HydrophobicContact CD1-CG 4.13Å
314	V	96.1	Very high	92.3	Very high	3 Å²	3	26 Å²	26	2%	0.018	16%	0.16	C	C	.	.	H	α-helix	trans	-62.1	-41.5	172.1	169	0	0	0	0	111.5	I288 D310 L311 N316 L317 V318 I333 L335 I360	I288-V314 HydrophobicContact CD1-CG1 4.42Å; D310-V314 WeakPolarHBondContact O-CB 3.42Å; D310-V314 VanDerWaalsContact O-CG2 3.25Å; D310-V314 WeakPolarHBondContact O-CG2 3.48Å; D310-V314 PolarHBondContact O-N 3.33Å; L311-V314 PolarHBondContact O-N 2.65Å; V314-N316 VanDerWaalsContact C-N 3.35Å; V314-L317 PolarHBondContact O-N 3.42Å; V314-V318 WeakPolarHBondContact O-CG2 3.42Å; V314-V318 PolarHBondContact O-N 2.83Å; V314-I333 HydrophobicContact CG2-CD1 3.56Å; V314-L335 HydrophobicContact CG2-CD2 3.99Å; V314-I360 HydrophobicContact CG1-CD1 3.35Å
315	F	95.4	Very high	92	Very high	4 Å²	4	29.1 Å²	29.1	2%	0.018	17%	0.169	C	C	.	.	H	α-helix	trans	-67.9	-39.1	178.5	-72.3	25.9	0	0	0	110.4	V259 L290 D293 L295 L311 H312 G319	V259-F315 HydrophobicContact CG1-CD2 4.44Å; V259-F315 HydrophobicContact CG1-CE2 3.36Å; V259-F315 HydrophobicContact CG1-CZ 3.45Å; V259-F315 VanDerWaalsContact CG1-CZ 3.45Å; L290-F315 HydrophobicContact CD1-CD1 3.62Å; L290-F315 HydrophobicContact CD1-CE1 3.76Å; L290-F315 HydrophobicContact CD1-CG 4.24Å; L290-F315 HydrophobicContact CD1-CZ 4.41Å; L290-F315 HydrophobicContact CD2-CD1 4.09Å; L290-F315 HydrophobicContact CD2-CE1 3.33Å; L290-F315 HydrophobicContact CD2-CE2 4.33Å; L290-F315 HydrophobicContact CD2-CZ 3.46Å; L290-F315 VanDerWaalsContact CD2-CZ 3.46Å; L290-F315 HydrophobicContact CG-CE1 4.2Å; D293-F315 WeakPolarHBondContact O-CE2 3.35Å; L295-F315 HydrophobicContact CB-CZ 4.31Å; L311-F315 HydrophobicContact CB-CE1 4.31Å; L311-F315 HydrophobicContact CD2-CE1 4.08Å; L311-F315 WeakPolarHBondContact O-CD1 3.31Å; L311-F315 WeakPolarHBondContact O-CG 3.43Å; L311-F315 PolarHBondContact O-N 3.25Å; H312-F315 PolarHBondContact O-N 3.3Å; F315-G319 PolarHBondContact O-N 2.81Å
316	N	95.8	Very high	91.7	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-62.5	-44.9	174.4	-169.4	57.9	0	0	0	111.8	Q208 L240 L244 H312 L313 V314 S320	Q208-N316 PolarHBondContact OE1-ND2 3.07Å; L240-N316 PolarHBondContact O-ND2 2.85Å; L244-N316 PolarHBondContact N-OD1 3.3Å; H312-N316 VanDerWaalsContact O-CB 3.31Å; H312-N316 WeakPolarHBondContact O-CB 3.29Å; H312-N316 PolarHBondContact O-N 2.93Å; L313-N316 PolarHBondContact O-N 3.02Å; V314-N316 VanDerWaalsContact C-N 3.35Å; N316-S320 WeakPolarHBondContact O-CB 3.32Å; N316-S320 PolarHBondContact O-N 2.86Å; N316-S320 PolarHBondContact O-OG 2.87Å
317	L	94.8	Very high	91.4	Very high	25 Å²	25	35.6 Å²	35.6	13%	0.131	21%	0.212	C	C	.	.	H	α-helix	trans	-59.5	-49.8	175.7	178.6	63.2	0	0	0	112.1	L240 L313 V314 S321 F324 T331 I348	L240-L317 HydrophobicContact CD1-CD1 4.17Å; L240-L317 HydrophobicContact CD2-CD1 4.17Å; L313-L317 WeakPolarHBondContact O-CB 3.3Å; L313-L317 PolarHBondContact O-N 2.94Å; V314-L317 PolarHBondContact O-N 3.42Å; L317-S321 WeakPolarHBondContact O-CB 3.39Å; L317-S321 PolarHBondContact O-N 2.95Å; L317-S321 PolarHBondContact O-OG 2.94Å; L317-S321 VanDerWaalsContact O-OG 3.13Å; L317-F324 HydrophobicContact CG-CE2 4.34Å; L317-T331 HydrophobicContact CD2-CG2 4.45Å; L317-I348 HydrophobicContact CD2-CD1 4.2Å
318	V	93.6	Very high	91.3	Very high	8 Å²	8	38.5 Å²	38.5	5%	0.048	23%	0.226	C	C	.	.	H	α-helix	trans	-72	-35.5	-178.7	173.9	0	0	0	0	112.4	V314 I348 C358 I360	V314-V318 WeakPolarHBondContact O-CG2 3.42Å; V314-V318 PolarHBondContact O-N 2.83Å; V318-I348 HydrophobicContact CG2-CD1 4.12Å; V318-I348 HydrophobicContact CG2-CG2 3.83Å; V318-C358 HydrophobicContact CG1-CB 4.15Å; V318-I360 HydrophobicContact CG2-CD1 3.68Å; V318-I360 HydrophobicContact CG2-CG1 4.33Å
319	G	90.9	Very high	91.3	Very high	57 Å²	57	38.4 Å²	38.4	59%	0.588	23%	0.228	S	C	*	.	H	α-helix	trans	-70.9	-35.1	178.5	0	0	0	0	0	113.6	F315	F315-G319 PolarHBondContact O-N 2.81Å
320	S	89.8	Confident	91.3	Very high	26 Å²	26	40.8 Å²	40.8	18%	0.182	24%	0.236	C	C	.	.	H	α-helix	trans	-84.5	-23.6	-176.5	-51.6	0	0	0	0	113.6	N243 N316	N243-S320 VanDerWaalsContact CB-OG 3.32Å; N243-S320 WeakPolarHBondContact CB-OG 3.3Å; N316-S320 WeakPolarHBondContact O-CB 3.32Å; N316-S320 PolarHBondContact O-N 2.86Å; N316-S320 PolarHBondContact O-OG 2.87Å
321	S	87.2	Confident	91.1	Very high	7 Å²	7	42.4 Å²	42.4	5%	0.049	25%	0.246	C	C	.	.			trans	-100.7	100.7	-173.2	-62.9	0	0	0	0	112.5	Y239 L317 S323	Y239-S321 PolarHBondContact OH-OG 3.49Å; L317-S321 WeakPolarHBondContact O-CB 3.39Å; L317-S321 PolarHBondContact O-N 2.95Å; L317-S321 PolarHBondContact O-OG 2.94Å; L317-S321 VanDerWaalsContact O-OG 3.13Å; S321-S323 VanDerWaalsContact C-N 3.28Å; S321-S323 PolarHBondContact O-N 3.36Å
322	S	82.6	Confident	91.1	Very high	95 Å²	95	44.1 Å²	44.1	66%	0.664	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-66.5	-25.5	177.9	57.8	0	0	0	0	114	F324 R325	S322-F324 PolarHBondContact O-N 3.2Å; S322-R325 WeakPolarHBondContact O-CB 3Å; S322-R325 PolarHBondContact O-N 3.42Å
323	S	85.3	Confident	91	Very high	82 Å²	82	44.4 Å²	44.4	57%	0.573	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-54.9	-34.5	-179.2	51.9	0	0	0	0	113.6	S321 R325 E326	S321-S323 VanDerWaalsContact C-N 3.28Å; S321-S323 PolarHBondContact O-N 3.36Å; S323-R325 PolarHBondContact O-N 3.47Å; S323-R325 VanDerWaalsContact O-N 3.15Å; S323-E326 PolarHBondContact O-N 3.07Å
324	F	86.3	Confident	91	Very high	18 Å²	18	44.1 Å²	44.1	8%	0.079	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-66	-14.7	178.4	-58	-46.9	0	0	0	113.9	L317 S322 T331 I348 Y350	L317-F324 HydrophobicContact CG-CE2 4.34Å; S322-F324 PolarHBondContact O-N 3.2Å; F324-T331 HydrophobicContact CZ-CG2 4.28Å; F324-I348 HydrophobicContact CB-CG2 3.95Å; F324-I348 HydrophobicContact CD1-CB 4.15Å; F324-I348 HydrophobicContact CD1-CG2 4.12Å; F324-I348 HydrophobicContact CD2-CD1 4.37Å; F324-I348 HydrophobicContact CD2-CG2 3.87Å; F324-I348 HydrophobicContact CE1-CB 4.37Å; F324-I348 HydrophobicContact CE1-CD1 4.14Å; F324-I348 HydrophobicContact CE2-CD1 3.82Å; F324-I348 HydrophobicContact CE2-CG2 4.39Å; F324-I348 HydrophobicContact CG-CB 4.27Å; F324-I348 HydrophobicContact CG-CG2 3.72Å; F324-I348 HydrophobicContact CZ-CD1 3.71Å; F324-Y350 HydrophobicContact CB-CE2 4.24Å; F324-Y350 WeakPolarHBondContact O-CD2 3.49Å
325	R	84.6	Confident	91	Very high	131 Å²	131	44.1 Å²	44.1	49%	0.494	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-76.4	-20	-179.6	-66.9	-177.7	171	-89.7	5.5	113.9	S322 S323 Y350	S322-R325 WeakPolarHBondContact O-CB 3Å; S322-R325 PolarHBondContact O-N 3.42Å; S323-R325 PolarHBondContact O-N 3.47Å; S323-R325 VanDerWaalsContact O-N 3.15Å; R325-Y350 HydrophobicContact CB-CD2 4.49Å; R325-Y350 HydrophobicContact CB-CE2 4.42Å; R325-Y350 HydrophobicContact CG-CD2 4.1Å; R325-Y350 HydrophobicContact CG-CE2 3.61Å
326	E	82.3	Confident	91.1	Very high	196 Å²	196	44.1 Å²	44.1	92%	0.916	26%	0.259	S	S	*	.	S	Bend	trans	-102.3	-3	-174.1	-60.7	-170	168.9	0	0	113.7	S323	S323-E326 PolarHBondContact O-N 3.07Å
327	G	86.2	Confident	91.1	Very high	41 Å²	41	47.4 Å²	47.4	42%	0.423	27%	0.273	S	S	.	.	S	Bend	trans	-169.6	-149.8	-177.6	0	0	0	0	0	114.9
328	E	91.8	Very high	91.1	Very high	65 Å²	65	49 Å²	49	30%	0.304	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	115.8	172.8	-52	-161.3	151.8	0	0	109	H347 F369 S373 K376	E328-H347 VanDerWaalsContact CD-NE2 3.34Å; E328-H347 IonicContact OE1-CE1 2.91Å; E328-H347 IonicContact OE1-NE2 3.19Å; E328-H347 IonicContact OE2-CD2 2.92Å; E328-H347 IonicContact OE2-CE1 3.77Å; E328-H347 PolarHBondContact OE2-CE1 2.99Å; E328-H347 IonicContact OE2-NE2 3.82Å; E328-H347 PolarHBondContact OE2-NE2 3.09Å; E328-F369 HydrophobicContact CB-CE2 4.28Å; E328-F369 HydrophobicContact CB-CZ 4.4Å; E328-S373 VanDerWaalsContact OE2-CB 3.31Å; E328-S373 WeakPolarHBondContact OE2-CB 3.33Å; E328-S373 PolarHBondContact OE2-OG 2.84Å; E328-K376 WeakPolarHBondContact OE1-CD 3.42Å; E328-K376 WeakPolarHBondContact OE1-CE 3.4Å; E328-K376 IonicContact OE1-NZ 3.01Å; E328-K376 PolarHBondContact OE1-NZ 2.95Å
329	G	93	Very high	91.1	Very high	11 Å²	11	51.8 Å²	51.8	11%	0.113	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	135.1	173.6	0	0	0	0	0	111.1	H347 I348	G329-H347 CarbonylContact O-C 3.58Å; G329-H347 VanDerWaalsContact O-CA 3.32Å; G329-H347 WeakPolarHBondContact O-CA 3.39Å; G329-I348 PolarHBondContact N-O 2.79Å; G329-I348 PolarHBondContact O-N 3.27Å
330	W	95.1	Very high	91.2	Very high	64 Å²	64	51.3 Å²	51.3	24%	0.242	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	115.3	164.3	-169.3	-124.6	0	0	0	107.6	H345 H347 R366 D368 F369 M372	W330-H345 HydrophobicContact CD2-CB 4.22Å; W330-H345 AromaticContact CE2-ND1 3.9Å; W330-H345 HydrophobicContact CE3-CB 4.32Å; W330-H345 HydrophobicContact CH2-CB 3.42Å; W330-H345 VanDerWaalsContact CH2-CB 3.42Å; W330-H345 HydrophobicContact CZ2-CB 3.27Å; W330-H345 AromaticContact CZ2-CG 3.93Å; W330-H345 HydrophobicContact CZ3-CB 3.94Å; W330-H345 AromaticContact NE1-ND1 3.66Å; W330-H347 HydrophobicContact CE3-CB 3.86Å; W330-H347 HydrophobicContact CZ3-CB 3.8Å; W330-R366 VanDerWaalsContact CZ2-O 3.29Å; W330-R366 WeakPolarHBondContact CZ2-O 2.9Å; W330-R366 PolarHBondContact NE1-O 2.97Å; W330-D368 HydrophobicContact CH2-CB 4.14Å; W330-D368 HydrophobicContact CZ2-CB 4.36Å; W330-F369 HydrophobicContact CB-CD2 3.68Å; W330-F369 HydrophobicContact CB-CE2 4.15Å; W330-F369 HydrophobicContact CD2-CB 3.99Å; W330-F369 AromaticContact CD2-CD2 3.97Å; W330-F369 HydrophobicContact CD2-CD2 3.97Å; W330-F369 HydrophobicContact CD2-CG 4.48Å; W330-F369 HydrophobicContact CE3-CB 4.45Å; W330-F369 HydrophobicContact CE3-CD2 4.12Å; W330-F369 HydrophobicContact CG-CB 4.21Å; W330-F369 AromaticContact CG-CD2 3.83Å; W330-F369 HydrophobicContact CG-CD2 3.83Å; W330-F369 HydrophobicContact CG-CG 4.4Å; W330-F369 HydrophobicContact CZ2-CB 4.36Å; W330-M372 HydrophobicContact CH2-CG 4.09Å; W330-M372 HydrophobicContact CZ3-CB 4.46Å; W330-M372 HydrophobicContact CZ3-CG 3.86Å
331	T	93.8	Very high	91.4	Very high	34 Å²	34	52.5 Å²	52.5	21%	0.209	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	138	-173.1	-172.6	0	0	0	0	111	L317 F324 H345 A346 I348	L317-T331 HydrophobicContact CD2-CG2 4.45Å; F324-T331 HydrophobicContact CZ-CG2 4.28Å; T331-H345 WeakPolarHBondContact O-CA 3.32Å; T331-A346 HydrophobicContact CG2-CB 4.36Å; T331-A346 PolarHBondContact N-O 3.25Å; T331-A346 VanDerWaalsContact N-O 3.12Å; T331-A346 PolarHBondContact O-N 3.41Å; T331-I348 HydrophobicContact CG2-CD1 3.69Å
332	P	94.8	Very high	91.6	Very high	46 Å²	46	53.2 Å²	53.2	30%	0.299	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	139.5	169.8	30.7	-34.1	0	0	0	110	F343 F344	P332-F343 HydrophobicContact CB-CB 4.34Å; P332-F343 HydrophobicContact CB-CD1 3.96Å; P332-F343 HydrophobicContact CB-CE1 4.47Å; P332-F343 HydrophobicContact CB-CG 4.16Å; P332-F344 CarbonylContact C-O 3.53Å; P332-F344 WeakPolarHBondContact CA-O 3.32Å
333	I	95.1	Very high	92.2	Very high	11 Å²	11	51 Å²	51	6%	0.056	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	124.6	-177.8	153.7	171.4	0	0	0	109.4	V314 L335 F344 A346	V314-I333 HydrophobicContact CG2-CD1 3.56Å; I333-L335 HydrophobicContact CD1-CD2 3.59Å; I333-L335 HydrophobicContact CD1-CG 4.47Å; I333-L335 HydrophobicContact CG1-CD2 3.85Å; I333-L335 HydrophobicContact CG1-CG 4.27Å; I333-F344 PolarHBondContact N-O 2.88Å; I333-F344 PolarHBondContact O-N 2.95Å; I333-A346 HydrophobicContact CG2-CB 3.48Å; I333-A346 VanDerWaalsContact CG2-CB 3.48Å
334	C	96.6	Very high	92.7	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.007	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	141.8	166.1	-177.3	0	0	0	0	109.2	V210 S211 T214 P336 N339 F343	V210-C334 WeakPolarHBondContact O-CB 3.41Å; S211-C334 WeakPolarHBondContact CA-O 3.08Å; S211-C334 WeakPolarHBondContact CB-O 3.38Å; S211-C334 WeakPolarHBondContact O-CB 3.29Å; S211-C334 PolarHBondContact O-N 3.41Å; T214-C334 HydrophobicContact CG2-CB 3.81Å; C334-P336 WeakPolarHBondContact O-CD 3.4Å; C334-N339 PolarHBondContact SG-O 3Å; C334-F343 HydrophobicContact CB-CD1 4.11Å; C334-F343 HydrophobicContact CB-CE1 4.22Å
335	L	97	Very high	93.1	Very high	3 Å²	3	48 Å²	48	2%	0.016	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	87	179.3	-64.1	173.7	0	0	0	107.9	F286 L306 D310 V314 I333 K337 F338 N339 F344 V362	F286-L335 HydrophobicContact CD2-CD1 4.2Å; F286-L335 HydrophobicContact CE2-CD1 3.96Å; L306-L335 HydrophobicContact CD1-CD1 3.85Å; L306-L335 HydrophobicContact CD1-CD2 4.2Å; L306-L335 HydrophobicContact CD1-CG 4.44Å; D310-L335 HydrophobicContact CB-CB 4.43Å; D310-L335 HydrophobicContact CB-CD2 4.17Å; D310-L335 VanDerWaalsContact OD1-C 3.31Å; V314-L335 HydrophobicContact CG2-CD2 3.99Å; I333-L335 HydrophobicContact CD1-CD2 3.59Å; I333-L335 HydrophobicContact CD1-CG 4.47Å; I333-L335 HydrophobicContact CG1-CD2 3.85Å; I333-L335 HydrophobicContact CG1-CG 4.27Å; L335-K337 VanDerWaalsContact C-N 3.26Å; L335-K337 PolarHBondContact O-N 2.6Å; L335-K337 VanDerWaalsContact O-N 3.07Å; L335-F338 HydrophobicContact CB-CB 3.91Å; L335-F338 HydrophobicContact CD1-CD1 4.15Å; L335-F338 PolarHBondContact O-N 3.29Å; L335-N339 CarbonylContact O-C 3.58Å; L335-N339 PolarHBondContact O-N 3.08Å; L335-F344 HydrophobicContact CB-CD2 4.38Å; L335-F344 HydrophobicContact CB-CE2 4.3Å; L335-F344 HydrophobicContact CD1-CD2 3.83Å; L335-F344 HydrophobicContact CD1-CE2 4.08Å; L335-F344 HydrophobicContact CD1-CG 4.41Å; L335-F344 HydrophobicContact CG-CD2 4Å; L335-F344 HydrophobicContact CG-CE2 4.35Å; L335-V362 HydrophobicContact CD1-CG1 4.28Å
336	P	96	Very high	93.7	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.032	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-20.5	-159.3	-24.2	35.1	0	0	0	116.1	Y207 V210 D310 L313 C334 T340	Y207-P336 HydrophobicContact CD1-CB 3.4Å; Y207-P336 VanDerWaalsContact CD1-CB 3.4Å; Y207-P336 HydrophobicContact CD1-CG 4.25Å; Y207-P336 HydrophobicContact CE1-CB 4.08Å; Y207-P336 HydrophobicContact CG-CB 4.13Å; Y207-P336 WeakPolarHBondContact O-CG 3.27Å; V210-P336 HydrophobicContact CB-CB 4.27Å; V210-P336 HydrophobicContact CB-CG 4.11Å; V210-P336 HydrophobicContact CG1-CB 3.83Å; V210-P336 HydrophobicContact CG1-CG 3.93Å; D310-P336 VanDerWaalsContact OD1-CD 3.27Å; D310-P336 WeakPolarHBondContact OD1-CD 3.27Å; D310-P336 VanDerWaalsContact OD1-N 3.1Å; L313-P336 HydrophobicContact CD1-CG 4.13Å; C334-P336 WeakPolarHBondContact O-CD 3.4Å; P336-T340 WeakPolarHBondContact O-CG2 2.99Å
337	K	95.7	Very high	94.4	Very high	70 Å²	70	32.5 Å²	32.5	30%	0.304	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-5.9	175.1	-73	-69	-58.1	-176.9	0	113.3	L59 Y207 H307 I309 D310 L335	L59-K337 PolarHBondContact O-NZ 3.28Å; L59-K337 VanDerWaalsContact O-NZ 3.1Å; Y207-K337 HydrophobicContact CE1-CD 4.35Å; Y207-K337 HydrophobicContact CE2-CD 4.27Å; H307-K337 HydrophobicContact CB-CB 3.38Å; H307-K337 HydrophobicContact CB-CG 4.31Å; I309-K337 HydrophobicContact CB-CG 4.17Å; I309-K337 HydrophobicContact CD1-CG 4.13Å; I309-K337 HydrophobicContact CG2-CG 4.46Å; D310-K337 PolarHBondContact OD1-N 2.99Å; D310-K337 WeakPolarHBondContact OD2-CB 3.25Å; L335-K337 VanDerWaalsContact C-N 3.26Å; L335-K337 PolarHBondContact O-N 2.6Å; L335-K337 VanDerWaalsContact O-N 3.07Å
338	F	95.1	Very high	94.9	Very high	59 Å²	59	30.7 Å²	30.7	26%	0.259	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-49.6	170.5	-179	-115	0	0	0	112.2	V285 F286 Q304 F305 L306 D310 L335 F344	V285-F338 HydrophobicContact CG1-CE1 4.09Å; V285-F338 HydrophobicContact CG1-CZ 4.16Å; F286-F338 AromaticContact CE2-CD1 3.92Å; F286-F338 HydrophobicContact CE2-CD1 3.92Å; F286-F338 AromaticContact CE2-CE1 3.78Å; F286-F338 HydrophobicContact CE2-CE1 3.78Å; F286-F338 HydrophobicContact CE2-CE2 4.4Å; F286-F338 HydrophobicContact CE2-CG 4.28Å; F286-F338 HydrophobicContact CE2-CZ 4.03Å; F286-F338 HydrophobicContact CZ-CD1 4.22Å; F286-F338 HydrophobicContact CZ-CD2 4.02Å; F286-F338 AromaticContact CZ-CE1 3.97Å; F286-F338 HydrophobicContact CZ-CE1 3.97Å; F286-F338 AromaticContact CZ-CE2 3.77Å; F286-F338 HydrophobicContact CZ-CE2 3.77Å; F286-F338 HydrophobicContact CZ-CG 4.24Å; F286-F338 AromaticContact CZ-CZ 3.74Å; F286-F338 HydrophobicContact CZ-CZ 3.74Å; Q304-F338 HydrophobicContact CB-CE2 3.97Å; Q304-F338 HydrophobicContact CB-CZ 4.13Å; Q304-F338 HydrophobicContact CG-CE2 4.3Å; Q304-F338 HydrophobicContact CG-CZ 4.19Å; F305-F338 WeakPolarHBondContact O-CD2 3.47Å; L306-F338 HydrophobicContact CD1-CB 4.44Å; D310-F338 PolarHBondContact OD2-N 3.18Å; D310-F338 VanDerWaalsContact OD2-N 3.1Å; L335-F338 HydrophobicContact CB-CB 3.91Å; L335-F338 HydrophobicContact CD1-CD1 4.15Å; L335-F338 PolarHBondContact O-N 3.29Å; F338-F344 HydrophobicContact CD1-CE1 4.39Å; F338-F344 AromaticContact CD1-CE2 3.82Å; F338-F344 HydrophobicContact CD1-CE2 3.82Å; F338-F344 AromaticContact CD1-CZ 3.54Å; F338-F344 HydrophobicContact CD1-CZ 3.54Å; F338-F344 AromaticContact CE1-CE1 3.93Å; F338-F344 HydrophobicContact CE1-CE1 3.93Å; F338-F344 HydrophobicContact CE1-CE2 4.19Å; F338-F344 AromaticContact CE1-CZ 3.46Å; F338-F344 HydrophobicContact CE1-CZ 3.46Å; F338-F344 VanDerWaalsContact CE1-CZ 3.46Å
339	N	94.8	Very high	95.1	Very high	65 Å²	65	27.6 Å²	27.6	35%	0.348	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	108.5	172.3	-180	11.3	0	0	0	110	C334 L335 A341 F344	C334-N339 PolarHBondContact SG-O 3Å; L335-N339 CarbonylContact O-C 3.58Å; L335-N339 PolarHBondContact O-N 3.08Å; N339-A341 VanDerWaalsContact C-N 3.26Å; N339-A341 PolarHBondContact O-N 2.83Å; N339-A341 WeakPolarHBondContact OD1-CB 3.4Å; N339-A341 PolarHBondContact OD1-N 2.64Å; N339-F344 HydrophobicContact CB-CE2 4.04Å; N339-F344 HydrophobicContact CB-CZ 4.07Å
340	T	92.9	Very high	95.1	Very high	48 Å²	48	28.2 Å²	28.2	29%	0.294	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	-19.1	175.9	49.4	0	0	0	0	114	T214 L215 P336	T214-T340 WeakPolarHBondContact CB-O 3.32Å; L215-T340 WeakPolarHBondContact CB-O 3.25Å; L215-T340 HydrophobicContact CD2-CG2 4.29Å; L215-T340 PolarHBondContact N-O 3.06Å; P336-T340 WeakPolarHBondContact O-CG2 2.99Å
341	A	92.9	Very high	94.9	Very high	50 Å²	50	25.7 Å²	25.7	41%	0.413	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-9.6	-160.5	0	0	0	0	0	114.9	T216 N339	T216-A341 WeakPolarHBondContact CB-O 3.48Å; T216-A341 WeakPolarHBondContact OG1-CA 3.27Å; T216-A341 WeakPolarHBondContact OG1-CB 3.41Å; T216-A341 PolarHBondContact OG1-O 2.71Å; N339-A341 VanDerWaalsContact C-N 3.26Å; N339-A341 PolarHBondContact O-N 2.83Å; N339-A341 WeakPolarHBondContact OD1-CB 3.4Å; N339-A341 PolarHBondContact OD1-N 2.64Å
342	G	92	Very high	94.6	Very high	22 Å²	22	27.7 Å²	27.7	23%	0.227	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	164.8	-175.9	0	0	0	0	0	113.7
343	F	94.1	Very high	94	Very high	50 Å²	50	31.6 Å²	31.6	22%	0.219	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	144.1	174.7	-69.1	-73.3	0	0	0	111.8	L212 T214 P332 C334	L212-F343 WeakPolarHBondContact O-CE1 3.39Å; L212-F343 WeakPolarHBondContact O-CZ 3.24Å; T214-F343 HydrophobicContact CG2-CD1 4.05Å; T214-F343 HydrophobicContact CG2-CD2 3.72Å; T214-F343 HydrophobicContact CG2-CE1 3.96Å; T214-F343 HydrophobicContact CG2-CE2 3.63Å; T214-F343 HydrophobicContact CG2-CG 3.94Å; T214-F343 HydrophobicContact CG2-CZ 3.76Å; P332-F343 HydrophobicContact CB-CB 4.34Å; P332-F343 HydrophobicContact CB-CD1 3.96Å; P332-F343 HydrophobicContact CB-CE1 4.47Å; P332-F343 HydrophobicContact CB-CG 4.16Å; C334-F343 HydrophobicContact CB-CD1 4.11Å; C334-F343 HydrophobicContact CB-CE1 4.22Å
344	F	96	Very high	93.4	Very high	16 Å²	16	35 Å²	35	7%	0.07	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	167.7	154.6	-57.9	-88	0	0	0	108	V285 P332 I333 L335 F338 N339 V362 S363 T364	V285-F344 HydrophobicContact CG2-CD1 4.31Å; V285-F344 HydrophobicContact CG2-CE1 4.4Å; P332-F344 CarbonylContact C-O 3.53Å; P332-F344 WeakPolarHBondContact CA-O 3.32Å; I333-F344 PolarHBondContact N-O 2.88Å; I333-F344 PolarHBondContact O-N 2.95Å; L335-F344 HydrophobicContact CB-CD2 4.38Å; L335-F344 HydrophobicContact CB-CE2 4.3Å; L335-F344 HydrophobicContact CD1-CD2 3.83Å; L335-F344 HydrophobicContact CD1-CE2 4.08Å; L335-F344 HydrophobicContact CD1-CG 4.41Å; L335-F344 HydrophobicContact CG-CD2 4Å; L335-F344 HydrophobicContact CG-CE2 4.35Å; F338-F344 HydrophobicContact CD1-CE1 4.39Å; F338-F344 AromaticContact CD1-CE2 3.82Å; F338-F344 HydrophobicContact CD1-CE2 3.82Å; F338-F344 AromaticContact CD1-CZ 3.54Å; F338-F344 HydrophobicContact CD1-CZ 3.54Å; F338-F344 AromaticContact CE1-CE1 3.93Å; F338-F344 HydrophobicContact CE1-CE1 3.93Å; F338-F344 HydrophobicContact CE1-CE2 4.19Å; F338-F344 AromaticContact CE1-CZ 3.46Å; F338-F344 HydrophobicContact CE1-CZ 3.46Å; F338-F344 VanDerWaalsContact CE1-CZ 3.46Å; N339-F344 HydrophobicContact CB-CE2 4.04Å; N339-F344 HydrophobicContact CB-CZ 4.07Å; F344-V362 HydrophobicContact CB-CG1 3.51Å; F344-V362 HydrophobicContact CD1-CG1 4.21Å; F344-V362 HydrophobicContact CG-CG1 3.92Å; F344-S363 WeakPolarHBondContact CA-O 3.4Å; F344-S363 WeakPolarHBondContact CB-O 3.45Å; F344-T364 HydrophobicContact CD1-CG2 4.28Å; F344-T364 HydrophobicContact CE1-CG2 4.19Å
345	H	96.2	Very high	92.9	Very high	21 Å²	21	35.6 Å²	35.6	10%	0.097	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	127.5	169.5	-72.6	-108.5	0	0	0	109.7	W330 T331 S363 R366	W330-H345 HydrophobicContact CD2-CB 4.22Å; W330-H345 AromaticContact CE2-ND1 3.9Å; W330-H345 HydrophobicContact CE3-CB 4.32Å; W330-H345 HydrophobicContact CH2-CB 3.42Å; W330-H345 VanDerWaalsContact CH2-CB 3.42Å; W330-H345 HydrophobicContact CZ2-CB 3.27Å; W330-H345 AromaticContact CZ2-CG 3.93Å; W330-H345 HydrophobicContact CZ3-CB 3.94Å; W330-H345 AromaticContact NE1-ND1 3.66Å; T331-H345 WeakPolarHBondContact O-CA 3.32Å; H345-S363 PolarHBondContact N-O 2.88Å; H345-S363 PolarHBondContact O-N 3.04Å; H345-R366 VanDerWaalsContact NE2-CG 3.32Å; H345-R366 WeakPolarHBondContact NE2-CG 3.41Å
346	A	96.9	Very high	92.5	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.008	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	125.8	175.7	0	0	0	0	0	110.7	T331 I333 I348 I360 L361	T331-A346 HydrophobicContact CG2-CB 4.36Å; T331-A346 PolarHBondContact N-O 3.25Å; T331-A346 VanDerWaalsContact N-O 3.12Å; T331-A346 PolarHBondContact O-N 3.41Å; I333-A346 HydrophobicContact CG2-CB 3.48Å; I333-A346 VanDerWaalsContact CG2-CB 3.48Å; A346-I348 HydrophobicContact CB-CD1 4.26Å; A346-I348 HydrophobicContact CB-CG1 3.98Å; A346-I360 HydrophobicContact CB-CG2 4.24Å; A346-L361 WeakPolarHBondContact CA-O 3Å
347	H	97	Very high	92.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	114.6	159.6	-176.2	-83.2	0	0	0	107.6	E328 G329 W330 S349 I360 L361 F369 M372	E328-H347 VanDerWaalsContact CD-NE2 3.34Å; E328-H347 IonicContact OE1-CE1 2.91Å; E328-H347 IonicContact OE1-NE2 3.19Å; E328-H347 IonicContact OE2-CD2 2.92Å; E328-H347 IonicContact OE2-CE1 3.77Å; E328-H347 PolarHBondContact OE2-CE1 2.99Å; E328-H347 IonicContact OE2-NE2 3.82Å; E328-H347 PolarHBondContact OE2-NE2 3.09Å; G329-H347 CarbonylContact O-C 3.58Å; G329-H347 VanDerWaalsContact O-CA 3.32Å; G329-H347 WeakPolarHBondContact O-CA 3.39Å; W330-H347 HydrophobicContact CE3-CB 3.86Å; W330-H347 HydrophobicContact CZ3-CB 3.8Å; H347-S349 PolarHBondContact CE1-OG 3.16Å; H347-I360 CarbonylContact O-C 3.6Å; H347-I360 VanDerWaalsContact O-CA 3.32Å; H347-I360 WeakPolarHBondContact O-CA 3.18Å; H347-L361 HydrophobicContact CB-CB 4.2Å; H347-L361 PolarHBondContact N-O 3.08Å; H347-L361 PolarHBondContact O-N 3.39Å; H347-F369 AromaticContact CD2-CD2 3.85Å; H347-F369 AromaticContact CD2-CE2 3.73Å; H347-M372 HydrophobicContact CB-CB 3.54Å; H347-M372 HydrophobicContact CB-CG 4.02Å
348	I	96.6	Very high	92.4	Very high	2 Å²	2	36 Å²	36	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	119.8	-177.5	-59.4	172.1	0	0	0	107.2	L317 V318 F324 G329 T331 A346 I360	L317-I348 HydrophobicContact CD2-CD1 4.2Å; V318-I348 HydrophobicContact CG2-CD1 4.12Å; V318-I348 HydrophobicContact CG2-CG2 3.83Å; F324-I348 HydrophobicContact CB-CG2 3.95Å; F324-I348 HydrophobicContact CD1-CB 4.15Å; F324-I348 HydrophobicContact CD1-CG2 4.12Å; F324-I348 HydrophobicContact CD2-CD1 4.37Å; F324-I348 HydrophobicContact CD2-CG2 3.87Å; F324-I348 HydrophobicContact CE1-CB 4.37Å; F324-I348 HydrophobicContact CE1-CD1 4.14Å; F324-I348 HydrophobicContact CE2-CD1 3.82Å; F324-I348 HydrophobicContact CE2-CG2 4.39Å; F324-I348 HydrophobicContact CG-CB 4.27Å; F324-I348 HydrophobicContact CG-CG2 3.72Å; F324-I348 HydrophobicContact CZ-CD1 3.71Å; G329-I348 PolarHBondContact N-O 2.79Å; G329-I348 PolarHBondContact O-N 3.27Å; T331-I348 HydrophobicContact CG2-CD1 3.69Å; A346-I348 HydrophobicContact CB-CD1 4.26Å; A346-I348 HydrophobicContact CB-CG1 3.98Å; I348-I360 HydrophobicContact CG1-CG2 4.25Å
349	S	94.9	Very high	92.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	146.4	174.8	64.5	0	0	0	0	113.5	H347 L359 K376	H347-S349 PolarHBondContact CE1-OG 3.16Å; S349-L359 PolarHBondContact N-O 3.15Å; S349-L359 PolarHBondContact O-N 2.72Å; S349-K376 VanDerWaalsContact CB-NZ 3.27Å; S349-K376 VanDerWaalsContact OG-CD 3.32Å; S349-K376 WeakPolarHBondContact OG-CD 3.45Å; S349-K376 VanDerWaalsContact OG-CE 3.27Å; S349-K376 WeakPolarHBondContact OG-CE 3.34Å; S349-K376 PolarHBondContact OG-NZ 3.41Å
350	Y	94.2	Very high	92.6	Very high	24 Å²	24	30.1 Å²	30.1	9%	0.094	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	146	172.6	-70.3	-98.1	0	0	0	110.7	F324 R325 S355 L357 C358	F324-Y350 HydrophobicContact CB-CE2 4.24Å; F324-Y350 WeakPolarHBondContact O-CD2 3.49Å; R325-Y350 HydrophobicContact CB-CD2 4.49Å; R325-Y350 HydrophobicContact CB-CE2 4.42Å; R325-Y350 HydrophobicContact CG-CD2 4.1Å; R325-Y350 HydrophobicContact CG-CE2 3.61Å; Y350-S355 WeakPolarHBondContact CD1-O 3.4Å; Y350-L357 WeakPolarHBondContact CA-O 3.45Å; Y350-C358 HydrophobicContact CD1-CB 3.98Å; Y350-C358 HydrophobicContact CE1-CB 3.75Å; Y350-C358 HydrophobicContact CE2-CB 4.4Å; Y350-C358 HydrophobicContact CG-CB 4.41Å
351	L	91.4	Very high	92.8	Very high	11 Å²	11	28 Å²	28	6%	0.058	18%	0.179	C	C	.	.	S	Bend	trans	-69.7	-32.4	-174.8	-64.5	-169.2	0	0	0	113.1	L289 L357 L359 F379 M380 L383 Y389	L289-L351 HydrophobicContact CD1-CD1 3.99Å; L289-L351 HydrophobicContact CD1-CG 4.37Å; L351-L357 HydrophobicContact CB-CB 4.28Å; L351-L357 HydrophobicContact CD1-CB 3.81Å; L351-L357 HydrophobicContact CD1-CD1 4.07Å; L351-L357 HydrophobicContact CG-CB 3.94Å; L351-L357 PolarHBondContact N-O 3.06Å; L351-L359 HydrophobicContact CD2-CB 3.8Å; L351-L359 HydrophobicContact CD2-CD2 4.36Å; L351-F379 HydrophobicContact CD1-CE1 4.16Å; L351-F379 HydrophobicContact CD2-CD1 4.37Å; L351-F379 HydrophobicContact CD2-CE1 4.09Å; L351-M380 HydrophobicContact CB-CE 4.16Å; L351-M380 HydrophobicContact CB-SD 3.86Å; L351-M380 HydrophobicContact CD1-SD 4.02Å; L351-M380 HydrophobicContact CD2-CG 4.43Å; L351-M380 HydrophobicContact CD2-SD 3.8Å; L351-M380 HydrophobicContact CG-SD 4.1Å; L351-M380 WeakPolarHBondContact O-CE 3.45Å; L351-L383 HydrophobicContact CD1-CD2 4.1Å; L351-Y389 HydrophobicContact CD1-CE2 4.06Å
352	E	86.3	Confident	93	Very high	76 Å²	76	25.6 Å²	25.6	36%	0.355	16%	0.16	S	C	.	.	S	Bend	trans	-145.9	153.4	174.3	-79.5	-178.7	-177.8	0	0	109.5	G354 S355 Y389 K393	E352-G354 PolarHBondContact O-N 3.48Å; E352-S355 WeakPolarHBondContact O-CB 3.41Å; E352-S355 PolarHBondContact O-N 2.88Å; E352-Y389 VanDerWaalsContact CG-OH 3.29Å; E352-Y389 WeakPolarHBondContact CG-OH 3.44Å; E352-Y389 VanDerWaalsContact OE1-CE1 3.27Å; E352-Y389 WeakPolarHBondContact OE1-CE1 3.39Å; E352-Y389 PolarHBondContact OE1-OH 2.9Å; E352-Y389 PolarHBondContact OE2-OH 2.63Å; E352-K393 VanDerWaalsContact CD-NZ 3.3Å; E352-K393 IonicContact OE1-NZ 2.8Å; E352-K393 PolarHBondContact OE1-NZ 2.83Å; E352-K393 WeakPolarHBondContact OE2-CE 3.42Å; E352-K393 IonicContact OE2-NZ 3.63Å; E352-K393 PolarHBondContact OE2-NZ 3.12Å
353	P	83.4	Confident	93.2	Very high	129 Å²	129	24.6 Å²	24.6	84%	0.838	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	131.3	171.9	-24	34.4	0	0	0	111.8	S355	P353-S355 PolarHBondContact O-N 2.69Å
354	G	81.3	Confident	93.3	Very high	83 Å²	83	26 Å²	26	86%	0.856	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.8	4.6	-177.2	0	0	0	0	0	115.4	E352	E352-G354 PolarHBondContact O-N 3.48Å
355	S	86.2	Confident	93.2	Very high	13 Å²	13	28.3 Å²	28.3	9%	0.091	18%	0.175	C	C	.	.			trans	-75.6	153.5	171.9	-163.9	0	0	0	0	111.8	Y350 E352 P353 L357	Y350-S355 WeakPolarHBondContact CD1-O 3.4Å; E352-S355 WeakPolarHBondContact O-CB 3.41Å; E352-S355 PolarHBondContact O-N 2.88Å; P353-S355 PolarHBondContact O-N 2.69Å; S355-L357 PolarHBondContact OG-N 2.87Å
356	E	89.6	Confident	93	Very high	83 Å²	83	32.3 Å²	32.3	39%	0.388	19%	0.189	S	C	.	.	S	Bend	trans	-90.5	-4.5	166.2	-61.5	-170.2	149.4	0	0	112.7	G292 C358 L396 Q399	G292-E356 PolarHBondContact N-O 3.08Å; E356-C358 PolarHBondContact O-N 2.87Å; E356-L396 HydrophobicContact CB-CD2 4.31Å; E356-Q399 PolarHBondContact OE2-NE2 3.05Å
357	L	93.8	Very high	92.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	108.7	179	-62.8	173.1	0	0	0	110.7	L290 A291 V296 Y350 L351 S355 Y389 M392 L396	L290-L357 VanDerWaalsContact O-CA 3.29Å; L290-L357 WeakPolarHBondContact O-CA 3.46Å; A291-L357 HydrophobicContact CB-CD2 3.98Å; V296-L357 HydrophobicContact CG2-CD2 4.29Å; Y350-L357 WeakPolarHBondContact CA-O 3.45Å; L351-L357 HydrophobicContact CB-CB 4.28Å; L351-L357 HydrophobicContact CD1-CB 3.81Å; L351-L357 HydrophobicContact CD1-CD1 4.07Å; L351-L357 HydrophobicContact CG-CB 3.94Å; L351-L357 PolarHBondContact N-O 3.06Å; S355-L357 PolarHBondContact OG-N 2.87Å; L357-Y389 HydrophobicContact CD1-CE2 3.89Å; L357-M392 HydrophobicContact CD1-CB 4.28Å; L357-M392 HydrophobicContact CD1-CE 4.35Å; L357-L396 HydrophobicContact CD1-CD1 4.31Å; L357-L396 HydrophobicContact CD2-CD1 4.27Å; L357-L396 HydrophobicContact CD2-CD2 4.27Å; L357-L396 HydrophobicContact CG-CD1 3.96Å
358	C	95.6	Very high	92.6	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.014	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.5	176.8	-167.8	0	0	0	0	110.5	L290 V318 Y350 E356	L290-C358 HydrophobicContact CB-CB 4.48Å; L290-C358 PolarHBondContact N-O 3.32Å; L290-C358 PolarHBondContact O-N 2.96Å; V318-C358 HydrophobicContact CG1-CB 4.15Å; Y350-C358 HydrophobicContact CD1-CB 3.98Å; Y350-C358 HydrophobicContact CE1-CB 3.75Å; Y350-C358 HydrophobicContact CE2-CB 4.4Å; Y350-C358 HydrophobicContact CG-CB 4.41Å; E356-C358 PolarHBondContact O-N 2.87Å
359	L	96.6	Very high	92.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	132	172.6	-179.8	66.8	0	0	0	109.6	L276 L289 S349 L351 L361 K376 F379	L276-L359 HydrophobicContact CD1-CD1 3.9Å; L289-L359 HydrophobicContact CD1-CB 4.36Å; L289-L359 HydrophobicContact CD1-CD1 4.43Å; S349-L359 PolarHBondContact N-O 3.15Å; S349-L359 PolarHBondContact O-N 2.72Å; L351-L359 HydrophobicContact CD2-CB 3.8Å; L351-L359 HydrophobicContact CD2-CD2 4.36Å; L359-L361 HydrophobicContact CD1-CD2 3.95Å; L359-L361 HydrophobicContact CD2-CD1 4.27Å; L359-L361 HydrophobicContact CD2-CD2 4.13Å; L359-L361 HydrophobicContact CD2-CG 4.2Å; L359-L361 HydrophobicContact CG-CD2 4Å; L359-L361 HydrophobicContact CG-CG 4.12Å; L359-K376 HydrophobicContact CD2-CB 3.99Å; L359-K376 HydrophobicContact CD2-CG 4.01Å; L359-F379 HydrophobicContact CD2-CD1 4.03Å
360	I	97.4	Very high	92.6	Very high	2 Å²	2	50 Å²	50	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	118.2	178.2	-49.2	175.9	0	0	0	107.8	S287 I288 L290 V314 V318 A346 H347 I348 V362	S287-I360 CarbonylContact C-O 3.49Å; S287-I360 WeakPolarHBondContact CA-O 3.42Å; I288-I360 HydrophobicContact CB-CB 4.16Å; I288-I360 HydrophobicContact CG1-CB 4.42Å; I288-I360 PolarHBondContact N-O 3.45Å; I288-I360 PolarHBondContact O-N 3.13Å; L290-I360 HydrophobicContact CD1-CD1 3.7Å; L290-I360 HydrophobicContact CG-CD1 4.23Å; V314-I360 HydrophobicContact CG1-CD1 3.35Å; V318-I360 HydrophobicContact CG2-CD1 3.68Å; V318-I360 HydrophobicContact CG2-CG1 4.33Å; A346-I360 HydrophobicContact CB-CG2 4.24Å; H347-I360 CarbonylContact O-C 3.6Å; H347-I360 VanDerWaalsContact O-CA 3.32Å; H347-I360 WeakPolarHBondContact O-CA 3.18Å; I348-I360 HydrophobicContact CG1-CG2 4.25Å; I360-V362 HydrophobicContact CG2-CG2 4.24Å
361	L	97.4	Very high	92.6	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	115.7	176.4	-52.6	175.5	0	0	0	108.6	L276 L284 S287 A346 H347 L359 M372 C375	L276-L361 HydrophobicContact CD1-CD2 4.5Å; L284-L361 HydrophobicContact CD1-CB 3.87Å; L284-L361 HydrophobicContact CD1-CD2 4.26Å; S287-L361 WeakPolarHBondContact OG-CD2 3.42Å; A346-L361 WeakPolarHBondContact CA-O 3Å; H347-L361 HydrophobicContact CB-CB 4.2Å; H347-L361 PolarHBondContact N-O 3.08Å; H347-L361 PolarHBondContact O-N 3.39Å; L359-L361 HydrophobicContact CD1-CD2 3.95Å; L359-L361 HydrophobicContact CD2-CD1 4.27Å; L359-L361 HydrophobicContact CD2-CD2 4.13Å; L359-L361 HydrophobicContact CD2-CG 4.2Å; L359-L361 HydrophobicContact CG-CD2 4Å; L359-L361 HydrophobicContact CG-CG 4.12Å; L361-M372 HydrophobicContact CB-CB 4.4Å; L361-M372 HydrophobicContact CB-CG 4.34Å; L361-M372 HydrophobicContact CB-SD 3.84Å; L361-M372 HydrophobicContact CD1-CB 4.05Å; L361-M372 VanDerWaalsContact CD1-O 3.24Å; L361-M372 WeakPolarHBondContact CD1-O 3.17Å; L361-M372 HydrophobicContact CD1-SD 4.41Å; L361-C375 HydrophobicContact CD1-CB 3.99Å
362	V	97.1	Very high	92.8	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	119.9	-177.2	-176.5	0	0	0	0	109.4	V285 F286 L335 F344 I360	V285-V362 WeakPolarHBondContact CB-O 3.32Å; V285-V362 PolarHBondContact N-O 2.84Å; F286-V362 HydrophobicContact CB-CB 4.16Å; F286-V362 HydrophobicContact CB-CG2 4.21Å; F286-V362 HydrophobicContact CD2-CB 4.22Å; F286-V362 HydrophobicContact CD2-CG1 4.33Å; F286-V362 HydrophobicContact CD2-CG2 4.47Å; F286-V362 PolarHBondContact O-N 3.45Å; L335-V362 HydrophobicContact CD1-CG1 4.28Å; F344-V362 HydrophobicContact CB-CG1 3.51Å; F344-V362 HydrophobicContact CD1-CG1 4.21Å; F344-V362 HydrophobicContact CG-CG1 3.92Å; I360-V362 HydrophobicContact CG2-CG2 4.24Å
363	S	96	Very high	93.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	154.9	177.5	-164.8	0	0	0	0	112.5	N283 F344 H345 D365 D368	N283-S363 WeakPolarHBondContact CB-OG 3.32Å; F344-S363 WeakPolarHBondContact CA-O 3.4Å; F344-S363 WeakPolarHBondContact CB-O 3.45Å; H345-S363 PolarHBondContact N-O 2.88Å; H345-S363 PolarHBondContact O-N 3.04Å; S363-D365 VanDerWaalsContact C-N 3.31Å; S363-D368 WeakPolarHBondContact CB-OD2 3.49Å; S363-D368 PolarHBondContact OG-OD2 2.83Å
364	T	94.6	Very high	93.8	Very high	80 Å²	80	47.4 Å²	47.4	49%	0.491	26%	0.255	S	S	.	.	S	Bend	trans	-83.1	-3.4	172.8	59.7	0	0	0	0	114	N283 V285 F344	N283-T364 PolarHBondContact O-N 2.81Å; V285-T364 HydrophobicContact CG2-CG2 3.39Å; F344-T364 HydrophobicContact CD1-CG2 4.28Å; F344-T364 HydrophobicContact CE1-CG2 4.19Å
365	D	93.9	Very high	94.5	Very high	65 Å²	65	43.6 Å²	43.6	35%	0.348	22%	0.215	S	C	.	.			trans	-124	132.3	-167.3	-173.7	-9.1	0	0	0	110.1	N283 S363 E367 D368	N283-D365 HydrophobicContact CB-CB 4Å; N283-D365 VanDerWaalsContact ND2-CB 3.32Å; N283-D365 WeakPolarHBondContact ND2-CB 3.44Å; N283-D365 PolarHBondContact ND2-OD2 2.92Å; S363-D365 VanDerWaalsContact C-N 3.31Å; D365-E367 VanDerWaalsContact C-N 3.31Å; D365-E367 PolarHBondContact O-N 2.69Å; D365-E367 PolarHBondContact OD1-N 2.98Å; D365-D368 HydrophobicContact CB-CB 4.09Å
366	R	91.9	Very high	94.9	Very high	105 Å²	105	44.3 Å²	44.3	40%	0.396	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-30.2	-172.8	-54.5	-152.6	173.9	176.9	-1.8	112.2	D80 E83 W330 H345	D80-R366 IonicContact OD1-NH1 3.81Å; D80-R366 IonicContact OD1-NH2 3.66Å; E83-R366 IonicContact OE2-NH1 3.45Å; E83-R366 PolarHBondContact OE2-NH1 3.4Å; W330-R366 VanDerWaalsContact CZ2-O 3.29Å; W330-R366 WeakPolarHBondContact CZ2-O 2.9Å; W330-R366 PolarHBondContact NE1-O 2.97Å; H345-R366 VanDerWaalsContact NE2-CG 3.32Å; H345-R366 WeakPolarHBondContact NE2-CG 3.41Å
367	E	93.5	Very high	95.1	Very high	156 Å²	156	45.7 Å²	45.7	73%	0.729	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.7	6.8	-174.2	-57.1	-50.8	122.7	0	0	113.6	D365 F369	D365-E367 VanDerWaalsContact C-N 3.31Å; D365-E367 PolarHBondContact O-N 2.69Å; D365-E367 PolarHBondContact OD1-N 2.98Å; E367-F369 PolarHBondContact O-N 3.35Å
368	D	93.6	Very high	95.1	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.016	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	5.1	-169.7	-149.1	33.9	0	0	0	114.3	N283 W330 S363 D365 F370 N371 M372	N283-D368 WeakPolarHBondContact CB-OD2 3.47Å; W330-D368 HydrophobicContact CH2-CB 4.14Å; W330-D368 HydrophobicContact CZ2-CB 4.36Å; S363-D368 WeakPolarHBondContact CB-OD2 3.49Å; S363-D368 PolarHBondContact OG-OD2 2.83Å; D365-D368 HydrophobicContact CB-CB 4.09Å; D368-F370 PolarHBondContact O-N 2.87Å; D368-N371 WeakPolarHBondContact O-CB 3.3Å; D368-N371 PolarHBondContact O-N 3.3Å; D368-N371 VanDerWaalsContact OD1-CB 3.3Å; D368-N371 WeakPolarHBondContact OD1-CB 3.45Å; D368-N371 PolarHBondContact OD1-ND2 3.36Å; D368-M372 WeakPolarHBondContact O-CG 2.92Å; D368-M372 PolarHBondContact O-N 2.92Å; D368-M372 WeakPolarHBondContact OD2-CE 3.08Å
369	F	95.2	Very high	95.1	Very high	54 Å²	54	50.4 Å²	50.4	24%	0.237	24%	0.24	C	C	.	.	H	α-helix	trans	-48.2	-52.8	-175.4	173.3	-103.2	0	0	0	113	E328 W330 H347 E367 N371 M372 S373	E328-F369 HydrophobicContact CB-CE2 4.28Å; E328-F369 HydrophobicContact CB-CZ 4.4Å; W330-F369 HydrophobicContact CB-CD2 3.68Å; W330-F369 HydrophobicContact CB-CE2 4.15Å; W330-F369 HydrophobicContact CD2-CB 3.99Å; W330-F369 AromaticContact CD2-CD2 3.97Å; W330-F369 HydrophobicContact CD2-CD2 3.97Å; W330-F369 HydrophobicContact CD2-CG 4.48Å; W330-F369 HydrophobicContact CE3-CB 4.45Å; W330-F369 HydrophobicContact CE3-CD2 4.12Å; W330-F369 HydrophobicContact CG-CB 4.21Å; W330-F369 AromaticContact CG-CD2 3.83Å; W330-F369 HydrophobicContact CG-CD2 3.83Å; W330-F369 HydrophobicContact CG-CG 4.4Å; W330-F369 HydrophobicContact CZ2-CB 4.36Å; H347-F369 AromaticContact CD2-CD2 3.85Å; H347-F369 AromaticContact CD2-CE2 3.73Å; E367-F369 PolarHBondContact O-N 3.35Å; F369-N371 VanDerWaalsContact C-N 3.33Å; F369-N371 PolarHBondContact O-N 2.92Å; F369-M372 PolarHBondContact O-N 2.91Å; F369-M372 VanDerWaalsContact O-N 3.14Å; F369-S373 PolarHBondContact O-N 3.41Å
370	F	95.2	Very high	94.9	Very high	160 Å²	160	52.3 Å²	52.3	70%	0.702	25%	0.249	S	C	*	.	H	α-helix	trans	-63.9	-38.1	-178.4	-64.2	-73	0	0	0	112.1	D368 M372 S373 D374	D368-F370 PolarHBondContact O-N 2.87Å; F370-M372 VanDerWaalsContact C-N 3.33Å; F370-M372 PolarHBondContact O-N 2.92Å; F370-S373 PolarHBondContact O-N 3.39Å; F370-D374 WeakPolarHBondContact O-CB 3.37Å; F370-D374 PolarHBondContact O-N 3.04Å
371	N	95.1	Very high	94.7	Very high	83 Å²	83	56.1 Å²	56.1	44%	0.444	27%	0.267	S	S	.	.	H	α-helix	trans	-66.5	-35.3	175.5	-69.1	-44.9	0	0	0	111.7	D368 F369 D374 C375	D368-N371 WeakPolarHBondContact O-CB 3.3Å; D368-N371 PolarHBondContact O-N 3.3Å; D368-N371 VanDerWaalsContact OD1-CB 3.3Å; D368-N371 WeakPolarHBondContact OD1-CB 3.45Å; D368-N371 PolarHBondContact OD1-ND2 3.36Å; F369-N371 VanDerWaalsContact C-N 3.33Å; F369-N371 PolarHBondContact O-N 2.92Å; N371-D374 WeakPolarHBondContact O-CB 3.25Å; N371-C375 PolarHBondContact O-N 3.31Å; N371-C375 PolarHBondContact O-SG 3.46Å
372	M	95.7	Very high	94.4	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-69.9	-42.9	175.8	-63.4	-51.9	89.3	0	0	111.6	A281 L284 W330 H347 L361 D368 F369 F370 D374 C375 K376	A281-M372 HydrophobicContact CB-CE 3.48Å; A281-M372 VanDerWaalsContact CB-CE 3.48Å; L284-M372 HydrophobicContact CB-CE 4.4Å; L284-M372 HydrophobicContact CB-SD 4.45Å; L284-M372 HydrophobicContact CD1-SD 3.87Å; W330-M372 HydrophobicContact CH2-CG 4.09Å; W330-M372 HydrophobicContact CZ3-CB 4.46Å; W330-M372 HydrophobicContact CZ3-CG 3.86Å; H347-M372 HydrophobicContact CB-CB 3.54Å; H347-M372 HydrophobicContact CB-CG 4.02Å; L361-M372 HydrophobicContact CB-CB 4.4Å; L361-M372 HydrophobicContact CB-CG 4.34Å; L361-M372 HydrophobicContact CB-SD 3.84Å; L361-M372 HydrophobicContact CD1-CB 4.05Å; L361-M372 VanDerWaalsContact CD1-O 3.24Å; L361-M372 WeakPolarHBondContact CD1-O 3.17Å; L361-M372 HydrophobicContact CD1-SD 4.41Å; D368-M372 WeakPolarHBondContact O-CG 2.92Å; D368-M372 PolarHBondContact O-N 2.92Å; D368-M372 WeakPolarHBondContact OD2-CE 3.08Å; F369-M372 PolarHBondContact O-N 2.91Å; F369-M372 VanDerWaalsContact O-N 3.14Å; F370-M372 VanDerWaalsContact C-N 3.33Å; F370-M372 PolarHBondContact O-N 2.92Å; M372-D374 VanDerWaalsContact C-N 3.34Å; M372-D374 PolarHBondContact O-N 3.08Å; M372-C375 WeakPolarHBondContact O-CA 3.39Å; M372-C375 WeakPolarHBondContact O-CB 3.29Å; M372-C375 PolarHBondContact O-N 3.11Å; M372-K376 PolarHBondContact O-N 3.22Å
373	S	94.9	Very high	94	Very high	34 Å²	34	60.1 Å²	60.1	24%	0.238	28%	0.282	C	S	.	.	H	α-helix	trans	-59.5	-44.2	173.8	-164.2	0	0	0	0	111.4	E328 F369 F370 C375 K376 Q377	E328-S373 VanDerWaalsContact OE2-CB 3.31Å; E328-S373 WeakPolarHBondContact OE2-CB 3.33Å; E328-S373 PolarHBondContact OE2-OG 2.84Å; F369-S373 PolarHBondContact O-N 3.41Å; F370-S373 PolarHBondContact O-N 3.39Å; S373-C375 VanDerWaalsContact C-N 3.31Å; S373-C375 PolarHBondContact O-N 3.36Å; S373-K376 WeakPolarHBondContact O-CB 3.27Å; S373-K376 PolarHBondContact O-N 3.19Å; S373-Q377 PolarHBondContact O-N 3.27Å
374	D	95.3	Very high	93.4	Very high	70 Å²	70	64.1 Å²	64.1	37%	0.374	31%	0.31	S	S	.	.	H	α-helix	trans	-57.2	-41.2	171.1	-112.9	48.3	0	0	0	112.5	F370 N371 M372 Q377 R378	F370-D374 WeakPolarHBondContact O-CB 3.37Å; F370-D374 PolarHBondContact O-N 3.04Å; N371-D374 WeakPolarHBondContact O-CB 3.25Å; M372-D374 VanDerWaalsContact C-N 3.34Å; M372-D374 PolarHBondContact O-N 3.08Å; D374-Q377 PolarHBondContact O-N 3.43Å; D374-R378 WeakPolarHBondContact O-CB 3.47Å; D374-R378 WeakPolarHBondContact O-CD 3.44Å; D374-R378 WeakPolarHBondContact O-CG 3.47Å; D374-R378 PolarHBondContact O-N 2.92Å; D374-R378 IonicContact OD2-CZ 3.56Å; D374-R378 IonicContact OD2-NE 3.41Å; D374-R378 IonicContact OD2-NH2 2.95Å; D374-R378 PolarHBondContact OD2-NH2 3.32Å
375	C	95.3	Very high	92.7	Very high	2 Å²	2	68 Å²	68	1%	0.014	32%	0.32	C	S	.	.	H	α-helix	trans	-65.6	-42.5	177.4	-70.7	0	0	0	0	111.8	A279 L361 N371 M372 S373 R378 F379	A279-C375 WeakPolarHBondContact O-CB 3.48Å; A279-C375 PolarHBondContact O-SG 3.46Å; L361-C375 HydrophobicContact CD1-CB 3.99Å; N371-C375 PolarHBondContact O-N 3.31Å; N371-C375 PolarHBondContact O-SG 3.46Å; M372-C375 WeakPolarHBondContact O-CA 3.39Å; M372-C375 WeakPolarHBondContact O-CB 3.29Å; M372-C375 PolarHBondContact O-N 3.11Å; S373-C375 VanDerWaalsContact C-N 3.31Å; S373-C375 PolarHBondContact O-N 3.36Å; C375-R378 PolarHBondContact O-N 2.95Å; C375-F379 WeakPolarHBondContact O-CB 3.3Å; C375-F379 PolarHBondContact O-N 2.83Å
376	K	94.7	Very high	91.9	Very high	28 Å²	28	70.4 Å²	70.4	12%	0.122	32%	0.324	C	S	.	.	H	α-helix	trans	-57.9	-47.9	171.5	175.3	-162.3	-178.8	171.1	0	111.3	E328 S349 L359 M372 S373 R378 F379 M380	E328-K376 WeakPolarHBondContact OE1-CD 3.42Å; E328-K376 WeakPolarHBondContact OE1-CE 3.4Å; E328-K376 IonicContact OE1-NZ 3.01Å; E328-K376 PolarHBondContact OE1-NZ 2.95Å; S349-K376 VanDerWaalsContact CB-NZ 3.27Å; S349-K376 VanDerWaalsContact OG-CD 3.32Å; S349-K376 WeakPolarHBondContact OG-CD 3.45Å; S349-K376 VanDerWaalsContact OG-CE 3.27Å; S349-K376 WeakPolarHBondContact OG-CE 3.34Å; S349-K376 PolarHBondContact OG-NZ 3.41Å; L359-K376 HydrophobicContact CD2-CB 3.99Å; L359-K376 HydrophobicContact CD2-CG 4.01Å; M372-K376 PolarHBondContact O-N 3.22Å; S373-K376 WeakPolarHBondContact O-CB 3.27Å; S373-K376 PolarHBondContact O-N 3.19Å; K376-R378 PolarHBondContact O-N 2.9Å; K376-F379 WeakPolarHBondContact O-CB 3.31Å; K376-F379 PolarHBondContact O-N 3.19Å; K376-M380 PolarHBondContact O-N 3.02Å
377	Q	94.4	Very high	91.5	Very high	112 Å²	112	70.4 Å²	70.4	52%	0.523	34%	0.34	S	S	.	.	H	α-helix	trans	-59.8	-49.7	179.2	-176.8	179.5	-25.7	0	0	111	S373 D374 F379 M380 E381	S373-Q377 PolarHBondContact O-N 3.27Å; D374-Q377 PolarHBondContact O-N 3.43Å; Q377-F379 VanDerWaalsContact C-N 3.25Å; Q377-F379 PolarHBondContact O-N 3.49Å; Q377-M380 PolarHBondContact O-N 3.4Å; Q377-M380 VanDerWaalsContact O-N 3.17Å; Q377-E381 HydrophobicContact CG-CG 4.43Å; Q377-E381 PolarHBondContact NE2-OE1 3.43Å; Q377-E381 WeakPolarHBondContact O-CG 3.45Å; Q377-E381 PolarHBondContact O-N 2.88Å
378	R	94.8	Very high	91.2	Very high	102 Å²	102	63.1 Å²	63.1	39%	0.385	31%	0.307	S	S	.	.	H	α-helix	trans	-62.2	-31	177.7	-64.2	165.3	-160.9	176.9	3.9	112.7	A279 D374 C375 K376 R382	A279-R378 HydrophobicContact CB-CB 4.49Å; D374-R378 WeakPolarHBondContact O-CB 3.47Å; D374-R378 WeakPolarHBondContact O-CD 3.44Å; D374-R378 WeakPolarHBondContact O-CG 3.47Å; D374-R378 PolarHBondContact O-N 2.92Å; D374-R378 IonicContact OD2-CZ 3.56Å; D374-R378 IonicContact OD2-NE 3.41Å; D374-R378 IonicContact OD2-NH2 2.95Å; D374-R378 PolarHBondContact OD2-NH2 3.32Å; C375-R378 PolarHBondContact O-N 2.95Å; K376-R378 PolarHBondContact O-N 2.9Å; R378-R382 VanDerWaalsContact O-CG 3.29Å; R378-R382 WeakPolarHBondContact O-CG 3.14Å; R378-R382 PolarHBondContact O-N 3.25Å
379	F	94.9	Very high	91	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-68.2	-51.7	172	170.9	-112.3	0	0	0	110.8	V272 L276 A279 L289 L351 L359 C375 K376 Q377 E381 R382 L383	V272-F379 HydrophobicContact CG1-CE2 4.4Å; V272-F379 HydrophobicContact CG1-CZ 4.24Å; L276-F379 HydrophobicContact CB-CD2 3.95Å; L276-F379 HydrophobicContact CB-CE2 3.86Å; L276-F379 HydrophobicContact CD1-CD1 4.49Å; L276-F379 HydrophobicContact CD1-CD2 3.77Å; L276-F379 HydrophobicContact CD1-CE2 4.05Å; L276-F379 HydrophobicContact CD1-CG 4.01Å; L276-F379 HydrophobicContact CG-CD2 4.47Å; L276-F379 HydrophobicContact CG-CE2 4.45Å; A279-F379 HydrophobicContact CB-CB 3.98Å; L289-F379 HydrophobicContact CD2-CZ 4.15Å; L351-F379 HydrophobicContact CD1-CE1 4.16Å; L351-F379 HydrophobicContact CD2-CD1 4.37Å; L351-F379 HydrophobicContact CD2-CE1 4.09Å; L359-F379 HydrophobicContact CD2-CD1 4.03Å; C375-F379 WeakPolarHBondContact O-CB 3.3Å; C375-F379 PolarHBondContact O-N 2.83Å; K376-F379 WeakPolarHBondContact O-CB 3.31Å; K376-F379 PolarHBondContact O-N 3.19Å; Q377-F379 VanDerWaalsContact C-N 3.25Å; Q377-F379 PolarHBondContact O-N 3.49Å; F379-E381 PolarHBondContact O-N 2.91Å; F379-R382 PolarHBondContact O-N 3.35Å; F379-R382 VanDerWaalsContact O-N 3.11Å; F379-L383 HydrophobicContact CE1-CD2 3.76Å; F379-L383 HydrophobicContact CE2-CD1 4.46Å; F379-L383 HydrophobicContact CE2-CD2 4.46Å; F379-L383 HydrophobicContact CZ-CD1 4.32Å; F379-L383 HydrophobicContact CZ-CD2 3.73Å; F379-L383 HydrophobicContact CZ-CG 4.48Å; F379-L383 VanDerWaalsContact O-CB 3.28Å; F379-L383 WeakPolarHBondContact O-CB 3.34Å; F379-L383 PolarHBondContact O-N 2.83Å
380	M	93.1	Very high	90.7	Very high	39 Å²	39	66 Å²	66	19%	0.192	32%	0.32	C	S	.	.	H	α-helix	trans	-59.9	-41.6	178.8	-76.3	-63.4	-74	0	0	112.8	L351 K376 Q377 R382 L383 S384	L351-M380 HydrophobicContact CB-CE 4.16Å; L351-M380 HydrophobicContact CB-SD 3.86Å; L351-M380 HydrophobicContact CD1-SD 4.02Å; L351-M380 HydrophobicContact CD2-CG 4.43Å; L351-M380 HydrophobicContact CD2-SD 3.8Å; L351-M380 HydrophobicContact CG-SD 4.1Å; L351-M380 WeakPolarHBondContact O-CE 3.45Å; K376-M380 PolarHBondContact O-N 3.02Å; Q377-M380 PolarHBondContact O-N 3.4Å; Q377-M380 VanDerWaalsContact O-N 3.17Å; M380-R382 VanDerWaalsContact C-N 3.28Å; M380-R382 PolarHBondContact O-N 2.93Å; M380-L383 PolarHBondContact O-N 2.85Å; M380-L383 HydrophobicContact SD-CD2 4.17Å; M380-S384 WeakPolarHBondContact O-CB 3.17Å; M380-S384 PolarHBondContact O-N 3.28Å; M380-S384 PolarHBondContact O-OG 3.47Å; M380-S384 VanDerWaalsContact O-OG 3.04Å
381	E	91.9	Very high	90.5	Very high	82 Å²	82	59.7 Å²	59.7	38%	0.383	30%	0.297	S	S	.	.	H	α-helix	trans	-63.4	-30.2	175.5	-75.9	-177.7	-157	0	0	113.8	Q377 F379 S384 K385	Q377-E381 HydrophobicContact CG-CG 4.43Å; Q377-E381 PolarHBondContact NE2-OE1 3.43Å; Q377-E381 WeakPolarHBondContact O-CG 3.45Å; Q377-E381 PolarHBondContact O-N 2.88Å; F379-E381 PolarHBondContact O-N 2.91Å; E381-S384 PolarHBondContact O-OG 3.34Å; E381-K385 WeakPolarHBondContact O-CD 3.45Å; E381-K385 VanDerWaalsContact O-CE 3.32Å; E381-K385 WeakPolarHBondContact O-CE 3.49Å; E381-K385 WeakPolarHBondContact O-CG 3.44Å
382	R	91	Very high	90.4	Very high	88 Å²	88	55.8 Å²	55.8	33%	0.332	28%	0.276	S	S	.	.	H	α-helix	trans	-82.5	-32.7	174.9	-71.6	175.6	-177.4	129.9	-12	111.8	A278 R378 F379 M380 R386	A278-R382 VanDerWaalsContact O-CZ 3.23Å; A278-R382 PolarHBondContact O-NH1 3.45Å; A278-R382 PolarHBondContact O-NH2 2.88Å; R378-R382 VanDerWaalsContact O-CG 3.29Å; R378-R382 WeakPolarHBondContact O-CG 3.14Å; R378-R382 PolarHBondContact O-N 3.25Å; F379-R382 PolarHBondContact O-N 3.35Å; F379-R382 VanDerWaalsContact O-N 3.11Å; M380-R382 VanDerWaalsContact C-N 3.28Å; M380-R382 PolarHBondContact O-N 2.93Å; R382-R386 WeakPolarHBondContact O-CG 3.33Å
383	L	89.2	Confident	90.1	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-73.6	-39.7	-179	-166.9	66.2	0	0	0	111.5	V272 L351 F379 M380 R386 A388 Y389 M392	V272-L383 HydrophobicContact CG2-CD1 4.01Å; L351-L383 HydrophobicContact CD1-CD2 4.1Å; F379-L383 HydrophobicContact CE1-CD2 3.76Å; F379-L383 HydrophobicContact CE2-CD1 4.46Å; F379-L383 HydrophobicContact CE2-CD2 4.46Å; F379-L383 HydrophobicContact CZ-CD1 4.32Å; F379-L383 HydrophobicContact CZ-CD2 3.73Å; F379-L383 HydrophobicContact CZ-CG 4.48Å; F379-L383 VanDerWaalsContact O-CB 3.28Å; F379-L383 WeakPolarHBondContact O-CB 3.34Å; F379-L383 PolarHBondContact O-N 2.83Å; M380-L383 PolarHBondContact O-N 2.85Å; M380-L383 HydrophobicContact SD-CD2 4.17Å; L383-R386 PolarHBondContact O-N 2.99Å; L383-A388 HydrophobicContact CD1-CB 4.35Å; L383-Y389 HydrophobicContact CD2-CD2 3.55Å; L383-Y389 HydrophobicContact CD2-CE2 4.19Å; L383-Y389 HydrophobicContact CD2-CG 4.34Å; L383-Y389 HydrophobicContact CG-CD2 3.99Å; L383-Y389 HydrophobicContact CG-CG 4.34Å; L383-M392 HydrophobicContact CD1-CE 3.85Å; L383-M392 HydrophobicContact CD2-CE 3.82Å; L383-M392 HydrophobicContact CG-CE 4.26Å
384	S	84.1	Confident	89.9	Confident	83 Å²	83	62 Å²	62	58%	0.58	30%	0.301	S	S	*	.	H	α-helix	trans	-70.8	-31	176.7	62.3	0	0	0	0	113.7	M380 E381 R386	M380-S384 WeakPolarHBondContact O-CB 3.17Å; M380-S384 PolarHBondContact O-N 3.28Å; M380-S384 PolarHBondContact O-OG 3.47Å; M380-S384 VanDerWaalsContact O-OG 3.04Å; E381-S384 PolarHBondContact O-OG 3.34Å; S384-R386 PolarHBondContact O-N 2.81Å
385	K	79.6	Confident	89.6	Confident	161 Å²	161	59.3 Å²	59.3	70%	0.7	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-6	172.5	-71.8	169.7	-166.9	159.4	0	113.6	E381	E381-K385 WeakPolarHBondContact O-CD 3.45Å; E381-K385 VanDerWaalsContact O-CE 3.32Å; E381-K385 WeakPolarHBondContact O-CE 3.49Å; E381-K385 WeakPolarHBondContact O-CG 3.44Å
386	R	76.3	Confident	89.4	Confident	117 Å²	117	60.5 Å²	60.5	44%	0.442	30%	0.295	S	S	.	.	S	Bend	trans	-126.2	147	-176.9	-62.9	-179.5	176.1	-176.5	-11.5	109.5	V271 S275 R382 L383 S384 A388	V271-R386 HydrophobicContact CG1-CB 4.16Å; V271-R386 VanDerWaalsContact CG1-CD 3.42Å; V271-R386 HydrophobicContact CG1-CG 4.41Å; V271-R386 PolarHBondContact O-NH1 3.3Å; S275-R386 PolarHBondContact OG-NH1 3.41Å; R382-R386 WeakPolarHBondContact O-CG 3.33Å; L383-R386 PolarHBondContact O-N 2.99Å; S384-R386 PolarHBondContact O-N 2.81Å; R386-A388 PolarHBondContact O-N 2.82Å
387	S	83.9	Confident	89	Confident	104 Å²	104	67.2 Å²	67.2	73%	0.727	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-7.2	177.4	51.1	0	0	0	0	114.3	Y389 Q390 A391	S387-Y389 VanDerWaalsContact C-N 3.28Å; S387-Y389 PolarHBondContact O-N 2.67Å; S387-Q390 PolarHBondContact O-N 2.96Å; S387-A391 PolarHBondContact O-N 2.94Å
388	A	87.3	Confident	88.4	Confident	4 Å²	4	65.9 Å²	65.9	3%	0.033	33%	0.326	C	S	.	.	H	α-helix	trans	-59.9	-31.8	-179.8	0	0	0	0	0	113.9	V268 V271 V272 L383 R386 A391 M392	V268-A388 HydrophobicContact CG1-CB 4.1Å; V271-A388 HydrophobicContact CB-CB 4.21Å; V271-A388 HydrophobicContact CG1-CB 3.47Å; V271-A388 VanDerWaalsContact CG1-CB 3.47Å; V272-A388 HydrophobicContact CG2-CB 4.16Å; L383-A388 HydrophobicContact CD1-CB 4.35Å; R386-A388 PolarHBondContact O-N 2.82Å; A388-A391 PolarHBondContact O-N 2.67Å; A388-M392 WeakPolarHBondContact O-CG 3.34Å; A388-M392 PolarHBondContact O-N 3.45Å
389	Y	89.5	Confident	87.5	Confident	22 Å²	22	63.3 Å²	63.3	9%	0.086	32%	0.319	C	S	.	.	H	α-helix	trans	-63.7	-45.4	176	-166.8	-127.4	0	0	0	112.2	L351 E352 L357 L383 S387 M392 K393	L351-Y389 HydrophobicContact CD1-CE2 4.06Å; E352-Y389 VanDerWaalsContact CG-OH 3.29Å; E352-Y389 WeakPolarHBondContact CG-OH 3.44Å; E352-Y389 VanDerWaalsContact OE1-CE1 3.27Å; E352-Y389 WeakPolarHBondContact OE1-CE1 3.39Å; E352-Y389 PolarHBondContact OE1-OH 2.9Å; E352-Y389 PolarHBondContact OE2-OH 2.63Å; L357-Y389 HydrophobicContact CD1-CE2 3.89Å; L383-Y389 HydrophobicContact CD2-CD2 3.55Å; L383-Y389 HydrophobicContact CD2-CE2 4.19Å; L383-Y389 HydrophobicContact CD2-CG 4.34Å; L383-Y389 HydrophobicContact CG-CD2 3.99Å; L383-Y389 HydrophobicContact CG-CG 4.34Å; S387-Y389 VanDerWaalsContact C-N 3.28Å; S387-Y389 PolarHBondContact O-N 2.67Å; Y389-M392 HydrophobicContact CD2-CE 4.08Å; Y389-M392 PolarHBondContact O-N 2.83Å; Y389-K393 HydrophobicContact CD1-CD 4.37Å; Y389-K393 HydrophobicContact CE1-CD 3.98Å; Y389-K393 VanDerWaalsContact CE1-NZ 3.33Å; Y389-K393 VanDerWaalsContact CZ-CE 3.48Å; Y389-K393 PolarHBondContact O-N 3Å; Y389-K393 VanDerWaalsContact OH-CE 3.32Å; Y389-K393 WeakPolarHBondContact OH-CE 3.38Å
390	Q	89.5	Confident	87.1	Confident	96 Å²	96	64.8 Å²	64.8	45%	0.449	33%	0.329	S	S	.	.	H	α-helix	trans	-66	-41.1	178.3	-178.7	57.4	28.2	0	0	111.2	S387 M392 K393 E394	S387-Q390 PolarHBondContact O-N 2.96Å; Q390-M392 VanDerWaalsContact C-N 3.31Å; Q390-M392 PolarHBondContact O-N 2.83Å; Q390-K393 PolarHBondContact O-N 2.85Å; Q390-K393 VanDerWaalsContact O-N 3.16Å; Q390-E394 WeakPolarHBondContact CG-OE1 3.37Å; Q390-E394 PolarHBondContact NE2-OE1 3.35Å; Q390-E394 WeakPolarHBondContact O-CG 3.49Å; Q390-E394 PolarHBondContact O-N 2.9Å
391	A	90.8	Very high	86.9	Confident	27 Å²	27	63.1 Å²	63.1	22%	0.223	32%	0.32	C	S	.	.	H	α-helix	trans	-61.6	-36.2	174.6	0	0	0	0	0	112.9	V268 S387 A388 E394 A395	V268-A391 HydrophobicContact CG1-CB 3.91Å; V268-A391 HydrophobicContact CG2-CB 3.86Å; S387-A391 PolarHBondContact O-N 2.94Å; A388-A391 PolarHBondContact O-N 2.67Å; A391-E394 PolarHBondContact O-N 2.84Å; A391-A395 PolarHBondContact O-N 2.65Å
392	M	91.7	Very high	86.9	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-67.9	-44.4	171.3	-71.3	-170.3	-61	0	0	112	L264 V268 V272 L289 V296 L357 L383 A388 Y389 Q390 E394 A395 L396	L264-M392 HydrophobicContact CD1-CG 4.26Å; L264-M392 HydrophobicContact CD2-CG 4.31Å; V268-M392 HydrophobicContact CG1-CG 4.36Å; V272-M392 HydrophobicContact CG1-SD 4.21Å; V272-M392 HydrophobicContact CG2-CE 3.83Å; V272-M392 HydrophobicContact CG2-CG 4.39Å; V272-M392 HydrophobicContact CG2-SD 3.61Å; L289-M392 HydrophobicContact CD2-CE 4.42Å; L289-M392 HydrophobicContact CD2-SD 4.06Å; V296-M392 HydrophobicContact CG1-SD 3.73Å; L357-M392 HydrophobicContact CD1-CB 4.28Å; L357-M392 HydrophobicContact CD1-CE 4.35Å; L383-M392 HydrophobicContact CD1-CE 3.85Å; L383-M392 HydrophobicContact CD2-CE 3.82Å; L383-M392 HydrophobicContact CG-CE 4.26Å; A388-M392 WeakPolarHBondContact O-CG 3.34Å; A388-M392 PolarHBondContact O-N 3.45Å; Y389-M392 HydrophobicContact CD2-CE 4.08Å; Y389-M392 PolarHBondContact O-N 2.83Å; Q390-M392 VanDerWaalsContact C-N 3.31Å; Q390-M392 PolarHBondContact O-N 2.83Å; M392-E394 PolarHBondContact O-N 2.74Å; M392-A395 PolarHBondContact O-N 3.35Å; M392-A395 VanDerWaalsContact O-N 3.12Å; M392-L396 WeakPolarHBondContact O-CG 3.44Å; M392-L396 PolarHBondContact O-N 3.46Å
393	K	90.1	Very high	87	Confident	61 Å²	61	57.8 Å²	57.8	27%	0.265	31%	0.305	S	S	.	.	H	α-helix	trans	-59	-30.5	174	-79.2	-176.7	166.5	175.9	0	113.2	E352 Y389 Q390	E352-K393 VanDerWaalsContact CD-NZ 3.3Å; E352-K393 IonicContact OE1-NZ 2.8Å; E352-K393 PolarHBondContact OE1-NZ 2.83Å; E352-K393 WeakPolarHBondContact OE2-CE 3.42Å; E352-K393 IonicContact OE2-NZ 3.63Å; E352-K393 PolarHBondContact OE2-NZ 3.12Å; Y389-K393 HydrophobicContact CD1-CD 4.37Å; Y389-K393 HydrophobicContact CE1-CD 3.98Å; Y389-K393 VanDerWaalsContact CE1-NZ 3.33Å; Y389-K393 VanDerWaalsContact CZ-CE 3.48Å; Y389-K393 PolarHBondContact O-N 3Å; Y389-K393 VanDerWaalsContact OH-CE 3.32Å; Y389-K393 WeakPolarHBondContact OH-CE 3.38Å; Q390-K393 PolarHBondContact O-N 2.85Å; Q390-K393 VanDerWaalsContact O-N 3.16Å
394	E	90.5	Very high	87	Confident	103 Å²	103	63.6 Å²	63.6	48%	0.481	34%	0.34	S	S	.	.	H	α-helix	trans	-75.6	-41.6	173.6	-75.2	164	-166.4	0	0	112	Q390 A391 M392 L396 K397	Q390-E394 WeakPolarHBondContact CG-OE1 3.37Å; Q390-E394 PolarHBondContact NE2-OE1 3.35Å; Q390-E394 WeakPolarHBondContact O-CG 3.49Å; Q390-E394 PolarHBondContact O-N 2.9Å; A391-E394 PolarHBondContact O-N 2.84Å; M392-E394 PolarHBondContact O-N 2.74Å; E394-L396 VanDerWaalsContact C-N 3.28Å; E394-L396 PolarHBondContact O-N 2.75Å; E394-K397 WeakPolarHBondContact O-CB 3.27Å; E394-K397 PolarHBondContact O-N 3.39Å
395	A	90.3	Very high	87.2	Confident	15 Å²	15	64.7 Å²	64.7	12%	0.124	34%	0.336	C	S	.	.	H	α-helix	trans	-62.7	-31.8	173.9	0	0	0	0	0	113.2	L262 L264 A391 M392 K397 C398 Q399	L262-A395 HydrophobicContact CD2-CB 4.13Å; L262-A395 HydrophobicContact CG-CB 4.46Å; L264-A395 HydrophobicContact CD2-CB 3.42Å; L264-A395 VanDerWaalsContact CD2-CB 3.42Å; L264-A395 HydrophobicContact CG-CB 4.35Å; A391-A395 PolarHBondContact O-N 2.65Å; M392-A395 PolarHBondContact O-N 3.35Å; M392-A395 VanDerWaalsContact O-N 3.12Å; A395-K397 PolarHBondContact O-N 3.14Å; A395-C398 CarbonylContact O-C 3.43Å; A395-C398 PolarHBondContact O-N 2.98Å; A395-Q399 PolarHBondContact O-N 3.4Å
396	L	90.1	Very high	87.8	Confident	27 Å²	27	57.7 Å²	57.7	14%	0.141	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-21.2	172.6	-69.6	175.1	0	0	0	113.9	L262 A291 E356 L357 M392 E394 Q399	L262-L396 HydrophobicContact CD2-CD2 4.44Å; A291-L396 HydrophobicContact CB-CD2 3.67Å; E356-L396 HydrophobicContact CB-CD2 4.31Å; L357-L396 HydrophobicContact CD1-CD1 4.31Å; L357-L396 HydrophobicContact CD2-CD1 4.27Å; L357-L396 HydrophobicContact CD2-CD2 4.27Å; L357-L396 HydrophobicContact CG-CD1 3.96Å; M392-L396 WeakPolarHBondContact O-CG 3.44Å; M392-L396 PolarHBondContact O-N 3.46Å; E394-L396 VanDerWaalsContact C-N 3.28Å; E394-L396 PolarHBondContact O-N 2.75Å; L396-Q399 WeakPolarHBondContact O-CG 3.4Å; L396-Q399 PolarHBondContact O-NE2 3.28Å
397	K	87.4	Confident	88.4	Confident	168 Å²	168	54.5 Å²	54.5	73%	0.73	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-21	175.1	-59.3	176.8	-177.8	177	0	112.7	E394 A395	E394-K397 WeakPolarHBondContact O-CB 3.27Å; E394-K397 PolarHBondContact O-N 3.39Å; A395-K397 PolarHBondContact O-N 3.14Å
398	C	79.9	Confident	88.8	Confident	85 Å²	85	50.3 Å²	50.3	57%	0.574	28%	0.28	S	S	*	.	S	Bend	trans	-133.9	60.6	-176.6	-64.2	0	0	0	0	109.4	A395 S400	A395-C398 CarbonylContact O-C 3.43Å; A395-C398 PolarHBondContact O-N 2.98Å; C398-S400 PolarHBondContact O-N 3.48Å
399	Q	77.3	Confident	88.9	Confident	48 Å²	48	56 Å²	56	22%	0.224	32%	0.316	C	S	.	.			trans	-69.8	-18.5	-172	-48.7	-167.6	9.6	0	0	113.6	L262 P263 R294 E356 A395 L396	L262-Q399 HydrophobicContact CD1-CB 4.19Å; L262-Q399 HydrophobicContact CD1-CG 4.41Å; P263-Q399 VanDerWaalsContact CD-O 3.27Å; P263-Q399 WeakPolarHBondContact CD-O 3.47Å; R294-Q399 PolarHBondContact NH1-O 3.16Å; E356-Q399 PolarHBondContact OE2-NE2 3.05Å; A395-Q399 PolarHBondContact O-N 3.4Å; L396-Q399 WeakPolarHBondContact O-CG 3.4Å; L396-Q399 PolarHBondContact O-NE2 3.28Å
400	S	85.2	Confident	89	Confident	31 Å²	31	57.8 Å²	57.8	22%	0.217	33%	0.325	C	S	.	.	S	Bend	trans	-117.2	174.4	-175.4	56.5	0	0	0	0	111.6	C398 E428	C398-S400 PolarHBondContact O-N 3.48Å; S400-E428 PolarHBondContact OG-OE2 2.81Å
401	Y	90.6	Very high	89.2	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.016	31%	0.306	C	S	.	.			trans	-130.1	148.2	163.5	57.2	-92.8	0	0	0	109.1	F414 T425 S426 P427 E428 W505 L513	Y401-F414 AromaticContact CE2-CE1 3.96Å; Y401-F414 HydrophobicContact CE2-CE1 3.96Å; Y401-F414 AromaticContact CE2-CZ 3.66Å; Y401-F414 HydrophobicContact CE2-CZ 3.66Å; Y401-F414 AromaticContact CZ-CZ 3.9Å; Y401-F414 VanDerWaalsContact OH-CZ 3.23Å; Y401-F414 WeakPolarHBondContact OH-CZ 3.5Å; Y401-T425 PolarHBondContact OH-OG1 2.94Å; Y401-S426 VanDerWaalsContact OH-C 3.3Å; Y401-S426 PolarHBondContact OH-N 2.68Å; Y401-P427 HydrophobicContact CD2-CB 4Å; Y401-P427 HydrophobicContact CE2-CB 3.63Å; Y401-P427 CarbonylContact O-C 3.56Å; Y401-P427 VanDerWaalsContact O-CA 3.27Å; Y401-P427 WeakPolarHBondContact O-CA 3.32Å; Y401-P427 WeakPolarHBondContact O-CB 3.21Å; Y401-E428 PolarHBondContact O-N 2.97Å; Y401-W505 HydrophobicContact CD1-CH2 4.19Å; Y401-W505 AromaticContact CD2-CH2 3.5Å; Y401-W505 HydrophobicContact CD2-CH2 3.5Å; Y401-W505 HydrophobicContact CD2-CZ2 4.09Å; Y401-W505 HydrophobicContact CD2-CZ3 4.34Å; Y401-W505 HydrophobicContact CE1-CH2 4.18Å; Y401-W505 AromaticContact CE2-CH2 3.49Å; Y401-W505 HydrophobicContact CE2-CH2 3.49Å; Y401-W505 VanDerWaalsContact CE2-CH2 3.49Å; Y401-W505 HydrophobicContact CE2-CZ2 4.43Å; Y401-W505 AromaticContact CE2-CZ3 3.88Å; Y401-W505 HydrophobicContact CE2-CZ3 3.88Å; Y401-W505 AromaticContact CG-CH2 3.88Å; Y401-W505 HydrophobicContact CG-CH2 3.88Å; Y401-W505 HydrophobicContact CG-CZ2 4.43Å; Y401-W505 AromaticContact CZ-CH2 3.85Å; Y401-L513 HydrophobicContact CD1-CD2 3.89Å; Y401-L513 HydrophobicContact CE1-CD1 4.36Å; Y401-L513 HydrophobicContact CE1-CD2 3.65Å
402	S	91.3	Very high	89.4	Confident	48 Å²	48	55.2 Å²	55.2	34%	0.336	31%	0.306	S	S	.	.			trans	-81.4	145.7	177.1	176.2	0	0	0	0	111.2	V404 Q405	S402-V404 PolarHBondContact O-N 2.94Å; S402-V404 VanDerWaalsContact O-N 3.16Å; S402-V404 PolarHBondContact OG-N 3.42Å; S402-Q405 VanDerWaalsContact O-CB 3.3Å; S402-Q405 WeakPolarHBondContact O-CB 3.32Å; S402-Q405 WeakPolarHBondContact O-CG 3.1Å; S402-Q405 PolarHBondContact O-N 3.46Å
403	V	91.8	Very high	89.6	Confident	10 Å²	10	55.5 Å²	55.5	6%	0.061	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-56	-30.8	175.1	-168.6	0	0	0	0	112.4	Q405 V406 L411 R412 P427	V403-Q405 PolarHBondContact O-N 2.76Å; V403-V406 WeakPolarHBondContact O-CB 3.06Å; V403-V406 WeakPolarHBondContact O-CG2 3.48Å; V403-V406 PolarHBondContact O-N 3.17Å; V403-L411 HydrophobicContact CG1-CB 4.14Å; V403-L411 HydrophobicContact CG1-CD2 3.93Å; V403-L411 HydrophobicContact CG1-CG 3.79Å; V403-L411 VanDerWaalsContact CG1-O 3.26Å; V403-L411 WeakPolarHBondContact CG1-O 3.47Å; V403-R412 WeakPolarHBondContact CG2-O 3.44Å; V403-P427 HydrophobicContact CG2-CB 3.5Å; V403-P427 HydrophobicContact CG2-CG 3.51Å
404	V	90	Very high	89.9	Confident	121 Å²	121	52.6 Å²	52.6	73%	0.733	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-58.1	-32	177.2	-176.6	0	0	0	0	111.7	S402 V406 G407	S402-V404 PolarHBondContact O-N 2.94Å; S402-V404 VanDerWaalsContact O-N 3.16Å; S402-V404 PolarHBondContact OG-N 3.42Å; V404-V406 PolarHBondContact O-N 3.35Å; V404-G407 PolarHBondContact O-N 3.27Å
405	Q	89.1	Confident	90.2	Very high	106 Å²	106	47.7 Å²	47.7	50%	0.495	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-66.2	-19.4	179.5	-57.4	179.5	17.2	0	0	113.2	S402 V403 G407 W505	S402-Q405 VanDerWaalsContact O-CB 3.3Å; S402-Q405 WeakPolarHBondContact O-CB 3.32Å; S402-Q405 WeakPolarHBondContact O-CG 3.1Å; S402-Q405 PolarHBondContact O-N 3.46Å; V403-Q405 PolarHBondContact O-N 2.76Å; Q405-G407 VanDerWaalsContact C-N 3.31Å; Q405-W505 PolarHBondContact O-NE1 2.87Å; Q405-W505 VanDerWaalsContact O-NE1 3.12Å
406	V	90.9	Very high	90.5	Very high	14 Å²	14	48 Å²	48	9%	0.085	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-75.3	-21.6	175	-169.5	0	0	0	0	111.6	V403 V404 I408 F414 L502 W505	V403-V406 WeakPolarHBondContact O-CB 3.06Å; V403-V406 WeakPolarHBondContact O-CG2 3.48Å; V403-V406 PolarHBondContact O-N 3.17Å; V404-V406 PolarHBondContact O-N 3.35Å; V406-I408 HydrophobicContact CG1-CD1 3.61Å; V406-I408 HydrophobicContact CG1-CG1 3.98Å; V406-F414 HydrophobicContact CG2-CE1 3.89Å; V406-F414 HydrophobicContact CG2-CZ 4.43Å; V406-L502 HydrophobicContact CG1-CB 4.32Å; V406-L502 HydrophobicContact CG1-CD1 3.6Å; V406-L502 HydrophobicContact CG2-CD1 4.28Å; V406-W505 HydrophobicContact CG1-CB 4.23Å; V406-W505 HydrophobicContact CG1-CD2 4.43Å; V406-W505 HydrophobicContact CG1-CG 4.21Å; V406-W505 HydrophobicContact CG2-CD2 4.11Å; V406-W505 HydrophobicContact CG2-CE3 4.21Å; V406-W505 HydrophobicContact CG2-CZ2 4.47Å; V406-W505 HydrophobicContact CG2-CZ3 4.46Å
407	G	90.4	Very high	90.8	Very high	50 Å²	50	47.3 Å²	47.3	52%	0.515	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	34.3	179.5	0	0	0	0	0	114.4	V404 Q405	V404-G407 PolarHBondContact O-N 3.27Å; Q405-G407 VanDerWaalsContact C-N 3.31Å
408	I	92	Very high	91.1	Very high	17 Å²	17	39.5 Å²	39.5	9%	0.087	23%	0.233	C	C	.	.			trans	-122.7	97.7	178.7	-55.6	173.8	0	0	0	108.6	V406 E410 L411 A498 K501 L502	V406-I408 HydrophobicContact CG1-CD1 3.61Å; V406-I408 HydrophobicContact CG1-CG1 3.98Å; I408-E410 PolarHBondContact O-N 3.48Å; I408-L411 HydrophobicContact CB-CB 3.91Å; I408-L411 HydrophobicContact CB-CD2 4.38Å; I408-L411 HydrophobicContact CD1-CD2 4.19Å; I408-L411 HydrophobicContact CG2-CB 3.68Å; I408-L411 WeakPolarHBondContact O-CB 3.32Å; I408-L411 PolarHBondContact O-N 2.73Å; I408-L411 VanDerWaalsContact O-N 3.16Å; I408-A498 HydrophobicContact CD1-CB 4.04Å; I408-A498 WeakPolarHBondContact CD1-O 3.26Å; I408-A498 HydrophobicContact CG2-CB 3.79Å; I408-K501 HydrophobicContact CD1-CB 3.88Å; I408-K501 HydrophobicContact CG1-CB 4.17Å; I408-K501 HydrophobicContact CG1-CD 4.3Å; I408-L502 HydrophobicContact CD1-CB 4.08Å
409	P	88	Confident	91.6	Very high	122 Å²	122	36.2 Å²	36.2	79%	0.792	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-37.8	-169.1	-28.4	36	0	0	0	115.8	L411	P409-L411 VanDerWaalsContact C-N 3.33Å
410	E	91.6	Very high	92.1	Very high	60 Å²	60	37.2 Å²	37.2	28%	0.28	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-6.6	-178.3	-63.2	-61.8	145.6	0	0	113.8	I408 R412 F486 S487 A490	I408-E410 PolarHBondContact O-N 3.48Å; E410-R412 PolarHBondContact O-N 2.8Å; E410-F486 HydrophobicContact CB-CD1 4.45Å; E410-F486 CarbonylContact O-C 3.57Å; E410-F486 VanDerWaalsContact O-CA 3.27Å; E410-F486 WeakPolarHBondContact O-CA 3.39Å; E410-S487 PolarHBondContact O-N 3.43Å; E410-S487 WeakPolarHBondContact OE2-CB 3.47Å; E410-S487 PolarHBondContact OE2-OG 3.46Å; E410-A490 HydrophobicContact CB-CB 3.87Å; E410-A490 HydrophobicContact CG-CB 4.29Å
411	L	94.6	Very high	92.2	Very high	9 Å²	9	37.2 Å²	37.2	5%	0.047	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	118.8	-179.8	-177.7	65.1	0	0	0	108.9	V403 I408 P409 H413 F414 L484 F486	V403-L411 HydrophobicContact CG1-CB 4.14Å; V403-L411 HydrophobicContact CG1-CD2 3.93Å; V403-L411 HydrophobicContact CG1-CG 3.79Å; V403-L411 VanDerWaalsContact CG1-O 3.26Å; V403-L411 WeakPolarHBondContact CG1-O 3.47Å; I408-L411 HydrophobicContact CB-CB 3.91Å; I408-L411 HydrophobicContact CB-CD2 4.38Å; I408-L411 HydrophobicContact CD1-CD2 4.19Å; I408-L411 HydrophobicContact CG2-CB 3.68Å; I408-L411 WeakPolarHBondContact O-CB 3.32Å; I408-L411 PolarHBondContact O-N 2.73Å; I408-L411 VanDerWaalsContact O-N 3.16Å; P409-L411 VanDerWaalsContact C-N 3.33Å; L411-H413 WeakPolarHBondContact CD1-O 3.17Å; L411-F414 HydrophobicContact CD1-CB 4.5Å; L411-F414 HydrophobicContact CD2-CD1 3.96Å; L411-L484 HydrophobicContact CD1-CB 4.36Å; L411-L484 HydrophobicContact CD1-CD2 3.65Å; L411-L484 HydrophobicContact CD2-CD2 4.47Å; L411-F486 HydrophobicContact CB-CD1 4.19Å; L411-F486 HydrophobicContact CB-CE1 4.12Å; L411-F486 HydrophobicContact CD1-CD1 3.98Å; L411-F486 HydrophobicContact CD1-CE1 3.73Å; L411-F486 HydrophobicContact CD1-CZ 4.05Å
412	R	94.3	Very high	92.2	Very high	60 Å²	60	37.5 Å²	37.5	23%	0.226	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-43.1	176.8	-68.1	-175.5	177.5	165.5	4.8	112.3	V403 E410 P430 Y433 A469 E470 C485 P488	V403-R412 WeakPolarHBondContact CG2-O 3.44Å; E410-R412 PolarHBondContact O-N 2.8Å; R412-P430 WeakPolarHBondContact O-CG 3.44Å; R412-Y433 HydrophobicContact CB-CE2 3.99Å; R412-Y433 WeakPolarHBondContact CD-OH 3.29Å; R412-Y433 PolarHBondContact NH1-OH 2.9Å; R412-A469 PolarHBondContact NH1-O 2.83Å; R412-A469 PolarHBondContact NH2-O 3.17Å; R412-E470 IonicContact NH1-OE1 3.98Å; R412-E470 PolarHBondContact NH1-OE1 2.97Å; R412-C485 WeakPolarHBondContact CA-O 3.4Å; R412-C485 PolarHBondContact N-O 3.02Å; R412-P488 VanDerWaalsContact NH2-CD 3.27Å
413	H	96.1	Very high	92.3	Very high	6 Å²	6	35.6 Å²	35.6	3%	0.028	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	159.1	179.7	-166.2	-94.8	0	0	0	111.1	L411 S426 L442 Y446 C485	L411-H413 WeakPolarHBondContact CD1-O 3.17Å; H413-S426 PolarHBondContact CE1-OG 3.16Å; H413-S426 PolarHBondContact NE2-OG 3.26Å; H413-L442 HydrophobicContact CB-CD2 4.41Å; H413-Y446 AromaticContact ND1-CE2 3.63Å; H413-Y446 AromaticContact ND1-CZ 3.61Å; H413-Y446 PolarHBondContact ND1-OH 2.92Å; H413-C485 HydrophobicContact CB-CB 4.27Å; H413-C485 PolarHBondContact N-O 3.16Å; H413-C485 VanDerWaalsContact N-O 3.09Å; H413-C485 PolarHBondContact O-N 3.45Å
414	F	96.4	Very high	92.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	155.9	174.7	73.4	-89.2	0	0	0	112.8	Y401 V406 L411 T425 P427 Y483 L484 L502 W505 I506	Y401-F414 AromaticContact CE2-CE1 3.96Å; Y401-F414 HydrophobicContact CE2-CE1 3.96Å; Y401-F414 AromaticContact CE2-CZ 3.66Å; Y401-F414 HydrophobicContact CE2-CZ 3.66Å; Y401-F414 AromaticContact CZ-CZ 3.9Å; Y401-F414 VanDerWaalsContact OH-CZ 3.23Å; Y401-F414 WeakPolarHBondContact OH-CZ 3.5Å; V406-F414 HydrophobicContact CG2-CE1 3.89Å; V406-F414 HydrophobicContact CG2-CZ 4.43Å; L411-F414 HydrophobicContact CD1-CB 4.5Å; L411-F414 HydrophobicContact CD2-CD1 3.96Å; F414-T425 HydrophobicContact CE2-CG2 4.36Å; F414-P427 HydrophobicContact CD1-CG 3.78Å; F414-P427 HydrophobicContact CE1-CB 4.21Å; F414-P427 HydrophobicContact CE1-CG 3.82Å; F414-P427 WeakPolarHBondContact O-CD 3.32Å; F414-Y483 CarbonylContact C-O 3.44Å; F414-Y483 WeakPolarHBondContact CA-O 3.34Å; F414-Y483 WeakPolarHBondContact CB-O 3.33Å; F414-L484 HydrophobicContact CB-CD2 3.75Å; F414-L502 HydrophobicContact CB-CD2 4.34Å; F414-L502 HydrophobicContact CD1-CD1 4.32Å; F414-L502 HydrophobicContact CD1-CD2 4.46Å; F414-L502 HydrophobicContact CD2-CD1 4.25Å; F414-L502 HydrophobicContact CD2-CD2 3.86Å; F414-L502 HydrophobicContact CE1-CD1 3.89Å; F414-L502 HydrophobicContact CE2-CD1 3.82Å; F414-L502 HydrophobicContact CE2-CD2 4.22Å; F414-L502 HydrophobicContact CG-CD1 4.47Å; F414-L502 HydrophobicContact CG-CD2 3.98Å; F414-L502 HydrophobicContact CZ-CD1 3.6Å; F414-W505 HydrophobicContact CZ-CZ3 4.28Å; F414-I506 HydrophobicContact CE2-CD1 4.23Å
415	L	97.2	Very high	92.8	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.3	166.1	-56.1	171.4	0	0	0	108.4	P252 L256 Y424 S426 Y446 L482 Y483	P252-L415 HydrophobicContact CB-CD1 3.79Å; P252-L415 HydrophobicContact CB-CD2 3.76Å; P252-L415 HydrophobicContact CB-CG 4.43Å; P252-L415 HydrophobicContact CG-CD1 4.32Å; P252-L415 HydrophobicContact CG-CD2 3.85Å; L256-L415 HydrophobicContact CD1-CB 4.11Å; L256-L415 HydrophobicContact CD1-CD1 4.28Å; L415-Y424 HydrophobicContact CD2-CE2 4.43Å; L415-S426 WeakPolarHBondContact CD2-OG 3.47Å; L415-Y446 HydrophobicContact CD1-CD1 3.71Å; L415-Y446 HydrophobicContact CD1-CD2 3.63Å; L415-Y446 HydrophobicContact CD1-CE1 4.03Å; L415-Y446 HydrophobicContact CD1-CE2 3.93Å; L415-Y446 HydrophobicContact CD1-CG 3.53Å; L415-Y446 HydrophobicContact CG-CD1 4.3Å; L415-Y446 HydrophobicContact CG-CD2 4.26Å; L415-Y446 HydrophobicContact CG-CE1 4.11Å; L415-Y446 HydrophobicContact CG-CE2 4.04Å; L415-Y446 HydrophobicContact CG-CG 4.4Å; L415-L482 WeakPolarHBondContact O-CA 3.47Å; L415-Y483 HydrophobicContact CB-CD2 4.3Å; L415-Y483 PolarHBondContact N-O 2.92Å; L415-Y483 PolarHBondContact O-N 2.96Å
416	Y	96.6	Very high	93.1	Very high	22 Å²	22	26.5 Å²	26.5	9%	0.086	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	122.7	172.6	172.2	-86.3	0	0	0	109.9	Y424 T425 F480 E481 L482 L503 I506 F514	Y416-Y424 CarbonylContact O-C 3.57Å; Y416-Y424 WeakPolarHBondContact O-CA 3.38Å; Y416-Y424 WeakPolarHBondContact O-CB 2.99Å; Y416-T425 HydrophobicContact CD1-CG2 4.22Å; Y416-T425 PolarHBondContact N-O 3.01Å; Y416-T425 PolarHBondContact O-N 3.28Å; Y416-F480 HydrophobicContact CD2-CB 4.3Å; Y416-F480 HydrophobicContact CD2-CD2 4.13Å; Y416-F480 HydrophobicContact CD2-CG 4.4Å; Y416-F480 HydrophobicContact CE2-CB 3.48Å; Y416-F480 VanDerWaalsContact CE2-CB 3.48Å; Y416-F480 HydrophobicContact CE2-CD1 4.32Å; Y416-F480 AromaticContact CE2-CD2 3.7Å; Y416-F480 HydrophobicContact CE2-CD2 3.7Å; Y416-F480 AromaticContact CE2-CG 3.58Å; Y416-F480 HydrophobicContact CE2-CG 3.58Å; Y416-E481 WeakPolarHBondContact CA-O 3.28Å; Y416-L482 HydrophobicContact CD2-CD1 4.23Å; Y416-L503 HydrophobicContact CD2-CD2 4.26Å; Y416-L503 HydrophobicContact CE2-CD2 3.69Å; Y416-I506 HydrophobicContact CD1-CD1 3.96Å; Y416-I506 HydrophobicContact CD1-CG2 4.22Å; Y416-I506 HydrophobicContact CD2-CD1 3.61Å; Y416-I506 HydrophobicContact CE1-CD1 4.45Å; Y416-I506 HydrophobicContact CE1-CG2 3.91Å; Y416-I506 HydrophobicContact CE2-CD1 4.13Å; Y416-I506 HydrophobicContact CG-CD1 3.49Å; Y416-I506 VanDerWaalsContact CG-CD1 3.49Å; Y416-F514 AromaticContact CD1-CZ 3.73Å; Y416-F514 HydrophobicContact CD1-CZ 3.73Å; Y416-F514 HydrophobicContact CE1-CE2 4.16Å; Y416-F514 AromaticContact CE1-CZ 3.72Å; Y416-F514 HydrophobicContact CE1-CZ 3.72Å
417	K	96.1	Very high	93.2	Very high	11 Å²	11	26.2 Å²	26.2	5%	0.048	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.7	174.7	176	-170.3	176	-179.3	0	109.4	E57 L256 A258 F480 E481	E57-K417 WeakPolarHBondContact OE1-CE 3.47Å; E57-K417 IonicContact OE1-NZ 3.32Å; E57-K417 PolarHBondContact OE1-NZ 2.73Å; L256-K417 HydrophobicContact CB-CD 4.28Å; L256-K417 HydrophobicContact CD1-CB 4.5Å; L256-K417 VanDerWaalsContact O-CD 3.3Å; L256-K417 WeakPolarHBondContact O-CD 3.43Å; L256-K417 WeakPolarHBondContact O-CE 3.21Å; L256-K417 PolarHBondContact O-NZ 3.39Å; A258-K417 HydrophobicContact CB-CD 4.41Å; A258-K417 HydrophobicContact CB-CG 4.08Å; K417-F480 CarbonylContact O-C 3.13Å; K417-F480 WeakPolarHBondContact O-CA 3.23Å; K417-F480 WeakPolarHBondContact O-CB 3.09Å; K417-E481 HydrophobicContact CB-CB 4.21Å; K417-E481 HydrophobicContact CD-CG 4.23Å; K417-E481 PolarHBondContact N-O 3.22Å; K417-E481 IonicContact NZ-OE1 3.46Å; K417-E481 PolarHBondContact O-N 3.47Å
418	S	94.4	Very high	93.3	Very high	5 Å²	5	28.8 Å²	28.8	4%	0.035	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	119.9	166.5	-177.2	0	0	0	0	110	S420 S421 G422 L423	S418-S420 VanDerWaalsContact C-N 3.32Å; S418-S420 PolarHBondContact OG-OG 2.93Å; S418-S420 VanDerWaalsContact OG-OG 3.12Å; S418-S421 WeakPolarHBondContact CB-OG 3.33Å; S418-S421 PolarHBondContact OG-OG 2.83Å; S418-G422 PolarHBondContact O-N 2.78Å; S418-G422 VanDerWaalsContact O-N 3.16Å; S418-L423 PolarHBondContact N-O 2.93Å
419	K	90.9	Very high	93.3	Very high	15 Å²	15	30.9 Å²	30.9	7%	0.065	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-21.9	179.9	-68.4	-176.8	176.4	-79.2	0	113	E57 T477 G479 E481	E57-K419 IonicContact OE1-NZ 3.27Å; E57-K419 PolarHBondContact OE1-NZ 2.9Å; E57-K419 IonicContact OE2-NZ 3.84Å; E57-K419 PolarHBondContact OE2-NZ 2.87Å; K419-T477 WeakPolarHBondContact CE-O 3.46Å; K419-G479 WeakPolarHBondContact CB-O 3.38Å; K419-G479 PolarHBondContact N-O 3.21Å; K419-E481 WeakPolarHBondContact CE-OE1 3.17Å; K419-E481 IonicContact NZ-OE1 2.69Å; K419-E481 PolarHBondContact NZ-OE1 3.36Å
420	S	87.7	Confident	93.3	Very high	70 Å²	70	26.7 Å²	26.7	49%	0.49	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-31.8	-178.8	56.4	0	0	0	0	113.5	S418	S418-S420 VanDerWaalsContact C-N 3.32Å; S418-S420 PolarHBondContact OG-OG 2.93Å; S418-S420 VanDerWaalsContact OG-OG 3.12Å
421	S	86.4	Confident	93.1	Very high	31 Å²	31	31.8 Å²	31.8	22%	0.217	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-13.1	179.9	58.3	0	0	0	0	114.2	S418 L423	S418-S421 WeakPolarHBondContact CB-OG 3.33Å; S418-S421 PolarHBondContact OG-OG 2.83Å; S421-L423 PolarHBondContact O-N 2.8Å
422	G	89.9	Confident	92.8	Very high	9 Å²	9	35.4 Å²	35.4	9%	0.093	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	17.6	-174.3	0	0	0	0	0	113.3	A258 V259 S418	A258-G422 VanDerWaalsContact CA-O 3.24Å; A258-G422 WeakPolarHBondContact CA-O 3.49Å; A258-G422 WeakPolarHBondContact CB-O 3.34Å; V259-G422 PolarHBondContact N-O 3.35Å; V259-G422 VanDerWaalsContact N-O 3.13Å; S418-G422 PolarHBondContact O-N 2.78Å; S418-G422 VanDerWaalsContact O-N 3.16Å
423	L	94.4	Very high	92.7	Very high	9 Å²	9	32.5 Å²	32.5	5%	0.047	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	150.1	-178.7	-62.9	175.7	0	0	0	110.9	V259 C261 L295 S418 S421 F514 I515	V259-L423 HydrophobicContact CB-CD2 4.12Å; V259-L423 CarbonylContact O-C 3.44Å; V259-L423 VanDerWaalsContact O-CA 3.25Å; V259-L423 WeakPolarHBondContact O-CA 3.47Å; V259-L423 WeakPolarHBondContact O-CD2 3.5Å; C261-L423 HydrophobicContact CB-CD1 4.43Å; L295-L423 HydrophobicContact CD2-CD2 4.46Å; S418-L423 PolarHBondContact N-O 2.93Å; S421-L423 PolarHBondContact O-N 2.8Å; L423-F514 HydrophobicContact CB-CD1 3.71Å; L423-F514 HydrophobicContact CB-CE1 4.26Å; L423-F514 HydrophobicContact CD1-CB 4.17Å; L423-F514 HydrophobicContact CD1-CD1 4.23Å; L423-I515 HydrophobicContact CD1-CB 3.97Å; L423-I515 HydrophobicContact CD1-CG1 4.05Å; L423-I515 VanDerWaalsContact CD1-N 3.26Å
424	Y	96.2	Very high	92.3	Very high	12 Å²	12	37.8 Å²	37.8	5%	0.047	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	160.2	170.8	85	-82.3	0	0	0	111.8	D251 P252 G253 L256 A258 V259 T260 L415 Y416	D251-Y424 PolarHBondContact OD1-OH 2.89Å; P252-Y424 HydrophobicContact CB-CE2 3.88Å; P252-Y424 HydrophobicContact CG-CE2 4.46Å; G253-Y424 VanDerWaalsContact N-CZ 3.32Å; G253-Y424 PolarHBondContact N-OH 2.95Å; G253-Y424 VanDerWaalsContact N-OH 3.12Å; L256-Y424 HydrophobicContact CD1-CD2 3.84Å; L256-Y424 HydrophobicContact CD1-CE2 4.46Å; L256-Y424 HydrophobicContact CD1-CG 3.91Å; A258-Y424 HydrophobicContact CB-CD1 3.9Å; A258-Y424 HydrophobicContact CB-CG 4.38Å; V259-Y424 PolarHBondContact O-N 2.94Å; T260-Y424 HydrophobicContact CG2-CD1 3.99Å; T260-Y424 HydrophobicContact CG2-CD2 4.32Å; T260-Y424 HydrophobicContact CG2-CE1 3.31Å; T260-Y424 HydrophobicContact CG2-CE2 3.7Å; T260-Y424 HydrophobicContact CG2-CG 4.46Å; T260-Y424 WeakPolarHBondContact CG2-OH 3.3Å; L415-Y424 HydrophobicContact CD2-CE2 4.43Å; Y416-Y424 CarbonylContact O-C 3.57Å; Y416-Y424 WeakPolarHBondContact O-CA 3.38Å; Y416-Y424 WeakPolarHBondContact O-CB 2.99Å
425	T	95.5	Very high	92.2	Very high	11 Å²	11	40.8 Å²	40.8	7%	0.067	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	143.3	176.3	-157.5	0	0	0	0	110.2	Y401 F414 Y416 L513 F514	Y401-T425 PolarHBondContact OH-OG1 2.94Å; F414-T425 HydrophobicContact CE2-CG2 4.36Å; Y416-T425 HydrophobicContact CD1-CG2 4.22Å; Y416-T425 PolarHBondContact N-O 3.01Å; Y416-T425 PolarHBondContact O-N 3.28Å; T425-L513 HydrophobicContact CG2-CD1 4.3Å; T425-F514 HydrophobicContact CG2-CE1 4.35Å; T425-F514 HydrophobicContact CG2-CZ 3.76Å
426	S	95.1	Very high	91.8	Very high	22 Å²	22	45 Å²	45	15%	0.154	25%	0.247	C	C	.	.			trans	-144.5	137.6	-175.9	-171.7	0	0	0	0	107.9	Y401 H413 L415	Y401-S426 VanDerWaalsContact OH-C 3.3Å; Y401-S426 PolarHBondContact OH-N 2.68Å; H413-S426 PolarHBondContact CE1-OG 3.16Å; H413-S426 PolarHBondContact NE2-OG 3.26Å; L415-S426 WeakPolarHBondContact CD2-OG 3.47Å
427	P	94.3	Very high	91.6	Very high	8 Å²	8	51.6 Å²	51.6	5%	0.052	28%	0.278	C	S	.	.			trans	-69.5	175.4	169.6	32.7	-33.1	0	0	0	110.7	Y401 V403 F414	Y401-P427 HydrophobicContact CD2-CB 4Å; Y401-P427 HydrophobicContact CE2-CB 3.63Å; Y401-P427 CarbonylContact O-C 3.56Å; Y401-P427 VanDerWaalsContact O-CA 3.27Å; Y401-P427 WeakPolarHBondContact O-CA 3.32Å; Y401-P427 WeakPolarHBondContact O-CB 3.21Å; V403-P427 HydrophobicContact CG2-CB 3.5Å; V403-P427 HydrophobicContact CG2-CG 3.51Å; F414-P427 HydrophobicContact CD1-CG 3.78Å; F414-P427 HydrophobicContact CE1-CB 4.21Å; F414-P427 HydrophobicContact CE1-CG 3.82Å; F414-P427 WeakPolarHBondContact O-CD 3.32Å
428	E	92.3	Very high	91.4	Very high	105 Å²	105	53.4 Å²	53.4	49%	0.491	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-62.9	147.9	166.1	-166	170.1	139.9	0	0	112	S400 Y401 P430	S400-E428 PolarHBondContact OG-OE2 2.81Å; Y401-E428 PolarHBondContact O-N 2.97Å; E428-P430 VanDerWaalsContact O-CD 3.29Å; E428-P430 WeakPolarHBondContact O-CD 3.19Å
429	I	90.9	Very high	91.2	Very high	61 Å²	61	55.9 Å²	55.9	31%	0.313	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-69.1	117.5	176.3	-57.9	-178.8	0	0	0	109	Y433 Q439	I429-Y433 VanDerWaalsContact CG2-O 3.23Å; I429-Y433 WeakPolarHBondContact CG2-O 3.41Å; I429-Q439 HydrophobicContact CD1-CG 4.11Å; I429-Q439 HydrophobicContact CG2-CG 4.41Å
430	P	89.4	Confident	91.2	Very high	34 Å²	34	58.5 Å²	58.5	22%	0.221	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-61.5	158.7	177.3	-18.2	26.6	0	0	0	113.2	R412 E428 V432 Y433 Q434	R412-P430 WeakPolarHBondContact O-CG 3.44Å; E428-P430 VanDerWaalsContact O-CD 3.29Å; E428-P430 WeakPolarHBondContact O-CD 3.19Å; P430-V432 PolarHBondContact O-N 3.29Å; P430-V432 VanDerWaalsContact O-N 3.07Å; P430-Y433 HydrophobicContact CG-CD2 4.23Å; P430-Y433 CarbonylContact O-C 3.5Å; P430-Y433 PolarHBondContact O-N 3.29Å; P430-Q434 PolarHBondContact O-N 3.38Å
431	E	87.3	Confident	91.4	Very high	166 Å²	166	59 Å²	59	78%	0.776	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-48.1	-37.7	174.4	-66.2	177.5	177.7	0	0	113.8	Y433 Q434	E431-Y433 PolarHBondContact O-N 3.49Å; E431-Y433 VanDerWaalsContact O-N 3.16Å; E431-Q434 PolarHBondContact O-N 3.14Å
432	V	88.1	Confident	91.7	Very high	85 Å²	85	57.9 Å²	57.9	52%	0.515	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-57.9	-28	177.5	-177	0	0	0	0	112.9	P430	P430-V432 PolarHBondContact O-N 3.29Å; P430-V432 VanDerWaalsContact O-N 3.07Å
433	Y	90.9	Very high	91.8	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-116.6	22.2	-178	-52.3	-58.8	0	0	0	113.1	R412 I429 P430 E431 E438 Q439 L442 E470 C485	R412-Y433 HydrophobicContact CB-CE2 3.99Å; R412-Y433 WeakPolarHBondContact CD-OH 3.29Å; R412-Y433 PolarHBondContact NH1-OH 2.9Å; I429-Y433 VanDerWaalsContact CG2-O 3.23Å; I429-Y433 WeakPolarHBondContact CG2-O 3.41Å; P430-Y433 HydrophobicContact CG-CD2 4.23Å; P430-Y433 CarbonylContact O-C 3.5Å; P430-Y433 PolarHBondContact O-N 3.29Å; E431-Y433 PolarHBondContact O-N 3.49Å; E431-Y433 VanDerWaalsContact O-N 3.16Å; Y433-E438 HydrophobicContact CD1-CB 4.29Å; Y433-Q439 WeakPolarHBondContact O-CG 3.35Å; Y433-L442 HydrophobicContact CD1-CB 4.49Å; Y433-L442 HydrophobicContact CD2-CD2 3.79Å; Y433-L442 HydrophobicContact CE2-CD1 4.21Å; Y433-L442 HydrophobicContact CE2-CD2 4.28Å; Y433-L442 HydrophobicContact CG-CD2 4.02Å; Y433-E470 WeakPolarHBondContact OH-CG 3.41Å; Y433-E470 PolarHBondContact OH-OE1 3.39Å; Y433-C485 PolarHBondContact OH-SG 3.22Å
434	Q	88.8	Confident	91.7	Very high	116 Å²	116	58.6 Å²	58.6	54%	0.542	30%	0.301	S	S	.	.			trans	-71.6	-30.5	-176.5	-87.4	178.3	5.9	0	0	114.5	P430 E431 Q439	P430-Q434 PolarHBondContact O-N 3.38Å; E431-Q434 PolarHBondContact O-N 3.14Å; Q434-Q439 PolarHBondContact O-NE2 3.29Å
435	S	93.2	Very high	91.5	Very high	63 Å²	63	59.6 Å²	59.6	44%	0.441	31%	0.307	S	S	.	.	S	Bend	trans	-70.8	148.3	179.1	58.9	0	0	0	0	112.1	E437 E438 Q439	S435-E437 VanDerWaalsContact C-N 3.27Å; S435-E437 PolarHBondContact O-N 3.05Å; S435-E438 PolarHBondContact O-N 2.84Å; S435-E438 WeakPolarHBondContact OG-CB 3.44Å; S435-E438 VanDerWaalsContact OG-CG 3.32Å; S435-E438 WeakPolarHBondContact OG-CG 3.32Å; S435-Q439 WeakPolarHBondContact O-CG 3.42Å; S435-Q439 PolarHBondContact O-N 3Å
436	D	89.9	Confident	91.5	Very high	91 Å²	91	59.3 Å²	59.3	49%	0.487	31%	0.305	S	S	.	.	H	α-helix	trans	-52.4	-43.5	178.6	-75.8	-70.9	0	0	0	113	R250 E438 Q439 E440	R250-D436 IonicContact CZ-OD1 2.69Å; R250-D436 VanDerWaalsContact CZ-OD1 3.24Å; R250-D436 IonicContact NH1-OD1 2.72Å; R250-D436 PolarHBondContact NH1-OD1 3.29Å; R250-D436 IonicContact NH2-OD1 3.81Å; R250-D436 PolarHBondContact NH2-OD1 3.28Å; D436-E438 VanDerWaalsContact C-N 3.32Å; D436-E438 PolarHBondContact O-N 3.06Å; D436-Q439 PolarHBondContact O-N 3.1Å; D436-E440 PolarHBondContact O-N 3.12Å
437	E	91.1	Very high	91.3	Very high	160 Å²	160	59.4 Å²	59.4	75%	0.748	30%	0.302	S	S	*	.	H	α-helix	trans	-61	-39.5	178.1	-62.8	-178.4	172.5	0	0	112.4	S435 R441	S435-E437 VanDerWaalsContact C-N 3.27Å; S435-E437 PolarHBondContact O-N 3.05Å; E437-R441 VanDerWaalsContact O-CB 3.31Å; E437-R441 WeakPolarHBondContact O-CB 3.49Å; E437-R441 PolarHBondContact O-N 3.36Å
438	E	92.1	Very high	91.2	Very high	49 Å²	49	61 Å²	61	23%	0.229	31%	0.31	C	S	.	.	H	α-helix	trans	-77.5	-30.2	179.1	-74.6	-67.1	128.2	0	0	112.5	Y433 S435 D436 R441 L442	Y433-E438 HydrophobicContact CD1-CB 4.29Å; S435-E438 PolarHBondContact O-N 2.84Å; S435-E438 WeakPolarHBondContact OG-CB 3.44Å; S435-E438 VanDerWaalsContact OG-CG 3.32Å; S435-E438 WeakPolarHBondContact OG-CG 3.32Å; D436-E438 VanDerWaalsContact C-N 3.32Å; D436-E438 PolarHBondContact O-N 3.06Å; E438-R441 VanDerWaalsContact CD-NE 3.26Å; E438-R441 PolarHBondContact O-N 3.15Å; E438-R441 IonicContact OE1-CZ 2.95Å; E438-R441 IonicContact OE1-NE 3.64Å; E438-R441 PolarHBondContact OE1-NE 3.11Å; E438-R441 IonicContact OE1-NH2 2.67Å; E438-R441 IonicContact OE2-CZ 3.44Å; E438-R441 IonicContact OE2-NE 3.7Å; E438-R441 PolarHBondContact OE2-NE 3.14Å; E438-R441 IonicContact OE2-NH2 2.75Å; E438-R441 PolarHBondContact OE2-NH2 3.46Å; E438-L442 VanDerWaalsContact O-CB 3.27Å; E438-L442 WeakPolarHBondContact O-CB 3.35Å; E438-L442 PolarHBondContact O-N 3.32Å
439	Q	91.9	Very high	91.1	Very high	57 Å²	57	56 Å²	56	27%	0.266	29%	0.287	S	S	.	.	H	α-helix	trans	-66.5	-45.8	169.9	-64.7	-174.5	34	0	0	111.1	I429 Y433 Q434 S435 D436 R441 L442 M443	I429-Q439 HydrophobicContact CD1-CG 4.11Å; I429-Q439 HydrophobicContact CG2-CG 4.41Å; Y433-Q439 WeakPolarHBondContact O-CG 3.35Å; Q434-Q439 PolarHBondContact O-NE2 3.29Å; S435-Q439 WeakPolarHBondContact O-CG 3.42Å; S435-Q439 PolarHBondContact O-N 3Å; D436-Q439 PolarHBondContact O-N 3.1Å; Q439-R441 VanDerWaalsContact C-N 3.31Å; Q439-R441 PolarHBondContact O-N 3Å; Q439-L442 PolarHBondContact O-N 3.18Å; Q439-M443 WeakPolarHBondContact O-CB 3.45Å; Q439-M443 PolarHBondContact O-N 2.72Å
440	E	90.1	Very high	91.2	Very high	70 Å²	70	53.9 Å²	53.9	33%	0.327	28%	0.276	S	S	.	.	H	α-helix	trans	-59.4	-42.6	172.7	-76.9	-177.3	-154.9	0	0	111.3	K121 R250 D436 M443 G444	K121-E440 IonicContact NZ-OE2 3.13Å; K121-E440 PolarHBondContact NZ-OE2 3.01Å; R250-E440 IonicContact NH2-OE1 3.51Å; R250-E440 PolarHBondContact NH2-OE1 3.13Å; D436-E440 PolarHBondContact O-N 3.12Å; E440-M443 PolarHBondContact O-N 3.26Å; E440-G444 PolarHBondContact O-N 2.94Å
441	R	91.2	Very high	91.2	Very high	79 Å²	79	53.3 Å²	53.3	30%	0.298	27%	0.272	S	S	.	.	H	α-helix	trans	-61.4	-50.5	176	-167	175.1	75.4	79.8	-1.5	111.3	E437 E438 Q439 M443 G444 L445 E470	E437-R441 VanDerWaalsContact O-CB 3.31Å; E437-R441 WeakPolarHBondContact O-CB 3.49Å; E437-R441 PolarHBondContact O-N 3.36Å; E438-R441 VanDerWaalsContact CD-NE 3.26Å; E438-R441 PolarHBondContact O-N 3.15Å; E438-R441 IonicContact OE1-CZ 2.95Å; E438-R441 IonicContact OE1-NE 3.64Å; E438-R441 PolarHBondContact OE1-NE 3.11Å; E438-R441 IonicContact OE1-NH2 2.67Å; E438-R441 IonicContact OE2-CZ 3.44Å; E438-R441 IonicContact OE2-NE 3.7Å; E438-R441 PolarHBondContact OE2-NE 3.14Å; E438-R441 IonicContact OE2-NH2 2.75Å; E438-R441 PolarHBondContact OE2-NH2 3.46Å; Q439-R441 VanDerWaalsContact C-N 3.31Å; Q439-R441 PolarHBondContact O-N 3Å; R441-M443 VanDerWaalsContact C-N 3.34Å; R441-M443 PolarHBondContact O-N 3.19Å; R441-G444 PolarHBondContact O-N 3.38Å; R441-L445 WeakPolarHBondContact O-CG 3.29Å; R441-L445 PolarHBondContact O-N 3.05Å; R441-E470 IonicContact CZ-OE1 2.74Å; R441-E470 IonicContact CZ-OE2 2.69Å; R441-E470 IonicContact NH1-OE1 2.67Å; R441-E470 PolarHBondContact NH1-OE1 3.33Å; R441-E470 IonicContact NH1-OE2 3.15Å; R441-E470 PolarHBondContact NH1-OE2 3.33Å; R441-E470 IonicContact NH2-OE1 2.98Å; R441-E470 PolarHBondContact NH2-OE1 3.11Å; R441-E470 IonicContact NH2-OE2 2.72Å
442	L	93.2	Very high	91.3	Very high	8 Å²	8	46.9 Å²	46.9	4%	0.042	25%	0.246	C	C	.	.	H	α-helix	trans	-60.1	-42.1	178.7	179.1	63.3	0	0	0	111.9	H413 Y433 E438 Q439 L445 Y446 C485	H413-L442 HydrophobicContact CB-CD2 4.41Å; Y433-L442 HydrophobicContact CD1-CB 4.49Å; Y433-L442 HydrophobicContact CD2-CD2 3.79Å; Y433-L442 HydrophobicContact CE2-CD1 4.21Å; Y433-L442 HydrophobicContact CE2-CD2 4.28Å; Y433-L442 HydrophobicContact CG-CD2 4.02Å; E438-L442 VanDerWaalsContact O-CB 3.27Å; E438-L442 WeakPolarHBondContact O-CB 3.35Å; E438-L442 PolarHBondContact O-N 3.32Å; Q439-L442 PolarHBondContact O-N 3.18Å; L442-L445 WeakPolarHBondContact O-CB 3.41Å; L442-L445 PolarHBondContact O-N 2.88Å; L442-Y446 HydrophobicContact CD1-CD2 4.35Å; L442-Y446 HydrophobicContact CD1-CE2 3.65Å; L442-Y446 HydrophobicContact CD2-CE2 4.25Å; L442-Y446 HydrophobicContact CG-CD2 4.18Å; L442-Y446 HydrophobicContact CG-CE2 3.68Å; L442-Y446 VanDerWaalsContact O-CD2 3.23Å; L442-Y446 WeakPolarHBondContact O-CD2 3.28Å; L442-Y446 PolarHBondContact O-N 3.48Å; L442-Y446 VanDerWaalsContact O-N 3.14Å; L442-C485 HydrophobicContact CD1-CB 4.23Å
443	M	92.7	Very high	91.3	Very high	9 Å²	9	43 Å²	43	4%	0.044	22%	0.222	C	C	.	.	H	α-helix	trans	-66.9	-39.4	176.1	-173.9	53.1	174.5	0	0	111.7	E249 P252 L255 Q439 E440 R441 L445 Y446 Q447	E249-M443 VanDerWaalsContact O-CG 3.31Å; E249-M443 WeakPolarHBondContact O-CG 3.15Å; P252-M443 HydrophobicContact CG-SD 4.35Å; L255-M443 HydrophobicContact CB-CE 3.7Å; L255-M443 HydrophobicContact CD2-CE 3.78Å; L255-M443 HydrophobicContact CD2-SD 4.03Å; L255-M443 HydrophobicContact CG-CE 4.36Å; Q439-M443 WeakPolarHBondContact O-CB 3.45Å; Q439-M443 PolarHBondContact O-N 2.72Å; E440-M443 PolarHBondContact O-N 3.26Å; R441-M443 VanDerWaalsContact C-N 3.34Å; R441-M443 PolarHBondContact O-N 3.19Å; M443-L445 VanDerWaalsContact C-N 3.33Å; M443-L445 PolarHBondContact O-N 3.35Å; M443-Y446 PolarHBondContact O-N 3.41Å; M443-Y446 VanDerWaalsContact O-N 3.07Å; M443-Q447 WeakPolarHBondContact O-CG 3.49Å; M443-Q447 PolarHBondContact O-N 3.42Å
444	G	91.8	Very high	91.2	Very high	25 Å²	25	45.5 Å²	45.5	26%	0.258	23%	0.234	S	C	.	.	H	α-helix	trans	-57.9	-41.3	170.7	0	0	0	0	0	112.9	E440 R441 Y446 Q447 D448	E440-G444 PolarHBondContact O-N 2.94Å; R441-G444 PolarHBondContact O-N 3.38Å; G444-Y446 VanDerWaalsContact C-N 3.3Å; G444-Y446 PolarHBondContact O-N 3.25Å; G444-Q447 PolarHBondContact O-N 2.92Å; G444-D448 WeakPolarHBondContact O-CB 3.32Å; G444-D448 PolarHBondContact O-N 3.43Å
445	L	92.6	Very high	91	Very high	33 Å²	33	44.3 Å²	44.3	17%	0.173	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-35.7	173.5	-61.6	179.8	0	0	0	112.1	R441 L442 M443 D448 L449 E470 L472	R441-L445 WeakPolarHBondContact O-CG 3.29Å; R441-L445 PolarHBondContact O-N 3.05Å; L442-L445 WeakPolarHBondContact O-CB 3.41Å; L442-L445 PolarHBondContact O-N 2.88Å; M443-L445 VanDerWaalsContact C-N 3.33Å; M443-L445 PolarHBondContact O-N 3.35Å; L445-D448 WeakPolarHBondContact O-CB 3.42Å; L445-L449 VanDerWaalsContact O-CG 3.27Å; L445-L449 WeakPolarHBondContact O-CG 3.41Å; L445-L449 PolarHBondContact O-N 3.15Å; L445-L449 VanDerWaalsContact O-N 3.15Å; L445-E470 HydrophobicContact CD1-CG 4.33Å; L445-L472 HydrophobicContact CB-CD1 4.09Å; L445-L472 HydrophobicContact CD1-CD1 4.46Å; L445-L472 HydrophobicContact CD1-CD2 4.32Å; L445-L472 HydrophobicContact CD2-CD1 4.17Å; L445-L472 HydrophobicContact CG-CD1 4.45Å
446	Y	94.1	Very high	90.1	Very high	5 Å²	5	45.3 Å²	45.3	2%	0.02	23%	0.233	C	C	.	.	H	α-helix	trans	-71.5	-38.4	175	-71.7	-53.2	0	0	0	113.3	H413 L415 L442 M443 G444 L449 H450 Y483	H413-Y446 AromaticContact ND1-CE2 3.63Å; H413-Y446 AromaticContact ND1-CZ 3.61Å; H413-Y446 PolarHBondContact ND1-OH 2.92Å; L415-Y446 HydrophobicContact CD1-CD1 3.71Å; L415-Y446 HydrophobicContact CD1-CD2 3.63Å; L415-Y446 HydrophobicContact CD1-CE1 4.03Å; L415-Y446 HydrophobicContact CD1-CE2 3.93Å; L415-Y446 HydrophobicContact CD1-CG 3.53Å; L415-Y446 HydrophobicContact CG-CD1 4.3Å; L415-Y446 HydrophobicContact CG-CD2 4.26Å; L415-Y446 HydrophobicContact CG-CE1 4.11Å; L415-Y446 HydrophobicContact CG-CE2 4.04Å; L415-Y446 HydrophobicContact CG-CG 4.4Å; L442-Y446 HydrophobicContact CD1-CD2 4.35Å; L442-Y446 HydrophobicContact CD1-CE2 3.65Å; L442-Y446 HydrophobicContact CD2-CE2 4.25Å; L442-Y446 HydrophobicContact CG-CD2 4.18Å; L442-Y446 HydrophobicContact CG-CE2 3.68Å; L442-Y446 VanDerWaalsContact O-CD2 3.23Å; L442-Y446 WeakPolarHBondContact O-CD2 3.28Å; L442-Y446 PolarHBondContact O-N 3.48Å; L442-Y446 VanDerWaalsContact O-N 3.14Å; M443-Y446 PolarHBondContact O-N 3.41Å; M443-Y446 VanDerWaalsContact O-N 3.07Å; G444-Y446 VanDerWaalsContact C-N 3.3Å; G444-Y446 PolarHBondContact O-N 3.25Å; Y446-L449 HydrophobicContact CD1-CD1 4.26Å; Y446-L449 PolarHBondContact O-N 2.88Å; Y446-H450 VanDerWaalsContact O-CB 3.25Å; Y446-H450 WeakPolarHBondContact O-CB 3.48Å; Y446-H450 PolarHBondContact O-N 2.91Å; Y446-Y483 HydrophobicContact CD1-CG 4.38Å
447	Q	92.1	Very high	89.6	Confident	23 Å²	23	46.3 Å²	46.3	11%	0.107	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-46.1	171.8	-68.1	171.9	-1.4	0	0	111	L255 M443 G444 L449 H450 S451	L255-Q447 HydrophobicContact CD1-CG 4.23Å; L255-Q447 HydrophobicContact CD2-CG 4.06Å; M443-Q447 WeakPolarHBondContact O-CG 3.49Å; M443-Q447 PolarHBondContact O-N 3.42Å; G444-Q447 PolarHBondContact O-N 2.92Å; Q447-L449 VanDerWaalsContact C-N 3.34Å; Q447-L449 PolarHBondContact O-N 3.5Å; Q447-H450 PolarHBondContact O-N 3Å; Q447-S451 VanDerWaalsContact O-CB 3.3Å; Q447-S451 WeakPolarHBondContact O-CB 3.2Å; Q447-S451 PolarHBondContact O-N 2.94Å; Q447-S451 PolarHBondContact O-OG 3.18Å
448	D	90.6	Very high	88.8	Confident	41 Å²	41	48.1 Å²	48.1	22%	0.219	24%	0.242	C	C	.	.	H	α-helix	trans	-54.5	-47	174.6	-112	41.3	0	0	0	112.5	G444 L445 C452 R465	G444-D448 WeakPolarHBondContact O-CB 3.32Å; G444-D448 PolarHBondContact O-N 3.43Å; L445-D448 WeakPolarHBondContact O-CB 3.42Å; D448-C452 PolarHBondContact O-N 3.49Å; D448-C452 VanDerWaalsContact O-N 3.13Å; D448-C452 PolarHBondContact O-SG 3.36Å; D448-R465 IonicContact OD2-CZ 3.15Å; D448-R465 IonicContact OD2-NH1 3.56Å; D448-R465 PolarHBondContact OD2-NH1 3.23Å; D448-R465 IonicContact OD2-NH2 2.67Å; D448-R465 PolarHBondContact OD2-NH2 3.47Å
449	L	92.1	Very high	88.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-67.6	-44.3	178.5	-69.4	172.8	0	0	0	112.3	L445 Y446 Q447 C452 L453 F463 L472 A474 Y483	L445-L449 VanDerWaalsContact O-CG 3.27Å; L445-L449 WeakPolarHBondContact O-CG 3.41Å; L445-L449 PolarHBondContact O-N 3.15Å; L445-L449 VanDerWaalsContact O-N 3.15Å; Y446-L449 HydrophobicContact CD1-CD1 4.26Å; Y446-L449 PolarHBondContact O-N 2.88Å; Q447-L449 VanDerWaalsContact C-N 3.34Å; Q447-L449 PolarHBondContact O-N 3.5Å; L449-C452 PolarHBondContact O-N 3.37Å; L449-L453 WeakPolarHBondContact O-CG 3.3Å; L449-L453 PolarHBondContact O-N 3.08Å; L449-F463 HydrophobicContact CD2-CD1 3.68Å; L449-F463 HydrophobicContact CD2-CE1 4.04Å; L449-L472 HydrophobicContact CD1-CB 4.1Å; L449-L472 HydrophobicContact CD1-CD1 4.27Å; L449-L472 HydrophobicContact CD1-CD2 4.43Å; L449-L472 HydrophobicContact CD2-CB 3.95Å; L449-L472 HydrophobicContact CD2-CD1 4.27Å; L449-L472 HydrophobicContact CG-CB 4.47Å; L449-L472 HydrophobicContact CG-CD1 4.26Å; L449-A474 HydrophobicContact CB-CB 4.04Å; L449-A474 HydrophobicContact CD1-CB 4.31Å; L449-A474 HydrophobicContact CD2-CB 4.08Å; L449-A474 HydrophobicContact CG-CB 4.37Å; L449-Y483 HydrophobicContact CB-CD1 3.85Å; L449-Y483 HydrophobicContact CB-CE1 4.25Å; L449-Y483 HydrophobicContact CD1-CD1 4.43Å
450	H	92.6	Very high	87.6	Confident	18 Å²	18	50.9 Å²	50.9	8%	0.083	27%	0.265	C	S	.	.	H	α-helix	trans	-60.7	-46.5	177.5	171.1	-84.2	0	0	0	111	E197 R200 L255 Y446 Q447 C452 L453 H454 Y483	E197-H450 IonicContact OE1-CG 3.81Å; E197-H450 IonicContact OE1-ND1 3.35Å; E197-H450 PolarHBondContact OE1-ND1 3.06Å; R200-H450 PolarHBondContact NH1-CE1 3.44Å; R200-H450 PolarHBondContact NH1-NE2 3.04Å; L255-H450 HydrophobicContact CD1-CB 3.82Å; L255-H450 VanDerWaalsContact CD1-CG 3.46Å; L255-H450 HydrophobicContact CD2-CB 4.49Å; L255-H450 HydrophobicContact CG-CB 4.38Å; L255-H450 PolarHBondContact O-NE2 3.08Å; Y446-H450 VanDerWaalsContact O-CB 3.25Å; Y446-H450 WeakPolarHBondContact O-CB 3.48Å; Y446-H450 PolarHBondContact O-N 2.91Å; Q447-H450 PolarHBondContact O-N 3Å; H450-C452 VanDerWaalsContact C-N 3.31Å; H450-C452 PolarHBondContact O-N 3.25Å; H450-L453 PolarHBondContact O-N 3.16Å; H450-H454 AromaticContact CD2-CD2 3.4Å; H450-H454 PolarHBondContact CD2-CD2 3.23Å; H450-H454 AromaticContact CD2-NE2 3.9Å; H450-H454 AromaticContact CE1-CD2 3.97Å; H450-H454 AromaticContact CG-CD2 3.95Å; H450-H454 AromaticContact NE2-CD2 3.44Å; H450-H454 PolarHBondContact NE2-CD2 3.49Å; H450-H454 AromaticContact NE2-NE2 3.98Å; H450-H454 WeakPolarHBondContact O-CB 3.31Å; H450-H454 PolarHBondContact O-CD2 3.24Å; H450-H454 PolarHBondContact O-N 2.69Å; H450-Y483 HydrophobicContact CB-CE1 3.94Å
451	S	89.7	Confident	87.5	Confident	21 Å²	21	58 Å²	58	15%	0.147	29%	0.289	C	S	.	.	H	α-helix	trans	-57.5	-38.5	173.4	-77	0	0	0	0	113.6	S194 E197 Q447 H455	S194-S451 WeakPolarHBondContact CB-OG 3.35Å; S194-S451 PolarHBondContact OG-OG 3.04Å; E197-S451 PolarHBondContact OE1-OG 3.13Å; E197-S451 PolarHBondContact OE2-OG 2.75Å; Q447-S451 VanDerWaalsContact O-CB 3.3Å; Q447-S451 WeakPolarHBondContact O-CB 3.2Å; Q447-S451 PolarHBondContact O-N 2.94Å; Q447-S451 PolarHBondContact O-OG 3.18Å; S451-H455 PolarHBondContact O-N 3.21Å
452	C	88.5	Confident	87.4	Confident	32 Å²	32	56 Å²	56	22%	0.216	29%	0.288	C	S	.	.	H	α-helix	trans	-69.7	-39.2	176.3	-68.6	0	0	0	0	112.9	D448 L449 H450 F463	D448-C452 PolarHBondContact O-N 3.49Å; D448-C452 VanDerWaalsContact O-N 3.13Å; D448-C452 PolarHBondContact O-SG 3.36Å; L449-C452 PolarHBondContact O-N 3.37Å; H450-C452 VanDerWaalsContact C-N 3.31Å; H450-C452 PolarHBondContact O-N 3.25Å; C452-F463 HydrophobicContact CB-CD1 4.37Å; C452-F463 HydrophobicContact CB-CG 4.44Å
453	L	89	Confident	87.3	Confident	3 Å²	3	58 Å²	58	2%	0.016	30%	0.296	C	S	.	.	H	α-helix	trans	-73.1	-42.8	-180	-68.7	169.6	0	0	0	111.9	L449 H450 H455 P459 L460 F463 A474 V476 Y483	L449-L453 WeakPolarHBondContact O-CG 3.3Å; L449-L453 PolarHBondContact O-N 3.08Å; H450-L453 PolarHBondContact O-N 3.16Å; L453-H455 PolarHBondContact O-N 3Å; L453-P459 CarbonylContact O-C 3.58Å; L453-P459 WeakPolarHBondContact O-CA 3.27Å; L453-P459 VanDerWaalsContact O-CB 3.27Å; L453-P459 WeakPolarHBondContact O-CB 3.32Å; L453-L460 HydrophobicContact CD2-CB 4.29Å; L453-L460 WeakPolarHBondContact CD2-O 3.48Å; L453-L460 PolarHBondContact O-N 3.13Å; L453-F463 HydrophobicContact CD2-CB 4.48Å; L453-A474 HydrophobicContact CD1-CB 3.4Å; L453-A474 VanDerWaalsContact CD1-CB 3.4Å; L453-A474 HydrophobicContact CD2-CB 4.23Å; L453-A474 HydrophobicContact CG-CB 4.03Å; L453-V476 HydrophobicContact CB-CG2 3.89Å; L453-V476 HydrophobicContact CD1-CG2 3.61Å; L453-V476 HydrophobicContact CD2-CG2 4.1Å; L453-V476 HydrophobicContact CG-CG2 4.07Å; L453-Y483 HydrophobicContact CD1-CD1 4.22Å; L453-Y483 HydrophobicContact CD1-CE1 3.48Å; L453-Y483 VanDerWaalsContact CD1-CE1 3.48Å
454	H	87.3	Confident	87.3	Confident	53 Å²	53	59.5 Å²	59.5	25%	0.245	30%	0.301	C	S	.	.	S	Bend	trans	-95.3	18.4	-173.6	-66.7	-71.8	0	0	0	114	K196 H450 E481 Y483	K196-H454 PolarHBondContact NZ-O 3.16Å; H450-H454 AromaticContact CD2-CD2 3.4Å; H450-H454 PolarHBondContact CD2-CD2 3.23Å; H450-H454 AromaticContact CD2-NE2 3.9Å; H450-H454 AromaticContact CE1-CD2 3.97Å; H450-H454 AromaticContact CG-CD2 3.95Å; H450-H454 AromaticContact NE2-CD2 3.44Å; H450-H454 PolarHBondContact NE2-CD2 3.49Å; H450-H454 AromaticContact NE2-NE2 3.98Å; H450-H454 WeakPolarHBondContact O-CB 3.31Å; H450-H454 PolarHBondContact O-CD2 3.24Å; H450-H454 PolarHBondContact O-N 2.69Å; H454-E481 IonicContact CE1-OE1 2.88Å; H454-E481 PolarHBondContact CE1-OE1 3.17Å; H454-E481 IonicContact CE1-OE2 2.64Å; H454-E481 IonicContact NE2-OE1 3.24Å; H454-E481 PolarHBondContact NE2-OE1 3.23Å; H454-E481 IonicContact NE2-OE2 3.81Å; H454-E481 PolarHBondContact NE2-OE2 3.43Å; H454-Y483 PolarHBondContact NE2-OH 3.24Å
455	H	84.4	Confident	87.3	Confident	90 Å²	90	62.4 Å²	62.4	42%	0.417	30%	0.304	S	S	.	.			trans	-59.2	125.9	-179.7	-166.4	-89	0	0	0	111.6	S451 L453 T457 R458 P459	S451-H455 PolarHBondContact O-N 3.21Å; L453-H455 PolarHBondContact O-N 3Å; H455-T457 VanDerWaalsContact C-N 3.33Å; H455-T457 PolarHBondContact CE1-OG1 2.88Å; H455-T457 PolarHBondContact ND1-OG1 2.99Å; H455-T457 PolarHBondContact O-N 2.95Å; H455-R458 CarbonylContact O-C 3.59Å; H455-R458 PolarHBondContact O-N 3.13Å; H455-P459 WeakPolarHBondContact O-CD 3.21Å
456	P	75.3	Confident	87.2	Confident	85 Å²	85	65 Å²	65	55%	0.552	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-37.7	-166.2	19.3	-30.3	0	0	0	114.5
457	T	78.3	Confident	87	Confident	111 Å²	111	66.5 Å²	66.5	68%	0.681	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-16.1	-174.3	56.9	0	0	0	0	113.9	H455	H455-T457 VanDerWaalsContact C-N 3.33Å; H455-T457 PolarHBondContact CE1-OG1 2.88Å; H455-T457 PolarHBondContact ND1-OG1 2.99Å; H455-T457 PolarHBondContact O-N 2.95Å
458	R	75.6	Confident	86.7	Confident	198 Å²	198	74.9 Å²	74.9	75%	0.747	38%	0.381	S	S	*	.	S	Bend	trans	-154.3	64.2	-171.8	-65.2	-169.5	-179.5	-173	0.5	111.3	H455 L460	H455-R458 CarbonylContact O-C 3.59Å; H455-R458 PolarHBondContact O-N 3.13Å; R458-L460 PolarHBondContact O-N 2.54Å
459	P	77.7	Confident	86.6	Confident	91 Å²	91	75 Å²	75	59%	0.591	39%	0.387	S	S	*	.			trans	-64.9	130	179.2	27.5	-34.4	0	0	0	110.7	L453 H455	L453-P459 CarbonylContact O-C 3.58Å; L453-P459 WeakPolarHBondContact O-CA 3.27Å; L453-P459 VanDerWaalsContact O-CB 3.27Å; L453-P459 WeakPolarHBondContact O-CB 3.32Å; H455-P459 WeakPolarHBondContact O-CD 3.21Å
460	L	81.3	Confident	86.6	Confident	73 Å²	73	75.6 Å²	75.6	38%	0.382	39%	0.39	S	S	.	.			trans	-90.4	134.7	179.5	-63.1	179.4	0	0	0	110.4	L453 R458 F463	L453-L460 HydrophobicContact CD2-CB 4.29Å; L453-L460 WeakPolarHBondContact CD2-O 3.48Å; L453-L460 PolarHBondContact O-N 3.13Å; R458-L460 PolarHBondContact O-N 2.54Å; L460-F463 HydrophobicContact CD1-CB 4.12Å; L460-F463 HydrophobicContact CD1-CD2 3.7Å; L460-F463 HydrophobicContact CD1-CG 4.22Å
461	R	86.8	Confident	86.7	Confident	219 Å²	219	75 Å²	75	83%	0.826	39%	0.388	S	S	*	.	S	Bend	trans	-76.7	-30.6	173.1	-67.7	-172.4	177.7	-150.8	-0.8	113	M475 V476	R461-M475 WeakPolarHBondContact O-CA 3.47Å; R461-V476 PolarHBondContact O-N 3.44Å
462	S	90.3	Very high	87	Confident	39 Å²	39	74.4 Å²	74.4	27%	0.273	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	142.9	173.3	-178	0	0	0	0	109.6	A474 Y496	S462-A474 CarbonylContact C-O 3.57Å; S462-A474 VanDerWaalsContact CA-O 3.23Å; S462-A474 WeakPolarHBondContact CA-O 3.15Å; S462-A474 PolarHBondContact OG-O 3.02Å; S462-Y496 PolarHBondContact OG-OH 2.91Å; S462-Y496 VanDerWaalsContact OG-OH 3.06Å
463	F	90.4	Very high	87.4	Confident	49 Å²	49	72.9 Å²	72.9	22%	0.215	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	130.8	179	179.4	-105.6	0	0	0	109.3	L449 C452 L453 L460 R465 L473 A474	L449-F463 HydrophobicContact CD2-CD1 3.68Å; L449-F463 HydrophobicContact CD2-CE1 4.04Å; C452-F463 HydrophobicContact CB-CD1 4.37Å; C452-F463 HydrophobicContact CB-CG 4.44Å; L453-F463 HydrophobicContact CD2-CB 4.48Å; L460-F463 HydrophobicContact CD1-CB 4.12Å; L460-F463 HydrophobicContact CD1-CD2 3.7Å; L460-F463 HydrophobicContact CD1-CG 4.22Å; F463-R465 HydrophobicContact CE1-CB 3.74Å; F463-R465 HydrophobicContact CZ-CB 4.05Å; F463-L473 CarbonylContact O-C 3.57Å; F463-L473 WeakPolarHBondContact O-CA 3.41Å; F463-A474 PolarHBondContact N-O 3.28Å; F463-A474 PolarHBondContact O-N 2.78Å
464	Y	92.1	Very high	87.7	Confident	41 Å²	41	72.7 Å²	72.7	16%	0.161	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.2	177.4	-180	-99.4	0	0	0	109.1	C466 N471 L472 L473 A490 K492 A495	Y464-C466 WeakPolarHBondContact CE1-SG 3.48Å; Y464-N471 HydrophobicContact CE2-CB 4.47Å; Y464-L472 CarbonylContact C-O 3.59Å; Y464-L472 VanDerWaalsContact CA-O 3.31Å; Y464-L472 WeakPolarHBondContact CA-O 3.49Å; Y464-L472 VanDerWaalsContact CD2-O 3.26Å; Y464-L472 WeakPolarHBondContact CD2-O 3.32Å; Y464-L473 HydrophobicContact CD2-CB 4Å; Y464-L473 HydrophobicContact CD2-CD1 4.16Å; Y464-A490 PolarHBondContact OH-O 3.21Å; Y464-K492 HydrophobicContact CD1-CB 4.2Å; Y464-K492 HydrophobicContact CD1-CD 3.96Å; Y464-K492 HydrophobicContact CD1-CG 3.85Å; Y464-K492 HydrophobicContact CE1-CB 3.71Å; Y464-K492 HydrophobicContact CE1-CD 4.26Å; Y464-K492 HydrophobicContact CE1-CG 3.89Å; Y464-K492 HydrophobicContact CG-CG 4.21Å; Y464-K492 PolarHBondContact OH-N 2.65Å; Y464-A495 HydrophobicContact CD2-CB 4.32Å; Y464-A495 HydrophobicContact CE2-CB 3.77Å
465	R	92.1	Very high	88	Confident	85 Å²	85	72 Å²	72	32%	0.321	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	126.5	-179.5	-172.1	-172.4	-66.6	176.8	2.5	108.8	D448 F463 L472	D448-R465 IonicContact OD2-CZ 3.15Å; D448-R465 IonicContact OD2-NH1 3.56Å; D448-R465 PolarHBondContact OD2-NH1 3.23Å; D448-R465 IonicContact OD2-NH2 2.67Å; D448-R465 PolarHBondContact OD2-NH2 3.47Å; F463-R465 HydrophobicContact CE1-CB 3.74Å; F463-R465 HydrophobicContact CZ-CB 4.05Å; R465-L472 HydrophobicContact CB-CB 4.46Å; R465-L472 PolarHBondContact N-O 3.28Å; R465-L472 PolarHBondContact O-N 3.01Å
466	C	91.6	Very high	88.5	Confident	87 Å²	87	69.2 Å²	69.2	59%	0.588	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	137.9	165.2	-74.4	0	0	0	0	109.8	Y464 N471	Y464-C466 WeakPolarHBondContact CE1-SG 3.48Å; C466-N471 VanDerWaalsContact CA-OD1 3.23Å; C466-N471 WeakPolarHBondContact CA-OD1 3.43Å; C466-N471 PolarHBondContact SG-OD1 3.21Å
467	G	88.8	Confident	89.3	Confident	38 Å²	38	67.4 Å²	67.4	39%	0.392	35%	0.346	S	S	.	.			trans	-133.7	171.1	173.6	0	0	0	0	0	110.6	E470 N471	G467-E470 VanDerWaalsContact CA-O 3.26Å; G467-E470 WeakPolarHBondContact CA-O 3.45Å; G467-E470 PolarHBondContact N-O 2.84Å; G467-N471 PolarHBondContact N-OD1 3.03Å
468	E	86.6	Confident	89.7	Confident	198 Å²	198	68 Å²	68	93%	0.925	36%	0.355	S	S	*	.	S	Bend	trans	-72.7	-38.9	-179.4	-60.5	-177.3	167.9	0	0	111.9	P488	E468-P488 WeakPolarHBondContact O-CB 3.48Å
469	A	88.1	Confident	90.4	Very high	43 Å²	43	60.3 Å²	60.3	36%	0.355	34%	0.336	S	S	.	.	S	Bend	trans	-96.2	-33.1	-178.1	0	0	0	0	0	113.7	R412 P488	R412-A469 PolarHBondContact NH1-O 2.83Å; R412-A469 PolarHBondContact NH2-O 3.17Å; A469-P488 WeakPolarHBondContact O-CD 3.49Å
470	E	92.9	Very high	91.2	Very high	13 Å²	13	57.4 Å²	57.4	6%	0.061	31%	0.314	C	S	.	.			trans	-141.7	148.3	-179.3	-65.7	73.2	-143.8	0	0	112.2	R412 Y433 R441 L445 G467 L472 C485 F486	R412-E470 IonicContact NH1-OE1 3.98Å; R412-E470 PolarHBondContact NH1-OE1 2.97Å; Y433-E470 WeakPolarHBondContact OH-CG 3.41Å; Y433-E470 PolarHBondContact OH-OE1 3.39Å; R441-E470 IonicContact CZ-OE1 2.74Å; R441-E470 IonicContact CZ-OE2 2.69Å; R441-E470 IonicContact NH1-OE1 2.67Å; R441-E470 PolarHBondContact NH1-OE1 3.33Å; R441-E470 IonicContact NH1-OE2 3.15Å; R441-E470 PolarHBondContact NH1-OE2 3.33Å; R441-E470 IonicContact NH2-OE1 2.98Å; R441-E470 PolarHBondContact NH2-OE1 3.11Å; R441-E470 IonicContact NH2-OE2 2.72Å; L445-E470 HydrophobicContact CD1-CG 4.33Å; G467-E470 VanDerWaalsContact CA-O 3.26Å; G467-E470 WeakPolarHBondContact CA-O 3.45Å; G467-E470 PolarHBondContact N-O 2.84Å; E470-L472 HydrophobicContact CB-CD2 4.15Å; E470-C485 VanDerWaalsContact CG-SG 3.54Å; E470-F486 WeakPolarHBondContact CA-O 3.45Å
471	N	94.8	Very high	91.9	Very high	7 Å²	7	54 Å²	54	4%	0.037	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	129.1	161.9	-70.9	-32.3	0	0	0	109.4	Y464 C466 G467 F486 S487 P488 A490	Y464-N471 HydrophobicContact CE2-CB 4.47Å; C466-N471 VanDerWaalsContact CA-OD1 3.23Å; C466-N471 WeakPolarHBondContact CA-OD1 3.43Å; C466-N471 PolarHBondContact SG-OD1 3.21Å; G467-N471 PolarHBondContact N-OD1 3.03Å; N471-F486 HydrophobicContact CB-CB 4.26Å; N471-F486 PolarHBondContact N-O 3.45Å; N471-F486 WeakPolarHBondContact O-CB 3.44Å; N471-F486 PolarHBondContact O-N 2.82Å; N471-S487 PolarHBondContact ND2-O 2.9Å; N471-P488 VanDerWaalsContact ND2-C 3.32Å; N471-P488 PolarHBondContact ND2-O 2.92Å; N471-A490 PolarHBondContact ND2-O 2.83Å
472	L	95.6	Very high	92.4	Very high	7 Å²	7	43.5 Å²	43.5	4%	0.037	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.2	-173.5	-59.5	179.3	0	0	0	111.3	L445 L449 Y464 R465 E470 L484 C485	L445-L472 HydrophobicContact CB-CD1 4.09Å; L445-L472 HydrophobicContact CD1-CD1 4.46Å; L445-L472 HydrophobicContact CD1-CD2 4.32Å; L445-L472 HydrophobicContact CD2-CD1 4.17Å; L445-L472 HydrophobicContact CG-CD1 4.45Å; L449-L472 HydrophobicContact CD1-CB 4.1Å; L449-L472 HydrophobicContact CD1-CD1 4.27Å; L449-L472 HydrophobicContact CD1-CD2 4.43Å; L449-L472 HydrophobicContact CD2-CB 3.95Å; L449-L472 HydrophobicContact CD2-CD1 4.27Å; L449-L472 HydrophobicContact CG-CB 4.47Å; L449-L472 HydrophobicContact CG-CD1 4.26Å; Y464-L472 CarbonylContact C-O 3.59Å; Y464-L472 VanDerWaalsContact CA-O 3.31Å; Y464-L472 WeakPolarHBondContact CA-O 3.49Å; Y464-L472 VanDerWaalsContact CD2-O 3.26Å; Y464-L472 WeakPolarHBondContact CD2-O 3.32Å; R465-L472 HydrophobicContact CB-CB 4.46Å; R465-L472 PolarHBondContact N-O 3.28Å; R465-L472 PolarHBondContact O-N 3.01Å; E470-L472 HydrophobicContact CB-CD2 4.15Å; L472-L484 WeakPolarHBondContact CA-O 3.19Å; L472-C485 HydrophobicContact CD2-CB 4.18Å
473	L	95.4	Very high	92.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	130.6	171.7	178.2	58.9	0	0	0	109.4	F463 Y464 L484 F486 A495 Y496 V499	F463-L473 CarbonylContact O-C 3.57Å; F463-L473 WeakPolarHBondContact O-CA 3.41Å; Y464-L473 HydrophobicContact CD2-CB 4Å; Y464-L473 HydrophobicContact CD2-CD1 4.16Å; L473-L484 HydrophobicContact CB-CB 4.17Å; L473-L484 HydrophobicContact CB-CD1 4.1Å; L473-L484 HydrophobicContact CD2-CD1 3.81Å; L473-L484 HydrophobicContact CG-CD1 4.03Å; L473-L484 PolarHBondContact N-O 3.39Å; L473-L484 WeakPolarHBondContact O-CB 3.17Å; L473-L484 PolarHBondContact O-N 3.47Å; L473-F486 HydrophobicContact CB-CE2 4.01Å; L473-F486 HydrophobicContact CD2-CE2 4.48Å; L473-A495 HydrophobicContact CD2-CB 3.94Å; L473-Y496 HydrophobicContact CD1-CE1 4.04Å; L473-Y496 HydrophobicContact CD1-CE2 4.35Å; L473-Y496 HydrophobicContact CD2-CD1 4.44Å; L473-Y496 HydrophobicContact CD2-CE1 4.48Å; L473-V499 HydrophobicContact CD2-CG2 3.61Å
474	A	95.4	Very high	93	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	151.8	169.7	0	0	0	0	0	111.4	L449 L453 S462 F463 L482 Y483	L449-A474 HydrophobicContact CB-CB 4.04Å; L449-A474 HydrophobicContact CD1-CB 4.31Å; L449-A474 HydrophobicContact CD2-CB 4.08Å; L449-A474 HydrophobicContact CG-CB 4.37Å; L453-A474 HydrophobicContact CD1-CB 3.4Å; L453-A474 VanDerWaalsContact CD1-CB 3.4Å; L453-A474 HydrophobicContact CD2-CB 4.23Å; L453-A474 HydrophobicContact CG-CB 4.03Å; S462-A474 CarbonylContact C-O 3.57Å; S462-A474 VanDerWaalsContact CA-O 3.23Å; S462-A474 WeakPolarHBondContact CA-O 3.15Å; S462-A474 PolarHBondContact OG-O 3.02Å; F463-A474 PolarHBondContact N-O 3.28Å; F463-A474 PolarHBondContact O-N 2.78Å; A474-L482 CarbonylContact C-O 3.59Å; A474-L482 VanDerWaalsContact CA-O 3.27Å; A474-L482 WeakPolarHBondContact CA-O 3.31Å; A474-Y483 HydrophobicContact CB-CD1 3.97Å; A474-Y483 HydrophobicContact CB-CE1 4.39Å
475	M	94.9	Very high	93.2	Very high	37 Å²	37	37.6 Å²	37.6	18%	0.182	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	133.7	-176.9	-175.1	175	-69.3	0	0	111.1	R461 T477 E481 L482 Y496 V499	R461-M475 WeakPolarHBondContact O-CA 3.47Å; M475-T477 HydrophobicContact CG-CG2 4.31Å; M475-E481 WeakPolarHBondContact O-CA 3.5Å; M475-L482 PolarHBondContact N-O 2.84Å; M475-L482 PolarHBondContact O-N 3.44Å; M475-Y496 HydrophobicContact CE-CD1 4.29Å; M475-Y496 HydrophobicContact CE-CE1 3.96Å; M475-V499 HydrophobicContact SD-CG1 4.41Å
476	V	93.9	Very high	93.3	Very high	33 Å²	33	33.6 Å²	33.6	20%	0.2	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	132.6	173.7	176.1	0	0	0	0	109.3	L453 R461 E481	L453-V476 HydrophobicContact CB-CG2 3.89Å; L453-V476 HydrophobicContact CD1-CG2 3.61Å; L453-V476 HydrophobicContact CD2-CG2 4.1Å; L453-V476 HydrophobicContact CG-CG2 4.07Å; R461-V476 PolarHBondContact O-N 3.44Å; V476-E481 HydrophobicContact CG1-CG 4.29Å; V476-E481 HydrophobicContact CG2-CB 4.36Å; V476-E481 HydrophobicContact CG2-CG 4.06Å
477	T	91.9	Very high	93.4	Very high	46 Å²	46	30.2 Å²	30.2	28%	0.282	19%	0.19	S	C	.	.			trans	-128.6	176.8	174.3	70	0	0	0	0	109.7	K419 M475 G479 F480	K419-T477 WeakPolarHBondContact CE-O 3.46Å; M475-T477 HydrophobicContact CG-CG2 4.31Å; T477-G479 VanDerWaalsContact C-N 3.26Å; T477-G479 PolarHBondContact O-N 3.49Å; T477-G479 PolarHBondContact OG1-N 3.45Å; T477-F480 HydrophobicContact CG2-CD1 4.4Å; T477-F480 HydrophobicContact CG2-CE1 3.8Å; T477-F480 HydrophobicContact CG2-CE2 4.07Å; T477-F480 HydrophobicContact CG2-CZ 3.6Å; T477-F480 PolarHBondContact N-O 3.41Å; T477-F480 WeakPolarHBondContact OG1-CD1 3.17Å; T477-F480 WeakPolarHBondContact OG1-CE1 3.4Å; T477-F480 PolarHBondContact OG1-N 3.18Å; T477-F480 PolarHBondContact OG1-O 3.1Å
478	S	88.6	Confident	93.5	Very high	125 Å²	125	30.8 Å²	30.8	87%	0.874	19%	0.186	S	C	*	.	S	Bend	trans	-67.1	-23.7	172.9	48.9	0	0	0	0	113.8
479	G	90.4	Very high	93.6	Very high	35 Å²	35	27.9 Å²	27.9	36%	0.361	18%	0.176	S	C	.	.	S	Bend	trans	-101	-30.3	-177.7	0	0	0	0	0	114.8	K419 T477	K419-G479 WeakPolarHBondContact CB-O 3.38Å; K419-G479 PolarHBondContact N-O 3.21Å; T477-G479 VanDerWaalsContact C-N 3.26Å; T477-G479 PolarHBondContact O-N 3.49Å; T477-G479 PolarHBondContact OG1-N 3.45Å
480	F	94	Very high	93.7	Very high	30 Å²	30	25.9 Å²	25.9	13%	0.132	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	159.9	-173.7	69.5	-93	0	0	0	113.3	Y416 K417 T477 L482 L503	Y416-F480 HydrophobicContact CD2-CB 4.3Å; Y416-F480 HydrophobicContact CD2-CD2 4.13Å; Y416-F480 HydrophobicContact CD2-CG 4.4Å; Y416-F480 HydrophobicContact CE2-CB 3.48Å; Y416-F480 VanDerWaalsContact CE2-CB 3.48Å; Y416-F480 HydrophobicContact CE2-CD1 4.32Å; Y416-F480 AromaticContact CE2-CD2 3.7Å; Y416-F480 HydrophobicContact CE2-CD2 3.7Å; Y416-F480 AromaticContact CE2-CG 3.58Å; Y416-F480 HydrophobicContact CE2-CG 3.58Å; K417-F480 CarbonylContact O-C 3.13Å; K417-F480 WeakPolarHBondContact O-CA 3.23Å; K417-F480 WeakPolarHBondContact O-CB 3.09Å; T477-F480 HydrophobicContact CG2-CD1 4.4Å; T477-F480 HydrophobicContact CG2-CE1 3.8Å; T477-F480 HydrophobicContact CG2-CE2 4.07Å; T477-F480 HydrophobicContact CG2-CZ 3.6Å; T477-F480 PolarHBondContact N-O 3.41Å; T477-F480 WeakPolarHBondContact OG1-CD1 3.17Å; T477-F480 WeakPolarHBondContact OG1-CE1 3.4Å; T477-F480 PolarHBondContact OG1-N 3.18Å; T477-F480 PolarHBondContact OG1-O 3.1Å; F480-L482 HydrophobicContact CD2-CB 3.99Å; F480-L482 HydrophobicContact CE2-CB 3.93Å; F480-L482 HydrophobicContact CE2-CD2 4.48Å; F480-L503 HydrophobicContact CD2-CD2 4.43Å; F480-L503 HydrophobicContact CE1-CD1 4.22Å; F480-L503 HydrophobicContact CE1-CD2 4.18Å; F480-L503 HydrophobicContact CE2-CD1 4.48Å; F480-L503 HydrophobicContact CE2-CD2 4.09Å; F480-L503 HydrophobicContact CZ-CD1 3.79Å; F480-L503 HydrophobicContact CZ-CD2 3.96Å
481	E	95.4	Very high	93.6	Very high	1 Å²	1	29 Å²	29	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	143.6	162.6	-48.4	-171.3	-173.9	0	0	109.8	Y416 K417 K419 H454 M475 V476 Y483	Y416-E481 WeakPolarHBondContact CA-O 3.28Å; K417-E481 HydrophobicContact CB-CB 4.21Å; K417-E481 HydrophobicContact CD-CG 4.23Å; K417-E481 PolarHBondContact N-O 3.22Å; K417-E481 IonicContact NZ-OE1 3.46Å; K417-E481 PolarHBondContact O-N 3.47Å; K419-E481 WeakPolarHBondContact CE-OE1 3.17Å; K419-E481 IonicContact NZ-OE1 2.69Å; K419-E481 PolarHBondContact NZ-OE1 3.36Å; H454-E481 IonicContact CE1-OE1 2.88Å; H454-E481 PolarHBondContact CE1-OE1 3.17Å; H454-E481 IonicContact CE1-OE2 2.64Å; H454-E481 IonicContact NE2-OE1 3.24Å; H454-E481 PolarHBondContact NE2-OE1 3.23Å; H454-E481 IonicContact NE2-OE2 3.81Å; H454-E481 PolarHBondContact NE2-OE2 3.43Å; M475-E481 WeakPolarHBondContact O-CA 3.5Å; V476-E481 HydrophobicContact CG1-CG 4.29Å; V476-E481 HydrophobicContact CG2-CB 4.36Å; V476-E481 HydrophobicContact CG2-CG 4.06Å; E481-Y483 HydrophobicContact CB-CE2 3.72Å; E481-Y483 PolarHBondContact OE2-OH 3.27Å
482	L	96.6	Very high	93.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	129.8	-176.5	177.5	63.7	0	0	0	110.2	L415 Y416 A474 M475 F480 L484 V499 L502	L415-L482 WeakPolarHBondContact O-CA 3.47Å; Y416-L482 HydrophobicContact CD2-CD1 4.23Å; A474-L482 CarbonylContact C-O 3.59Å; A474-L482 VanDerWaalsContact CA-O 3.27Å; A474-L482 WeakPolarHBondContact CA-O 3.31Å; M475-L482 PolarHBondContact N-O 2.84Å; M475-L482 PolarHBondContact O-N 3.44Å; F480-L482 HydrophobicContact CD2-CB 3.99Å; F480-L482 HydrophobicContact CE2-CB 3.93Å; F480-L482 HydrophobicContact CE2-CD2 4.48Å; L482-L484 HydrophobicContact CD1-CD2 4.1Å; L482-L484 HydrophobicContact CD1-CG 4.14Å; L482-L484 HydrophobicContact CD2-CD1 3.88Å; L482-L484 HydrophobicContact CD2-CG 4.32Å; L482-L484 HydrophobicContact CG-CD1 4.03Å; L482-L484 HydrophobicContact CG-CD2 4.41Å; L482-L484 HydrophobicContact CG-CG 3.98Å; L482-V499 HydrophobicContact CD2-CB 4.43Å; L482-V499 HydrophobicContact CD2-CG1 3.92Å; L482-V499 HydrophobicContact CD2-CG2 4.12Å; L482-L502 HydrophobicContact CD1-CD2 3.59Å; L482-L502 HydrophobicContact CD2-CD2 4.37Å
483	Y	96.9	Very high	93.3	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.008	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	129	178.7	-54	-101.5	0	0	0	108.3	L256 F414 L415 Y446 L449 H450 L453 H454 A474 E481	L256-Y483 HydrophobicContact CD2-CD2 3.95Å; L256-Y483 HydrophobicContact CD2-CE2 3.36Å; F414-Y483 CarbonylContact C-O 3.44Å; F414-Y483 WeakPolarHBondContact CA-O 3.34Å; F414-Y483 WeakPolarHBondContact CB-O 3.33Å; L415-Y483 HydrophobicContact CB-CD2 4.3Å; L415-Y483 PolarHBondContact N-O 2.92Å; L415-Y483 PolarHBondContact O-N 2.96Å; Y446-Y483 HydrophobicContact CD1-CG 4.38Å; L449-Y483 HydrophobicContact CB-CD1 3.85Å; L449-Y483 HydrophobicContact CB-CE1 4.25Å; L449-Y483 HydrophobicContact CD1-CD1 4.43Å; H450-Y483 HydrophobicContact CB-CE1 3.94Å; L453-Y483 HydrophobicContact CD1-CD1 4.22Å; L453-Y483 HydrophobicContact CD1-CE1 3.48Å; L453-Y483 VanDerWaalsContact CD1-CE1 3.48Å; H454-Y483 PolarHBondContact NE2-OH 3.24Å; A474-Y483 HydrophobicContact CB-CD1 3.97Å; A474-Y483 HydrophobicContact CB-CE1 4.39Å; E481-Y483 HydrophobicContact CB-CE2 3.72Å; E481-Y483 PolarHBondContact OE2-OH 3.27Å
484	L	96.4	Very high	93.1	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	133.4	-169.7	-64.8	156.5	0	0	0	110.2	L411 F414 L472 L473 L482 F486 V499 L502	L411-L484 HydrophobicContact CD1-CB 4.36Å; L411-L484 HydrophobicContact CD1-CD2 3.65Å; L411-L484 HydrophobicContact CD2-CD2 4.47Å; F414-L484 HydrophobicContact CB-CD2 3.75Å; L472-L484 WeakPolarHBondContact CA-O 3.19Å; L473-L484 HydrophobicContact CB-CB 4.17Å; L473-L484 HydrophobicContact CB-CD1 4.1Å; L473-L484 HydrophobicContact CD2-CD1 3.81Å; L473-L484 HydrophobicContact CG-CD1 4.03Å; L473-L484 PolarHBondContact N-O 3.39Å; L473-L484 WeakPolarHBondContact O-CB 3.17Å; L473-L484 PolarHBondContact O-N 3.47Å; L482-L484 HydrophobicContact CD1-CD2 4.1Å; L482-L484 HydrophobicContact CD1-CG 4.14Å; L482-L484 HydrophobicContact CD2-CD1 3.88Å; L482-L484 HydrophobicContact CD2-CG 4.32Å; L482-L484 HydrophobicContact CG-CD1 4.03Å; L482-L484 HydrophobicContact CG-CD2 4.41Å; L482-L484 HydrophobicContact CG-CG 3.98Å; L484-F486 HydrophobicContact CB-CD2 4.14Å; L484-F486 HydrophobicContact CB-CE2 3.49Å; L484-F486 VanDerWaalsContact CB-CE2 3.49Å; L484-F486 HydrophobicContact CB-CZ 4.02Å; L484-F486 HydrophobicContact CD1-CE2 4.01Å; L484-F486 HydrophobicContact CD1-CZ 4.04Å; L484-F486 HydrophobicContact CD2-CZ 4.3Å; L484-F486 HydrophobicContact CG-CE2 4.24Å; L484-F486 HydrophobicContact CG-CZ 4.37Å; L484-V499 HydrophobicContact CD1-CG2 3.68Å; L484-L502 HydrophobicContact CD2-CD2 3.67Å
485	C	95.9	Very high	92.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	115.6	175.2	174.3	0	0	0	0	108.7	R412 H413 Y433 L442 E470 L472	R412-C485 WeakPolarHBondContact CA-O 3.4Å; R412-C485 PolarHBondContact N-O 3.02Å; H413-C485 HydrophobicContact CB-CB 4.27Å; H413-C485 PolarHBondContact N-O 3.16Å; H413-C485 VanDerWaalsContact N-O 3.09Å; H413-C485 PolarHBondContact O-N 3.45Å; Y433-C485 PolarHBondContact OH-SG 3.22Å; L442-C485 HydrophobicContact CD1-CB 4.23Å; E470-C485 VanDerWaalsContact CG-SG 3.54Å; L472-C485 HydrophobicContact CD2-CB 4.18Å
486	F	95	Very high	92.8	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.009	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	158.8	-179.4	-62.8	-87.1	0	0	0	111.7	E410 L411 E470 N471 L473 L484 A490 A495 A498	E410-F486 HydrophobicContact CB-CD1 4.45Å; E410-F486 CarbonylContact O-C 3.57Å; E410-F486 VanDerWaalsContact O-CA 3.27Å; E410-F486 WeakPolarHBondContact O-CA 3.39Å; L411-F486 HydrophobicContact CB-CD1 4.19Å; L411-F486 HydrophobicContact CB-CE1 4.12Å; L411-F486 HydrophobicContact CD1-CD1 3.98Å; L411-F486 HydrophobicContact CD1-CE1 3.73Å; L411-F486 HydrophobicContact CD1-CZ 4.05Å; E470-F486 WeakPolarHBondContact CA-O 3.45Å; N471-F486 HydrophobicContact CB-CB 4.26Å; N471-F486 PolarHBondContact N-O 3.45Å; N471-F486 WeakPolarHBondContact O-CB 3.44Å; N471-F486 PolarHBondContact O-N 2.82Å; L473-F486 HydrophobicContact CB-CE2 4.01Å; L473-F486 HydrophobicContact CD2-CE2 4.48Å; L484-F486 HydrophobicContact CB-CD2 4.14Å; L484-F486 HydrophobicContact CB-CE2 3.49Å; L484-F486 VanDerWaalsContact CB-CE2 3.49Å; L484-F486 HydrophobicContact CB-CZ 4.02Å; L484-F486 HydrophobicContact CD1-CE2 4.01Å; L484-F486 HydrophobicContact CD1-CZ 4.04Å; L484-F486 HydrophobicContact CD2-CZ 4.3Å; L484-F486 HydrophobicContact CG-CE2 4.24Å; L484-F486 HydrophobicContact CG-CZ 4.37Å; F486-A490 HydrophobicContact CB-CB 3.59Å; F486-A490 HydrophobicContact CD1-CB 4.27Å; F486-A490 HydrophobicContact CG-CB 4.11Å; F486-A495 HydrophobicContact CD2-CB 4.19Å; F486-A495 HydrophobicContact CE2-CB 3.7Å; F486-A495 HydrophobicContact CZ-CB 3.97Å; F486-A498 HydrophobicContact CE1-CB 3.67Å; F486-A498 HydrophobicContact CZ-CB 3.77Å
487	S	93.1	Very high	92.8	Very high	16 Å²	16	44 Å²	44	11%	0.112	26%	0.263	C	S	.	.			trans	-53.4	148.4	162.1	145	0	0	0	0	111.5	E410 N471 L489 A490	E410-S487 PolarHBondContact O-N 3.43Å; E410-S487 WeakPolarHBondContact OE2-CB 3.47Å; E410-S487 PolarHBondContact OE2-OG 3.46Å; N471-S487 PolarHBondContact ND2-O 2.9Å; S487-L489 PolarHBondContact O-N 3.49Å; S487-L489 PolarHBondContact OG-N 2.96Å; S487-A490 WeakPolarHBondContact O-CB 3.26Å; S487-A490 PolarHBondContact O-N 2.97Å
488	P	91.4	Very high	92.8	Very high	49 Å²	49	42 Å²	42	32%	0.318	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-15.7	-178.7	29.5	-34.3	0	0	0	112.3	R412 E468 A469 N471 A490	R412-P488 VanDerWaalsContact NH2-CD 3.27Å; E468-P488 WeakPolarHBondContact O-CB 3.48Å; A469-P488 WeakPolarHBondContact O-CD 3.49Å; N471-P488 VanDerWaalsContact ND2-C 3.32Å; N471-P488 PolarHBondContact ND2-O 2.92Å; P488-A490 VanDerWaalsContact C-N 3.28Å
489	L	89.4	Confident	93.1	Very high	137 Å²	137	36.3 Å²	36.3	72%	0.717	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-14.2	173.5	-54	179.5	0	0	0	112.8	S487 T491	S487-L489 PolarHBondContact O-N 3.49Å; S487-L489 PolarHBondContact OG-N 2.96Å; L489-T491 PolarHBondContact O-N 3.2Å
490	A	90.4	Very high	93.2	Very high	2 Å²	2	39.4 Å²	39.4	2%	0.017	22%	0.219	C	C	.	.			trans	-69.5	115.9	-176.8	0	0	0	0	0	111.9	E410 Y464 N471 F486 S487 P488	E410-A490 HydrophobicContact CB-CB 3.87Å; E410-A490 HydrophobicContact CG-CB 4.29Å; Y464-A490 PolarHBondContact OH-O 3.21Å; N471-A490 PolarHBondContact ND2-O 2.83Å; F486-A490 HydrophobicContact CB-CB 3.59Å; F486-A490 HydrophobicContact CD1-CB 4.27Å; F486-A490 HydrophobicContact CG-CB 4.11Å; S487-A490 WeakPolarHBondContact O-CB 3.26Å; S487-A490 PolarHBondContact O-N 2.97Å; P488-A490 VanDerWaalsContact C-N 3.28Å
491	T	90.6	Very high	93.3	Very high	77 Å²	77	43.3 Å²	43.3	47%	0.472	24%	0.236	S	C	.	.			trans	-71.4	154.5	176	70	0	0	0	0	111.9	L489 A493 L494 A495	L489-T491 PolarHBondContact O-N 3.2Å; T491-A493 PolarHBondContact O-N 3.33Å; T491-L494 WeakPolarHBondContact O-CA 3.44Å; T491-L494 WeakPolarHBondContact O-CB 3.28Å; T491-L494 PolarHBondContact O-N 3.4Å; T491-L494 PolarHBondContact OG1-N 3.48Å; T491-A495 PolarHBondContact O-N 3.13Å
492	K	91.3	Very high	93.3	Very high	119 Å²	119	43.3 Å²	43.3	52%	0.517	24%	0.236	S	C	.	.	H	α-helix	trans	-52.8	-40.4	174.2	-173	176.3	-179.2	179.5	0	112.4	Y464 A495 Y496	Y464-K492 HydrophobicContact CD1-CB 4.2Å; Y464-K492 HydrophobicContact CD1-CD 3.96Å; Y464-K492 HydrophobicContact CD1-CG 3.85Å; Y464-K492 HydrophobicContact CE1-CB 3.71Å; Y464-K492 HydrophobicContact CE1-CD 4.26Å; Y464-K492 HydrophobicContact CE1-CG 3.89Å; Y464-K492 HydrophobicContact CG-CG 4.21Å; Y464-K492 PolarHBondContact OH-N 2.65Å; K492-A495 PolarHBondContact O-N 3.1Å; K492-Y496 HydrophobicContact CD-CE2 4.4Å; K492-Y496 HydrophobicContact CG-CD2 3.98Å; K492-Y496 HydrophobicContact CG-CE2 3.81Å; K492-Y496 VanDerWaalsContact O-CD2 3.31Å; K492-Y496 WeakPolarHBondContact O-CD2 3.48Å; K492-Y496 PolarHBondContact O-N 2.97Å; K492-Y496 VanDerWaalsContact O-N 3.14Å
493	A	91.5	Very high	93.2	Very high	77 Å²	77	44.5 Å²	44.5	64%	0.636	24%	0.242	S	C	*	.	H	α-helix	trans	-64.1	-42	176.9	0	0	0	0	0	112.2	T491 S497	T491-A493 PolarHBondContact O-N 3.33Å; A493-S497 WeakPolarHBondContact O-CB 3.32Å; A493-S497 PolarHBondContact O-N 2.91Å
494	L	92.1	Very high	93.1	Very high	83 Å²	83	51.1 Å²	51.1	44%	0.435	27%	0.271	S	S	.	.	H	α-helix	trans	-60.4	-45.9	172.7	-94	165.1	0	0	0	111.4	T491 Y496 S497 A498	T491-L494 WeakPolarHBondContact O-CA 3.44Å; T491-L494 WeakPolarHBondContact O-CB 3.28Å; T491-L494 PolarHBondContact O-N 3.4Å; T491-L494 PolarHBondContact OG1-N 3.48Å; L494-Y496 PolarHBondContact O-N 3.09Å; L494-S497 CarbonylContact O-C 3.59Å; L494-S497 WeakPolarHBondContact O-CB 3.49Å; L494-S497 PolarHBondContact O-N 3.32Å; L494-S497 VanDerWaalsContact O-N 3.1Å; L494-S497 PolarHBondContact O-OG 3.26Å; L494-A498 WeakPolarHBondContact O-CB 3.4Å; L494-A498 PolarHBondContact O-N 3.07Å
495	A	92.3	Very high	93.1	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.1	-46.2	-179.4	0	0	0	0	0	112.8	Y464 L473 F486 T491 K492 S497 A498 V499	Y464-A495 HydrophobicContact CD2-CB 4.32Å; Y464-A495 HydrophobicContact CE2-CB 3.77Å; L473-A495 HydrophobicContact CD2-CB 3.94Å; F486-A495 HydrophobicContact CD2-CB 4.19Å; F486-A495 HydrophobicContact CE2-CB 3.7Å; F486-A495 HydrophobicContact CZ-CB 3.97Å; T491-A495 PolarHBondContact O-N 3.13Å; K492-A495 PolarHBondContact O-N 3.1Å; A495-S497 PolarHBondContact O-N 3.4Å; A495-A498 WeakPolarHBondContact O-CB 3.38Å; A495-A498 PolarHBondContact O-N 3.26Å; A495-V499 PolarHBondContact O-N 3.23Å
496	Y	92.2	Very high	93	Very high	75 Å²	75	52.6 Å²	52.6	29%	0.294	28%	0.277	S	S	.	.	H	α-helix	trans	-69.3	-30.5	174.4	-76.1	-77.1	0	0	0	113.1	S462 L473 M475 K492 L494 A498 N500	S462-Y496 PolarHBondContact OG-OH 2.91Å; S462-Y496 VanDerWaalsContact OG-OH 3.06Å; L473-Y496 HydrophobicContact CD1-CE1 4.04Å; L473-Y496 HydrophobicContact CD1-CE2 4.35Å; L473-Y496 HydrophobicContact CD2-CD1 4.44Å; L473-Y496 HydrophobicContact CD2-CE1 4.48Å; M475-Y496 HydrophobicContact CE-CD1 4.29Å; M475-Y496 HydrophobicContact CE-CE1 3.96Å; K492-Y496 HydrophobicContact CD-CE2 4.4Å; K492-Y496 HydrophobicContact CG-CD2 3.98Å; K492-Y496 HydrophobicContact CG-CE2 3.81Å; K492-Y496 VanDerWaalsContact O-CD2 3.31Å; K492-Y496 WeakPolarHBondContact O-CD2 3.48Å; K492-Y496 PolarHBondContact O-N 2.97Å; K492-Y496 VanDerWaalsContact O-N 3.14Å; L494-Y496 PolarHBondContact O-N 3.09Å; Y496-A498 VanDerWaalsContact C-N 3.32Å; Y496-N500 PolarHBondContact O-ND2 3.14Å
497	S	92.8	Very high	92.9	Very high	46 Å²	46	61 Å²	61	32%	0.322	31%	0.309	S	S	.	.	H	α-helix	trans	-67.4	-34.6	171.3	86.6	0	0	0	0	112.2	A493 L494 A495 N500 K501	A493-S497 WeakPolarHBondContact O-CB 3.32Å; A493-S497 PolarHBondContact O-N 2.91Å; L494-S497 CarbonylContact O-C 3.59Å; L494-S497 WeakPolarHBondContact O-CB 3.49Å; L494-S497 PolarHBondContact O-N 3.32Å; L494-S497 VanDerWaalsContact O-N 3.1Å; L494-S497 PolarHBondContact O-OG 3.26Å; A495-S497 PolarHBondContact O-N 3.4Å; S497-N500 PolarHBondContact O-N 2.98Å; S497-K501 PolarHBondContact O-N 2.83Å
498	A	93.7	Very high	92.9	Very high	3 Å²	3	70 Å²	70	3%	0.025	34%	0.34	C	S	.	.	H	α-helix	trans	-67.9	-38.4	-179.9	0	0	0	0	0	111.8	I408 F486 L494 A495 Y496 N500 K501 L502	I408-A498 HydrophobicContact CD1-CB 4.04Å; I408-A498 WeakPolarHBondContact CD1-O 3.26Å; I408-A498 HydrophobicContact CG2-CB 3.79Å; F486-A498 HydrophobicContact CE1-CB 3.67Å; F486-A498 HydrophobicContact CZ-CB 3.77Å; L494-A498 WeakPolarHBondContact O-CB 3.4Å; L494-A498 PolarHBondContact O-N 3.07Å; A495-A498 WeakPolarHBondContact O-CB 3.38Å; A495-A498 PolarHBondContact O-N 3.26Å; Y496-A498 VanDerWaalsContact C-N 3.32Å; A498-N500 VanDerWaalsContact C-N 3.29Å; A498-N500 PolarHBondContact O-N 3.23Å; A498-K501 PolarHBondContact O-N 2.91Å; A498-K501 VanDerWaalsContact O-N 3.09Å; A498-L502 WeakPolarHBondContact O-CB 3.34Å; A498-L502 PolarHBondContact O-N 3.14Å
499	V	94	Very high	93	Very high	6 Å²	6	70.2 Å²	70.2	4%	0.036	34%	0.337	C	S	.	.	H	α-helix	trans	-50.7	-50	171.2	174.8	0	0	0	0	110.9	L473 M475 L482 L484 A495 K501 L502 L503	L473-V499 HydrophobicContact CD2-CG2 3.61Å; M475-V499 HydrophobicContact SD-CG1 4.41Å; L482-V499 HydrophobicContact CD2-CB 4.43Å; L482-V499 HydrophobicContact CD2-CG1 3.92Å; L482-V499 HydrophobicContact CD2-CG2 4.12Å; L484-V499 HydrophobicContact CD1-CG2 3.68Å; A495-V499 PolarHBondContact O-N 3.23Å; V499-K501 VanDerWaalsContact C-N 3.32Å; V499-K501 PolarHBondContact O-N 3.5Å; V499-L502 PolarHBondContact O-N 3.31Å; V499-L503 HydrophobicContact CG1-CD1 3.8Å; V499-L503 HydrophobicContact CG1-CG 4.29Å; V499-L503 WeakPolarHBondContact O-CB 3.45Å; V499-L503 VanDerWaalsContact O-CG 3.31Å; V499-L503 WeakPolarHBondContact O-CG 3.31Å; V499-L503 PolarHBondContact O-N 3.4Å
500	N	93.2	Very high	93.1	Very high	101 Å²	101	66.7 Å²	66.7	54%	0.54	32%	0.316	S	S	.	.	H	α-helix	trans	-66.4	-30.9	-178.8	-72.5	-61	0	0	0	113.5	Y496 S497 A498 K504	Y496-N500 PolarHBondContact O-ND2 3.14Å; S497-N500 PolarHBondContact O-N 2.98Å; A498-N500 VanDerWaalsContact C-N 3.29Å; A498-N500 PolarHBondContact O-N 3.23Å; N500-K504 WeakPolarHBondContact O-CD 3.41Å; N500-K504 VanDerWaalsContact O-CG 3.27Å; N500-K504 WeakPolarHBondContact O-CG 3.42Å; N500-K504 PolarHBondContact O-N 3.01Å
501	K	94.8	Very high	93	Very high	112 Å²	112	71.1 Å²	71.1	49%	0.487	34%	0.34	S	S	.	.	H	α-helix	trans	-73	-47.1	173.8	-70.4	-179.7	178.4	-178.6	0	111.1	I408 S497 A498 V499 K504 W505	I408-K501 HydrophobicContact CD1-CB 3.88Å; I408-K501 HydrophobicContact CG1-CB 4.17Å; I408-K501 HydrophobicContact CG1-CD 4.3Å; S497-K501 PolarHBondContact O-N 2.83Å; A498-K501 PolarHBondContact O-N 2.91Å; A498-K501 VanDerWaalsContact O-N 3.09Å; V499-K501 VanDerWaalsContact C-N 3.32Å; V499-K501 PolarHBondContact O-N 3.5Å; K501-K504 WeakPolarHBondContact O-CB 3.46Å; K501-K504 PolarHBondContact O-N 3.5Å; K501-W505 PolarHBondContact O-N 2.77Å
502	L	95.4	Very high	93.1	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61.8	-47.1	179.3	176.1	62.8	0	0	0	111.3	V406 I408 F414 L482 L484 A498 V499 K504 W505 I506	V406-L502 HydrophobicContact CG1-CB 4.32Å; V406-L502 HydrophobicContact CG1-CD1 3.6Å; V406-L502 HydrophobicContact CG2-CD1 4.28Å; I408-L502 HydrophobicContact CD1-CB 4.08Å; F414-L502 HydrophobicContact CB-CD2 4.34Å; F414-L502 HydrophobicContact CD1-CD1 4.32Å; F414-L502 HydrophobicContact CD1-CD2 4.46Å; F414-L502 HydrophobicContact CD2-CD1 4.25Å; F414-L502 HydrophobicContact CD2-CD2 3.86Å; F414-L502 HydrophobicContact CE1-CD1 3.89Å; F414-L502 HydrophobicContact CE2-CD1 3.82Å; F414-L502 HydrophobicContact CE2-CD2 4.22Å; F414-L502 HydrophobicContact CG-CD1 4.47Å; F414-L502 HydrophobicContact CG-CD2 3.98Å; F414-L502 HydrophobicContact CZ-CD1 3.6Å; L482-L502 HydrophobicContact CD1-CD2 3.59Å; L482-L502 HydrophobicContact CD2-CD2 4.37Å; L484-L502 HydrophobicContact CD2-CD2 3.67Å; A498-L502 WeakPolarHBondContact O-CB 3.34Å; A498-L502 PolarHBondContact O-N 3.14Å; V499-L502 PolarHBondContact O-N 3.31Å; L502-K504 PolarHBondContact O-N 2.68Å; L502-W505 HydrophobicContact CD1-CE3 4.24Å; L502-W505 CarbonylContact O-C 3.57Å; L502-W505 WeakPolarHBondContact O-CA 3.41Å; L502-W505 WeakPolarHBondContact O-CB 3.42Å; L502-W505 PolarHBondContact O-N 3.02Å; L502-I506 HydrophobicContact CD1-CD1 3.86Å; L502-I506 HydrophobicContact CD1-CG1 3.89Å; L502-I506 HydrophobicContact CD2-CD1 4.37Å; L502-I506 HydrophobicContact CG-CD1 3.8Å; L502-I506 HydrophobicContact CG-CG1 4.21Å; L502-I506 WeakPolarHBondContact O-CG1 3.45Å; L502-I506 PolarHBondContact O-N 3.11Å
503	L	94.7	Very high	93.1	Very high	25 Å²	25	65.6 Å²	65.6	13%	0.131	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-33.2	176.9	-68.4	175.1	0	0	0	112.5	Y416 F480 V499 R507	Y416-L503 HydrophobicContact CD2-CD2 4.26Å; Y416-L503 HydrophobicContact CE2-CD2 3.69Å; F480-L503 HydrophobicContact CD2-CD2 4.43Å; F480-L503 HydrophobicContact CE1-CD1 4.22Å; F480-L503 HydrophobicContact CE1-CD2 4.18Å; F480-L503 HydrophobicContact CE2-CD1 4.48Å; F480-L503 HydrophobicContact CE2-CD2 4.09Å; F480-L503 HydrophobicContact CZ-CD1 3.79Å; F480-L503 HydrophobicContact CZ-CD2 3.96Å; V499-L503 HydrophobicContact CG1-CD1 3.8Å; V499-L503 HydrophobicContact CG1-CG 4.29Å; V499-L503 WeakPolarHBondContact O-CB 3.45Å; V499-L503 VanDerWaalsContact O-CG 3.31Å; V499-L503 WeakPolarHBondContact O-CG 3.31Å; V499-L503 PolarHBondContact O-N 3.4Å; L503-R507 WeakPolarHBondContact O-CB 3.16Å; L503-R507 VanDerWaalsContact O-CG 3.24Å; L503-R507 WeakPolarHBondContact O-CG 3.5Å; L503-R507 PolarHBondContact O-N 3.27Å; L503-R507 VanDerWaalsContact O-N 3.12Å
504	K	94.9	Very high	93.1	Very high	142 Å²	142	62.1 Å²	62.1	62%	0.617	28%	0.278	S	S	*	.	H	α-helix	trans	-71.2	-31.5	172.7	-74.9	174.4	-178	-178	0	113	N500 K501 L502 R508	N500-K504 WeakPolarHBondContact O-CD 3.41Å; N500-K504 VanDerWaalsContact O-CG 3.27Å; N500-K504 WeakPolarHBondContact O-CG 3.42Å; N500-K504 PolarHBondContact O-N 3.01Å; K501-K504 WeakPolarHBondContact O-CB 3.46Å; K501-K504 PolarHBondContact O-N 3.5Å; L502-K504 PolarHBondContact O-N 2.68Å; K504-R508 WeakPolarHBondContact O-CD 3.32Å; K504-R508 WeakPolarHBondContact O-CG 3.45Å
505	W	95.7	Very high	93	Very high	30 Å²	30	59 Å²	59	11%	0.114	26%	0.261	C	S	.	.	H	α-helix	trans	-73.1	-48.7	174.4	-178.9	91.9	0	0	0	111	Y401 Q405 V406 F414 K501 L502 R507 R508 E509 L513	Y401-W505 HydrophobicContact CD1-CH2 4.19Å; Y401-W505 AromaticContact CD2-CH2 3.5Å; Y401-W505 HydrophobicContact CD2-CH2 3.5Å; Y401-W505 HydrophobicContact CD2-CZ2 4.09Å; Y401-W505 HydrophobicContact CD2-CZ3 4.34Å; Y401-W505 HydrophobicContact CE1-CH2 4.18Å; Y401-W505 AromaticContact CE2-CH2 3.49Å; Y401-W505 HydrophobicContact CE2-CH2 3.49Å; Y401-W505 VanDerWaalsContact CE2-CH2 3.49Å; Y401-W505 HydrophobicContact CE2-CZ2 4.43Å; Y401-W505 AromaticContact CE2-CZ3 3.88Å; Y401-W505 HydrophobicContact CE2-CZ3 3.88Å; Y401-W505 AromaticContact CG-CH2 3.88Å; Y401-W505 HydrophobicContact CG-CH2 3.88Å; Y401-W505 HydrophobicContact CG-CZ2 4.43Å; Y401-W505 AromaticContact CZ-CH2 3.85Å; Q405-W505 PolarHBondContact O-NE1 2.87Å; Q405-W505 VanDerWaalsContact O-NE1 3.12Å; V406-W505 HydrophobicContact CG1-CB 4.23Å; V406-W505 HydrophobicContact CG1-CD2 4.43Å; V406-W505 HydrophobicContact CG1-CG 4.21Å; V406-W505 HydrophobicContact CG2-CD2 4.11Å; V406-W505 HydrophobicContact CG2-CE3 4.21Å; V406-W505 HydrophobicContact CG2-CZ2 4.47Å; V406-W505 HydrophobicContact CG2-CZ3 4.46Å; F414-W505 HydrophobicContact CZ-CZ3 4.28Å; K501-W505 PolarHBondContact O-N 2.77Å; L502-W505 HydrophobicContact CD1-CE3 4.24Å; L502-W505 CarbonylContact O-C 3.57Å; L502-W505 WeakPolarHBondContact O-CA 3.41Å; L502-W505 WeakPolarHBondContact O-CB 3.42Å; L502-W505 PolarHBondContact O-N 3.02Å; W505-R507 VanDerWaalsContact C-N 3.31Å; W505-R507 PolarHBondContact O-N 3.15Å; W505-R508 WeakPolarHBondContact O-CB 3.42Å; W505-R508 PolarHBondContact O-N 3.38Å; W505-E509 HydrophobicContact CD2-CG 4.44Å; W505-E509 HydrophobicContact CH2-CG 4.3Å; W505-E509 HydrophobicContact CZ2-CG 3.96Å; W505-E509 PolarHBondContact O-N 2.65Å; W505-E509 VanDerWaalsContact O-N 3.16Å; W505-L513 HydrophobicContact CH2-CD1 4.04Å; W505-L513 HydrophobicContact CZ3-CD1 3.8Å
506	I	94.5	Very high	92.6	Very high	2 Å²	2	62.8 Å²	62.8	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-56.8	-44.2	177.6	-66	177.9	0	0	0	110.8	F414 Y416 L502 R508 E509 E510 F514	F414-I506 HydrophobicContact CE2-CD1 4.23Å; Y416-I506 HydrophobicContact CD1-CD1 3.96Å; Y416-I506 HydrophobicContact CD1-CG2 4.22Å; Y416-I506 HydrophobicContact CD2-CD1 3.61Å; Y416-I506 HydrophobicContact CE1-CD1 4.45Å; Y416-I506 HydrophobicContact CE1-CG2 3.91Å; Y416-I506 HydrophobicContact CE2-CD1 4.13Å; Y416-I506 HydrophobicContact CG-CD1 3.49Å; Y416-I506 VanDerWaalsContact CG-CD1 3.49Å; L502-I506 HydrophobicContact CD1-CD1 3.86Å; L502-I506 HydrophobicContact CD1-CG1 3.89Å; L502-I506 HydrophobicContact CD2-CD1 4.37Å; L502-I506 HydrophobicContact CG-CD1 3.8Å; L502-I506 HydrophobicContact CG-CG1 4.21Å; L502-I506 WeakPolarHBondContact O-CG1 3.45Å; L502-I506 PolarHBondContact O-N 3.11Å; I506-R508 PolarHBondContact O-N 3.04Å; I506-E509 CarbonylContact O-C 3.38Å; I506-E509 PolarHBondContact O-N 3.4Å; I506-E510 WeakPolarHBondContact O-CA 3.21Å; I506-E510 WeakPolarHBondContact O-CB 3.4Å; I506-E510 PolarHBondContact O-N 3.22Å; I506-F514 HydrophobicContact CG2-CE2 3.89Å; I506-F514 HydrophobicContact CG2-CZ 4.41Å
507	R	93.3	Very high	92	Very high	180 Å²	180	63.9 Å²	63.9	68%	0.679	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.6	175.5	-75.6	175.9	-175.3	-177	1.8	115	L503 W505	L503-R507 WeakPolarHBondContact O-CB 3.16Å; L503-R507 VanDerWaalsContact O-CG 3.24Å; L503-R507 WeakPolarHBondContact O-CG 3.5Å; L503-R507 PolarHBondContact O-N 3.27Å; L503-R507 VanDerWaalsContact O-N 3.12Å; W505-R507 VanDerWaalsContact C-N 3.31Å; W505-R507 PolarHBondContact O-N 3.15Å
508	R	93.7	Very high	91.4	Very high	203 Å²	203	64 Å²	64	77%	0.766	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-32.8	175.1	-72.1	167.9	176.2	-170.2	-3.1	111.9	K504 W505 I506	K504-R508 WeakPolarHBondContact O-CD 3.32Å; K504-R508 WeakPolarHBondContact O-CG 3.45Å; W505-R508 WeakPolarHBondContact O-CB 3.42Å; W505-R508 PolarHBondContact O-N 3.38Å; I506-R508 PolarHBondContact O-N 3.04Å
509	E	92.5	Very high	91	Very high	54 Å²	54	66.1 Å²	66.1	25%	0.252	31%	0.31	S	S	.	.	S	Bend	trans	-97.2	10.7	177.8	-60.3	-71	131	0	0	112.1	W505 I506 D511 R512 L513	W505-E509 HydrophobicContact CD2-CG 4.44Å; W505-E509 HydrophobicContact CH2-CG 4.3Å; W505-E509 HydrophobicContact CZ2-CG 3.96Å; W505-E509 PolarHBondContact O-N 2.65Å; W505-E509 VanDerWaalsContact O-N 3.16Å; I506-E509 CarbonylContact O-C 3.38Å; I506-E509 PolarHBondContact O-N 3.4Å; E509-D511 PolarHBondContact O-N 3.09Å; E509-R512 WeakPolarHBondContact O-CA 3.25Å; E509-R512 WeakPolarHBondContact O-CB 3.47Å; E509-R512 PolarHBondContact O-N 3.39Å; E509-R512 WeakPolarHBondContact OE2-CD 3.25Å; E509-R512 IonicContact OE2-CZ 3.71Å; E509-R512 IonicContact OE2-NE 3.48Å; E509-R512 IonicContact OE2-NH1 2.78Å; E509-R512 PolarHBondContact OE2-NH1 2.68Å; E509-L513 HydrophobicContact CB-CD1 3.74Å; E509-L513 HydrophobicContact CB-CG 3.94Å; E509-L513 WeakPolarHBondContact O-CG 3.49Å; E509-L513 PolarHBondContact O-N 3.16Å
510	E	91.1	Very high	90.8	Very high	63 Å²	63	68.3 Å²	68.3	29%	0.294	32%	0.324	S	S	.	.	H	α-helix	trans	-61	-47.8	-168.4	-165.1	168.7	178.2	0	0	112.1	I506 R512 L513 F514 L516	I506-E510 WeakPolarHBondContact O-CA 3.21Å; I506-E510 WeakPolarHBondContact O-CB 3.4Å; I506-E510 PolarHBondContact O-N 3.22Å; E510-R512 PolarHBondContact O-N 3.29Å; E510-R512 VanDerWaalsContact O-N 3.16Å; E510-L513 PolarHBondContact O-N 2.71Å; E510-F514 HydrophobicContact CG-CD2 3.89Å; E510-F514 HydrophobicContact CG-CE2 4.47Å; E510-F514 PolarHBondContact O-N 3.38Å; E510-L516 HydrophobicContact CG-CD1 4.34Å; E510-L516 HydrophobicContact CG-CD2 4.2Å
511	D	90.1	Very high	90.3	Very high	96 Å²	96	66.2 Å²	66.2	51%	0.513	31%	0.309	S	S	.	.	H	α-helix	trans	-59.7	-22.8	174	-65.3	-33.5	0	0	0	113.7	E509 L516	E509-D511 PolarHBondContact O-N 3.09Å; D511-L516 WeakPolarHBondContact OD1-CD1 3.37Å
512	R	91.6	Very high	90.1	Very high	79 Å²	79	63.9 Å²	63.9	30%	0.298	30%	0.3	S	S	.	.	H	α-helix	trans	-90.1	-43.5	179.9	-173.8	-169.1	173.7	-164.6	-4.6	111.6	P263 L264 R269 E509 E510	P263-R512 WeakPolarHBondContact CA-O 3.42Å; P263-R512 HydrophobicContact CB-CG 4.17Å; L264-R512 PolarHBondContact N-O 3.11Å; L264-R512 VanDerWaalsContact O-CA 3.32Å; L264-R512 WeakPolarHBondContact O-CA 3.28Å; R269-R512 PolarHBondContact NH2-O 2.83Å; E509-R512 WeakPolarHBondContact O-CA 3.25Å; E509-R512 WeakPolarHBondContact O-CB 3.47Å; E509-R512 PolarHBondContact O-N 3.39Å; E509-R512 WeakPolarHBondContact OE2-CD 3.25Å; E509-R512 IonicContact OE2-CZ 3.71Å; E509-R512 IonicContact OE2-NE 3.48Å; E509-R512 IonicContact OE2-NH1 2.78Å; E509-R512 PolarHBondContact OE2-NH1 2.68Å; E510-R512 PolarHBondContact O-N 3.29Å; E510-R512 VanDerWaalsContact O-N 3.16Å
513	L	90.9	Very high	89.8	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-85.6	-19.5	-172.1	-64.1	177.7	0	0	0	113.7	C261 P263 Y401 T425 W505 E509 E510	C261-L513 WeakPolarHBondContact CB-O 3.49Å; P263-L513 HydrophobicContact CB-CD2 4.16Å; P263-L513 HydrophobicContact CG-CD2 4.12Å; Y401-L513 HydrophobicContact CD1-CD2 3.89Å; Y401-L513 HydrophobicContact CE1-CD1 4.36Å; Y401-L513 HydrophobicContact CE1-CD2 3.65Å; T425-L513 HydrophobicContact CG2-CD1 4.3Å; W505-L513 HydrophobicContact CH2-CD1 4.04Å; W505-L513 HydrophobicContact CZ3-CD1 3.8Å; E509-L513 HydrophobicContact CB-CD1 3.74Å; E509-L513 HydrophobicContact CB-CG 3.94Å; E509-L513 WeakPolarHBondContact O-CG 3.49Å; E509-L513 PolarHBondContact O-N 3.16Å; E510-L513 PolarHBondContact O-N 2.71Å
514	F	92.4	Very high	89.5	Confident	3 Å²	3	69.6 Å²	69.6	1%	0.013	33%	0.326	C	S	.	.	S	Bend	trans	-130	161.3	-175.7	-55.6	-68.7	0	0	0	113.2	Y416 L423 T425 I506 E510 L516	Y416-F514 AromaticContact CD1-CZ 3.73Å; Y416-F514 HydrophobicContact CD1-CZ 3.73Å; Y416-F514 HydrophobicContact CE1-CE2 4.16Å; Y416-F514 AromaticContact CE1-CZ 3.72Å; Y416-F514 HydrophobicContact CE1-CZ 3.72Å; L423-F514 HydrophobicContact CB-CD1 3.71Å; L423-F514 HydrophobicContact CB-CE1 4.26Å; L423-F514 HydrophobicContact CD1-CB 4.17Å; L423-F514 HydrophobicContact CD1-CD1 4.23Å; T425-F514 HydrophobicContact CG2-CE1 4.35Å; T425-F514 HydrophobicContact CG2-CZ 3.76Å; I506-F514 HydrophobicContact CG2-CE2 3.89Å; I506-F514 HydrophobicContact CG2-CZ 4.41Å; E510-F514 HydrophobicContact CG-CD2 3.89Å; E510-F514 HydrophobicContact CG-CE2 4.47Å; E510-F514 PolarHBondContact O-N 3.38Å; F514-L516 HydrophobicContact CB-CD2 3.98Å
515	I	89.2	Confident	89.2	Confident	17 Å²	17	65.4 Å²	65.4	9%	0.087	31%	0.309	C	S	.	.			trans	-99.1	99.9	168	-49.2	-179.4	0	0	0	106.7	L295 L423 P518	L295-I515 HydrophobicContact CD2-CD1 3.76Å; L295-I515 HydrophobicContact CG-CD1 3.91Å; L423-I515 HydrophobicContact CD1-CB 3.97Å; L423-I515 HydrophobicContact CD1-CG1 4.05Å; L423-I515 VanDerWaalsContact CD1-N 3.26Å; I515-P518 HydrophobicContact CG2-CB 4.25Å
516	L	83.7	Confident	88.8	Confident	81 Å²	81	67.6 Å²	67.6	42%	0.424	32%	0.321	S	S	.	.	S	Bend	trans	-81.7	-34.9	-177.3	-57.7	-178.1	0	0	0	112.5	E510 D511 F514	E510-L516 HydrophobicContact CG-CD1 4.34Å; E510-L516 HydrophobicContact CG-CD2 4.2Å; D511-L516 WeakPolarHBondContact OD1-CD1 3.37Å; F514-L516 HydrophobicContact CB-CD2 3.98Å
517	S	79.6	Confident	88.4	Confident	97 Å²	97	71.9 Å²	71.9	68%	0.678	34%	0.341	S	S	*	.	S	Bend	trans	-131.8	79.7	-175.1	-63.9	0	0	0	0	111.1	L519	S517-L519 PolarHBondContact O-N 3.26Å
518	P	79.6	Confident	88.1	Confident	50 Å²	50	64.2 Å²	64.2	33%	0.325	32%	0.317	S	S	.	.			trans	-65.5	131.9	174.8	27.6	-33.8	0	0	0	110.8	I515	I515-P518 HydrophobicContact CG2-CB 4.25Å
519	L	86.3	Confident	87.6	Confident	47 Å²	47	53.5 Å²	53.5	25%	0.246	28%	0.283	C	S	.	.			trans	-75.4	152.6	-179.1	-63	-176	0	0	0	112.4	Q277 V299 R300 S517	Q277-L519 HydrophobicContact CB-CD1 4.46Å; V299-L519 WeakPolarHBondContact CA-O 3.24Å; V299-L519 HydrophobicContact CG2-CB 4.4Å; R300-L519 PolarHBondContact N-O 3.17Å; S517-L519 PolarHBondContact O-N 3.26Å
520	T	89.8	Confident	87.2	Confident	52 Å²	52	53.5 Å²	53.5	32%	0.319	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-119.4	150.9	172.6	60.5	0	0	0	0	112	Q277 R300	Q277-T520 PolarHBondContact NE2-O 3.45Å; R300-T520 HydrophobicContact CG-CG2 4.08Å; R300-T520 CarbonylContact O-C 3.59Å; R300-T520 WeakPolarHBondContact O-CA 3.3Å; R300-T520 WeakPolarHBondContact O-CB 3.39Å
521	Y	82.4	Confident	86.9	Confident	56 Å²	56	52.6 Å²	52.6	22%	0.22	28%	0.284	C	S	.	.			trans	-67.1	0	-179.5	-61.9	-63.4	0	0	0	116.2	K280 L284 S287 V299 R300 K301	K280-Y521 HydrophobicContact CB-CD1 3.65Å; K280-Y521 HydrophobicContact CB-CE1 3.96Å; K280-Y521 HydrophobicContact CB-CG 4.39Å; K280-Y521 HydrophobicContact CD-CD1 4.24Å; K280-Y521 PolarHBondContact NZ-OXT 2.85Å; L284-Y521 HydrophobicContact CD2-CE1 4Å; L284-Y521 HydrophobicContact CD2-CE2 4.33Å; L284-Y521 WeakPolarHBondContact CD2-OH 3.45Å; L284-Y521 HydrophobicContact CG-CE2 4.2Å; S287-Y521 VanDerWaalsContact CB-OH 3.23Å; S287-Y521 WeakPolarHBondContact CB-OH 3.47Å; S287-Y521 PolarHBondContact N-OH 3.04Å; S287-Y521 PolarHBondContact OG-OH 3.05Å; V299-Y521 HydrophobicContact CB-CE1 4.38Å; V299-Y521 HydrophobicContact CG1-CD1 3.87Å; V299-Y521 HydrophobicContact CG1-CE1 3.49Å; V299-Y521 VanDerWaalsContact CG1-CE1 3.49Å; V299-Y521 HydrophobicContact CG1-CE2 4.23Å; V299-Y521 HydrophobicContact CG1-CG 4.38Å; R300-Y521 WeakPolarHBondContact O-CD2 3.39Å; R300-Y521 PolarHBondContact O-N 3.2Å; K301-Y521 HydrophobicContact CB-CD2 4.48Å; K301-Y521 HydrophobicContact CG-CD2 3.89Å

Retrieved 521 of 521 residues in 256.4 ms (Link to these results)

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