A0A096M048_POEFO Loading...

HBS1-like protein

GTPase component of the Pelota-HBS1L complex, a complex that recognizes stalled ribosomes and triggers the No-Go Decay (NGD) pathway. The Pelota-HBS1L complex recognizes ribosomes stalled at the 3' end of an mRNA and engages stalled ribosomes by destabilizing mRNA in the mRNA channel. Following mRNA extraction from stalled ribosomes by the SKI complex, the Pelota-HBS1L complex promotes recruitment of ABCE1, which drives the disassembly of stalled ribosomes, followed by degradation of damaged mRNAs as part of the NGD pathway.

AlphaFold DB , UniProt , Accession A0A096M048, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 704 aa.

Structure Viewer

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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	32.8	Very low	33.3	Very low	249 Å²	249	165.1 Å²	165.1	100%	1.227	79%	0.793	S	S	*	*				0	164.3	0	-82.7	-169.6	-84.1	0	0	109.5
2	S	32.6	Very low	33.3	Very low	86 Å²	86	170.8 Å²	170.8	60%	0.601	80%	0.803	S	S	*	*			trans	-73.2	142.6	-172.7	178.2	0	0	0	0	114.2
3	R	36.8	Very low	33.3	Very low	236 Å²	236	168.4 Å²	168.4	89%	0.891	80%	0.799	S	S	*	*				-173.2	124.7	125	-95.2	151	-173.5	-162.2	0.2	108.2
4	H	33.8	Very low	33.2	Very low	147 Å²	147	169.9 Å²	169.9	68%	0.681	81%	0.806	S	S	*	*				58.2	132.7	52.8	-75.1	-15.6	0	0	0	113
5	R	37.9	Very low	33	Very low	201 Å²	201	163.2 Å²	163.2	76%	0.758	80%	0.799	S	S	*	*			cis	-171.6	148.8	-7.4	-149	178.1	-171.9	172.9	1.2	106.1
6	N	32.3	Very low	32.9	Very low	162 Å²	162	162.6 Å²	162.6	87%	0.866	80%	0.8	S	S	*	*				-170.5	158.4	129	-106.1	-14.8	0	0	0	113.6
7	V	36.6	Very low	33	Very low	126 Å²	126	160.9 Å²	160.9	76%	0.764	80%	0.795	S	S	*	*			trans	-126.1	139.2	-177.4	173	0	0	0	0	108.1
8	R	32.8	Very low	33	Very low	219 Å²	219	164.3 Å²	164.3	83%	0.826	81%	0.805	S	S	*	*			trans	-156.5	116	149.4	-120.9	173.2	-177.9	159.6	1.1	109.5
9	G	30	Very low	33.2	Very low	60 Å²	60	165.2 Å²	165.2	62%	0.619	81%	0.807	S	S	*	*			trans	-102.1	152.4	160.8	0	0	0	0	0	109.3
10	Y	31.3	Very low	33.4	Very low	189 Å²	189	165.1 Å²	165.1	74%	0.741	81%	0.81	S	S	*	*			trans	-130.1	114.6	154	-82.9	-97.9	0	0	0	103.5
11	N	29.8	Very low	33.4	Very low	141 Å²	141	165.2 Å²	165.2	75%	0.754	81%	0.814	S	S	*	*				51.5	91.9	86.7	-81.4	53	0	0	0	111.4
12	Y	33.5	Very low	33.5	Very low	233 Å²	233	160.1 Å²	160.1	91%	0.914	79%	0.792	S	S	*	*			trans	-67.7	145.5	144.7	-87.6	-103.2	0	0	0	108.4
13	D	32.3	Very low	33.6	Very low	140 Å²	140	162.7 Å²	162.7	75%	0.749	80%	0.796	S	S	*	*			trans	-148.5	169.3	158.4	-123.2	-36.4	0	0	0	109.7
14	E	33.1	Very low	33.4	Very low	190 Å²	190	162 Å²	162	89%	0.888	80%	0.795	S	S	*	*			trans	-60.8	153	-160	-56.4	171.7	142.3	0	0	117.6
15	G	29	Very low	33.3	Very low	69 Å²	69	158 Å²	158	71%	0.711	79%	0.793	S	S	*	*			trans	136.1	127.5	133.7	0	0	0	0	0	119.4
16	L	31.5	Very low	33	Very low	154 Å²	154	157.9 Å²	157.9	81%	0.806	80%	0.801	S	S	*	*			trans	70.7	107.8	149	-61.6	164.4	0	0	0	119.8
17	D	35.1	Very low	33.1	Very low	134 Å²	134	155.1 Å²	155.1	72%	0.717	80%	0.795	S	S	*	*				42.9	115.6	118.3	-44.9	-10	0	0	0	119.4
18	F	32.9	Very low	33	Very low	222 Å²	222	155.7 Å²	155.7	97%	0.974	80%	0.798	S	S	*	*			trans	-150	146.1	134.3	-109.2	-75.2	0	0	0	110.4
19	E	37	Very low	33	Very low	181 Å²	181	153.8 Å²	153.8	85%	0.846	80%	0.799	S	S	*	*			trans	-88.1	179.1	-175	-64.5	172.3	128	0	0	112.7
20	D	37.9	Very low	33.1	Very low	162 Å²	162	158.9 Å²	158.9	87%	0.866	81%	0.812	S	S	*	*			trans	-38.9	138.9	-178.2	-51.8	-45.9	0	0	0	116.4
21	D	33.3	Very low	33.3	Very low	169 Å²	169	156.9 Å²	156.9	90%	0.904	81%	0.814	S	S	*	*			trans	-151.5	153.6	135.1	-142.9	-16.8	0	0	0	111.1
22	D	35.2	Very low	33.7	Very low	141 Å²	141	160.3 Å²	160.3	75%	0.754	82%	0.818	S	S	*	*			trans	-101.5	169.5	-162.6	-131.2	-31.7	0	0	0	113.4
23	M	33.6	Very low	34	Very low	141 Å²	141	155.3 Å²	155.3	70%	0.695	82%	0.816	S	S	*	*			trans	60.3	99.4	149.3	-159	-168.1	-46.3	0	0	119.8
24	Y	33.4	Very low	34.4	Very low	221 Å²	221	155.1 Å²	155.1	87%	0.867	81%	0.813	S	S	*	*				178.1	141.6	109.9	-111.7	-78.8	0	0	0	114.8
25	G	31.4	Very low	34.6	Very low	62 Å²	62	149.7 Å²	149.7	64%	0.639	80%	0.796	S	S	*	*			trans	91.8	92	132.1	0	0	0	0	0	119.5
26	Q	31.3	Very low	35.1	Very low	199 Å²	199	152 Å²	152	93%	0.93	80%	0.799	S	S	*	*			trans	-144.8	144.3	136.6	-117.9	158.4	61.3	0	0	110.4
27	S	33.8	Very low	35.8	Very low	104 Å²	104	148.7 Å²	148.7	73%	0.727	79%	0.793	S	S	*	*			trans	-136.2	159.8	175.6	-65.9	0	0	0	0	108.1
28	V	35.3	Very low	36.5	Very low	139 Å²	139	145.6 Å²	145.6	84%	0.842	78%	0.779	S	S	*	*			trans	65.8	145	-176.5	-45.4	0	0	0	0	113.9
29	E	32.9	Very low	36.8	Very low	178 Å²	178	138 Å²	138	83%	0.832	76%	0.758	S	S	*	*			cis	-129.3	151.3	9.6	-67.4	170.9	159.9	0	0	111.2
30	D	31.8	Very low	36.9	Very low	168 Å²	168	136 Å²	136	90%	0.898	75%	0.753	S	S	*	*			trans	-166.3	130.7	138.4	-113.3	-24.5	0	0	0	110.1
31	D	36.2	Very low	37.2	Very low	147 Å²	147	135.7 Å²	135.7	79%	0.786	75%	0.746	S	S	*	*			trans	-94.5	127.3	-169.1	-100	-42.5	0	0	0	113.2
32	Y	38.4	Very low	37.5	Very low	213 Å²	213	136.1 Å²	136.1	84%	0.835	74%	0.74	S	S	*	*			trans	-133.3	99.8	162.9	-94	-85.8	0	0	0	111.8	I34	Y32-I34 PolarHBondContact O-N 2.85Å; Y32-I34 VanDerWaalsContact O-N 3.08Å
33	C	39.4	Very low	37.8	Very low	128 Å²	128	136.1 Å²	136.1	87%	0.865	74%	0.739	S	S	*	*			trans	-74.1	95.7	178.9	-57.1	0	0	0	0	112.4
34	I	39.3	Very low	37.8	Very low	136 Å²	136	140.4 Å²	140.4	70%	0.697	75%	0.749	S	S	*	*			trans	-93.5	137.3	170.1	-56.7	178.1	0	0	0	109.7	Y32	Y32-I34 PolarHBondContact O-N 2.85Å; Y32-I34 VanDerWaalsContact O-N 3.08Å
35	S	37.2	Very low	37.9	Very low	75 Å²	75	134.5 Å²	134.5	52%	0.524	74%	0.74	S	S	.	*			trans	-72.1	149.7	-174.1	72.4	0	0	0	0	113.4	A37 T38	S35-A37 PolarHBondContact O-N 2.92Å; S35-T38 PolarHBondContact O-N 3.34Å
36	P	40.7	Very low	38	Very low	118 Å²	118	143.6 Å²	143.6	77%	0.766	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-10.4	-169.8	-26.4	35.9	0	0	0	117.1
37	A	45.4	Very low	38.1	Very low	84 Å²	84	144.7 Å²	144.7	69%	0.694	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-32.7	-179	0	0	0	0	0	113.1	S35	S35-A37 PolarHBondContact O-N 2.92Å
38	T	49.6	Very low	38.1	Very low	69 Å²	69	149 Å²	149	42%	0.423	76%	0.759	S	S	.	*	S	Bend	trans	-81.4	-23.5	-172	-42.9	0	0	0	0	113.2	S35 N40 Q41	S35-T38 PolarHBondContact O-N 3.34Å; T38-N40 VanDerWaalsContact C-N 3.27Å; T38-N40 PolarHBondContact O-N 2.95Å; T38-Q41 PolarHBondContact O-N 3.07Å
39	A	39.3	Very low	38	Very low	63 Å²	63	154.4 Å²	154.4	52%	0.521	77%	0.765	S	S	.	*	G	3₁₀ helix	trans	-64.1	-27	-173.8	0	0	0	0	0	114.1	Q41 F42	A39-Q41 PolarHBondContact O-N 2.86Å; A39-F42 PolarHBondContact O-N 2.74Å
40	N	39.4	Very low	37.8	Very low	138 Å²	138	155.2 Å²	155.2	74%	0.738	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-74.5	-3.2	-175.7	-80.4	-15	0	0	0	115	T38	T38-N40 VanDerWaalsContact C-N 3.27Å; T38-N40 PolarHBondContact O-N 2.95Å
41	Q	43.9	Very low	38.1	Very low	156 Å²	156	151.7 Å²	151.7	73%	0.729	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-90.3	-10	175.7	-72.4	-175.9	-33	0	0	114.1	T38 A39	T38-Q41 PolarHBondContact O-N 3.07Å; A39-Q41 PolarHBondContact O-N 2.86Å
42	F	39.6	Very low	38.2	Very low	179 Å²	179	150.2 Å²	150.2	79%	0.785	76%	0.761	S	S	*	*	S	Bend	trans	-120.4	27.7	-170	-72.3	-81.2	0	0	0	115	A39	A39-F42 PolarHBondContact O-N 2.74Å
43	I	41	Very low	37.7	Very low	141 Å²	141	149.9 Å²	149.9	72%	0.723	76%	0.764	S	S	*	*			trans	-111.9	92.4	171.5	-55.2	179.6	0	0	0	109.6
44	Y	35	Very low	37.7	Very low	230 Å²	230	152.7 Å²	152.7	90%	0.902	76%	0.764	S	S	*	*			trans	-95.3	127.8	172.7	-123.3	-86.3	0	0	0	111.7
45	S	34.1	Very low	37.2	Very low	97 Å²	97	155.2 Å²	155.2	68%	0.678	77%	0.773	S	S	*	*			trans	-88.1	135.9	-173.1	-168.9	0	0	0	0	112.3	R47	S45-R47 PolarHBondContact O-N 2.73Å
46	R	33.5	Very low	37	Very low	253 Å²	253	157.7 Å²	157.7	96%	0.955	79%	0.787	S	S	*	*	S	Bend	trans	-79.5	47.7	-173.7	-160.6	-170.9	-73.6	-172.8	-4.2	113.2
47	R	33.7	Very low	36.5	Very low	223 Å²	223	160.2 Å²	160.2	84%	0.842	79%	0.793	S	S	*	*			trans	-144.1	57	-177.4	-76.2	-167.7	176	170.9	0	114.4	S45	S45-R47 PolarHBondContact O-N 2.73Å
48	E	35.3	Very low	35.7	Very low	195 Å²	195	165.4 Å²	165.4	91%	0.911	80%	0.803	S	S	*	*			trans	-162.7	121.5	145.6	-111.1	149.2	-143.2	0	0	109.7
49	R	31.4	Very low	34.8	Very low	252 Å²	252	170.6 Å²	170.6	95%	0.951	82%	0.823	S	S	*	*			trans	-153.5	116.2	172.5	-116.1	-170.2	-179.4	-161.1	-0.9	109
50	Q	29.9	Very low	34.3	Very low	195 Å²	195	176.9 Å²	176.9	91%	0.911	84%	0.841	S	S	*	*			trans	-110	145.2	146.2	-74.3	-174.4	-19.5	0	0	106.8
51	A	37.7	Very low	33.8	Very low	93 Å²	93	179.1 Å²	179.1	77%	0.769	85%	0.847	S	S	*	*			trans	-84.3	159	177.8	0	0	0	0	0	110.3
52	P	37.4	Very low	33.1	Very low	117 Å²	117	182.2 Å²	182.2	76%	0.76	85%	0.854	S	S	*	*				-144.8	147.6	94.4	37.6	-23.5	0	0	0	116.5
53	K	28.8	Very low	32.7	Very low	205 Å²	205	183.1 Å²	183.1	89%	0.891	86%	0.86	S	S	*	*			trans	61.7	163.8	148.7	-71.8	-171.6	170.7	-171	0	120
54	E	40	Very low	32.2	Very low	188 Å²	188	184 Å²	184	88%	0.879	87%	0.867	S	S	*	*			trans	-112.3	137.4	-169	-61.5	151.1	131.9	0	0	109.7
55	E	29	Very low	31.9	Very low	189 Å²	189	182 Å²	182	88%	0.883	87%	0.866	S	S	*	*			trans	-127.3	144.5	160.3	-71.3	-179.5	146.2	0	0	107.3
56	P	32.1	Very low	31.6	Very low	126 Å²	126	185.1 Å²	185.1	82%	0.818	88%	0.875	S	S	*	*	P	Polyproline II helix	trans	-73.7	161.3	178.8	32.2	-34.8	0	0	0	111.6
57	L	30.3	Very low	31.7	Very low	172 Å²	172	178.8 Å²	178.8	90%	0.901	86%	0.864	S	S	*	*	P	Polyproline II helix	trans	-66.9	138.6	-177.4	-67.3	156.1	0	0	0	111.8
58	E	29.5	Very low	31.5	Very low	192 Å²	192	174 Å²	174	90%	0.897	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-79.7	135.8	161.1	-65	176.7	139.2	0	0	108.8
59	E	29.5	Very low	31.1	Very low	179 Å²	179	172.8 Å²	172.8	84%	0.836	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-98.6	125.5	168.7	-64.9	-176.1	142	0	0	107.5	E61	E59-E61 PolarHBondContact O-N 3.4Å
60	E	29.1	Very low	31.2	Very low	195 Å²	195	163.9 Å²	163.9	91%	0.911	83%	0.834	S	S	*	*			trans	-74.6	87.7	179.9	-68.7	-177.9	152.9	0	0	110.2
61	E	28.5	Very low	31.4	Very low	184 Å²	184	160.4 Å²	160.4	86%	0.86	83%	0.829	S	S	*	*			trans	-68.6	152.2	164.9	-70.1	-166.6	129.5	0	0	111	E59	E59-E61 PolarHBondContact O-N 3.4Å
62	Y	30.6	Very low	31.3	Very low	222 Å²	222	160.6 Å²	160.6	87%	0.871	82%	0.823	S	S	*	*			trans	-78.3	145.4	-174.4	-74.9	-112.4	0	0	0	111.4	D64	Y62-D64 PolarHBondContact O-N 3.43Å
63	E	30.4	Very low	31.5	Very low	197 Å²	197	159.4 Å²	159.4	92%	0.921	81%	0.814	S	S	*	*			trans	-67.2	97	170.5	-63.8	-178.9	139.4	0	0	110.5
64	D	29.6	Very low	32.1	Very low	161 Å²	161	157.2 Å²	157.2	86%	0.861	81%	0.812	S	S	*	*			trans	-68.8	136.1	163.4	-102.1	-31.4	0	0	0	109.7	Y62 D66	Y62-D64 PolarHBondContact O-N 3.43Å; D64-D66 PolarHBondContact O-N 2.82Å
65	E	29.5	Very low	32.8	Very low	187 Å²	187	153 Å²	153	87%	0.874	79%	0.791	S	S	*	*			trans	-67.7	122.5	-179.6	-70.6	-168.3	138.1	0	0	111.7	V67	E65-V67 PolarHBondContact O-N 2.72Å
66	D	28.4	Very low	33.9	Very low	163 Å²	163	152.3 Å²	152.3	87%	0.872	79%	0.793	S	S	*	*			trans	-53.7	101.2	174.7	-95.9	-45.2	0	0	0	112.1	D64	D64-D66 PolarHBondContact O-N 2.82Å
67	V	34.7	Very low	35.5	Very low	120 Å²	120	149.1 Å²	149.1	73%	0.727	77%	0.769	S	S	*	*			trans	-62.8	126.2	161.7	-179.6	0	0	0	0	107.2	E65 M69	E65-V67 PolarHBondContact O-N 2.72Å; V67-M69 VanDerWaalsContact C-N 3.35Å; V67-M69 PolarHBondContact O-N 3.11Å
68	P	28.8	Very low	37.6	Very low	122 Å²	122	145.7 Å²	145.7	79%	0.792	75%	0.751	S	S	*	*			trans	-70.4	87.2	-170.9	27.4	-35.8	0	0	0	112.2	S70	P68-S70 PolarHBondContact O-N 3.21Å
69	M	28.2	Very low	39.8	Very low	169 Å²	169	140.9 Å²	140.9	83%	0.833	74%	0.737	S	S	*	*			trans	-58.9	126.6	170	-80.2	-93.2	-102.7	0	0	110.2	V67	V67-M69 VanDerWaalsContact C-N 3.35Å; V67-M69 PolarHBondContact O-N 3.11Å
70	S	32.2	Very low	42.2	Very low	65 Å²	65	137.7 Å²	137.7	46%	0.455	73%	0.725	S	S	.	*			trans	-50.4	138.5	168.9	-66.2	0	0	0	0	110.3	P68 C72 D102	P68-S70 PolarHBondContact O-N 3.21Å; S70-C72 PolarHBondContact O-N 2.85Å; S70-D102 WeakPolarHBondContact CB-OD2 3.37Å; S70-D102 PolarHBondContact OG-OD2 2.87Å
71	P	35.1	Very low	44.5	Very low	123 Å²	123	130.7 Å²	130.7	80%	0.799	69%	0.694	S	S	*	*			trans	-65.3	103.7	-175.8	26.1	-34.5	0	0	0	111.2	V73	P71-V73 PolarHBondContact O-N 2.8Å
72	C	35.3	Very low	47	Very low	96 Å²	96	126.4 Å²	126.4	65%	0.649	67%	0.674	S	S	*	*			trans	-62.5	129.1	172	-66.4	0	0	0	0	109.8	S70	S70-C72 PolarHBondContact O-N 2.85Å
73	V	41.6	Very low	49.3	Very low	93 Å²	93	118.7 Å²	118.7	56%	0.564	66%	0.656	S	S	*	*			trans	-83.2	119.6	174.8	-179.2	0	0	0	0	108.3	P71 F75	P71-V73 PolarHBondContact O-N 2.8Å; V73-F75 HydrophobicContact CB-CD2 4.23Å; V73-F75 HydrophobicContact CB-CE2 3.76Å; V73-F75 HydrophobicContact CG1-CD2 4.08Å; V73-F75 HydrophobicContact CG1-CE2 3.49Å; V73-F75 VanDerWaalsContact CG1-CE2 3.49Å; V73-F75 HydrophobicContact CG1-CZ 3.8Å; V73-F75 VanDerWaalsContact O-CD2 3.22Å; V73-F75 WeakPolarHBondContact O-CD2 3.23Å; V73-F75 PolarHBondContact O-N 2.98Å
74	D	40.8	Very low	51.7	Low	158 Å²	158	113.7 Å²	113.7	85%	0.845	63%	0.631	S	S	*	*			trans	-62.6	103.4	-179.9	-78.1	-48	0	0	0	112.3
75	F	54.5	Low	54.3	Low	101 Å²	101	106.7 Å²	106.7	44%	0.443	59%	0.594	S	S	.	*			trans	-112.7	114.4	164.7	-65.8	-77.5	0	0	0	108.6	V73 L77 T106 M110	V73-F75 HydrophobicContact CB-CD2 4.23Å; V73-F75 HydrophobicContact CB-CE2 3.76Å; V73-F75 HydrophobicContact CG1-CD2 4.08Å; V73-F75 HydrophobicContact CG1-CE2 3.49Å; V73-F75 VanDerWaalsContact CG1-CE2 3.49Å; V73-F75 HydrophobicContact CG1-CZ 3.8Å; V73-F75 VanDerWaalsContact O-CD2 3.22Å; V73-F75 WeakPolarHBondContact O-CD2 3.23Å; V73-F75 PolarHBondContact O-N 2.98Å; F75-L77 VanDerWaalsContact C-N 3.32Å; F75-L77 HydrophobicContact CB-CD1 4.31Å; F75-L77 HydrophobicContact CB-CG 4.18Å; F75-L77 PolarHBondContact O-N 2.73Å; F75-T106 HydrophobicContact CE2-CG2 4.35Å; F75-M110 HydrophobicContact CB-CE 3.86Å; F75-M110 HydrophobicContact CD1-CE 4.39Å; F75-M110 HydrophobicContact CD2-CE 3.4Å; F75-M110 HydrophobicContact CD2-SD 4.36Å; F75-M110 HydrophobicContact CE2-CE 3.97Å; F75-M110 HydrophobicContact CG-CE 3.63Å; F75-M110 HydrophobicContact CG-SD 4.31Å
76	N	52.9	Low	57	Low	173 Å²	173	102.3 Å²	102.3	93%	0.925	57%	0.572	S	S	*	*			trans	-64.3	91.3	173.5	-90.1	-81.3	0	0	0	109.9
77	L	65.9	Low	59.8	Low	60 Å²	60	98.5 Å²	98.5	31%	0.314	56%	0.558	S	S	.	*			trans	-116	143.4	179	-70.4	176.6	0	0	0	110.1	F75 L85 M110 F114	F75-L77 VanDerWaalsContact C-N 3.32Å; F75-L77 HydrophobicContact CB-CD1 4.31Å; F75-L77 HydrophobicContact CB-CG 4.18Å; F75-L77 PolarHBondContact O-N 2.73Å; L77-L85 HydrophobicContact CD1-CD2 4.24Å; L77-M110 HydrophobicContact CD1-CE 3.66Å; L77-M110 HydrophobicContact CD1-SD 4.43Å; L77-F114 HydrophobicContact CD1-CZ 4.45Å
78	D	74.9	Confident	62.2	Low	99 Å²	99	93 Å²	93	53%	0.529	53%	0.525	S	S	.	.			trans	-55.9	138	172.2	-180	72.1	0	0	0	110.9	L80 N81 Q82	D78-L80 PolarHBondContact O-N 2.95Å; D78-L80 PolarHBondContact OD2-N 3.04Å; D78-N81 WeakPolarHBondContact O-CA 3.24Å; D78-N81 PolarHBondContact O-N 3.22Å; D78-Q82 PolarHBondContact O-N 2.68Å
79	P	76.3	Confident	64.9	Low	92 Å²	92	87.6 Å²	87.6	60%	0.597	49%	0.489	S	S	*	.	H	α-helix	trans	-56	-31.7	-170.5	-29.4	36.3	0	0	0	114.7	N81 Q82 A83	P79-N81 VanDerWaalsContact C-N 3.27Å; P79-N81 PolarHBondContact O-N 2.77Å; P79-Q82 PolarHBondContact O-N 3.32Å; P79-A83 PolarHBondContact O-N 2.94Å
80	L	78.1	Confident	67.6	Low	111 Å²	111	83.7 Å²	83.7	58%	0.581	47%	0.472	S	S	*	.	H	α-helix	trans	-67.3	-27.9	176.6	-177.7	62.1	0	0	0	112.6	D78 K84	D78-L80 PolarHBondContact O-N 2.95Å; D78-L80 PolarHBondContact OD2-N 3.04Å; L80-K84 WeakPolarHBondContact O-CD 3.41Å; L80-K84 WeakPolarHBondContact O-CE 3.45Å; L80-K84 VanDerWaalsContact O-CG 3.31Å; L80-K84 WeakPolarHBondContact O-CG 3.43Å
81	N	77.3	Confident	70.1	Confident	49 Å²	49	86.5 Å²	86.5	26%	0.262	48%	0.477	S	S	.	.	H	α-helix	trans	-88.3	-30.8	176.1	-63.2	-35.7	0	0	0	111.8	D78 P79 K84 L85 F114	D78-N81 WeakPolarHBondContact O-CA 3.24Å; D78-N81 PolarHBondContact O-N 3.22Å; P79-N81 VanDerWaalsContact C-N 3.27Å; P79-N81 PolarHBondContact O-N 2.77Å; N81-K84 PolarHBondContact O-N 3.36Å; N81-K84 PolarHBondContact OD1-NZ 3.43Å; N81-L85 WeakPolarHBondContact O-CB 3.44Å; N81-L85 PolarHBondContact O-N 2.99Å; N81-F114 HydrophobicContact CB-CE2 3.98Å; N81-F114 HydrophobicContact CB-CZ 4.19Å
82	Q	81.4	Confident	72.3	Confident	93 Å²	93	80.7 Å²	80.7	44%	0.435	44%	0.44	S	S	.	.	H	α-helix	trans	-60.8	-44.6	169.6	-168.8	-179.4	15.5	0	0	111.4	D78 P79 K84 L85 F86	D78-Q82 PolarHBondContact O-N 2.68Å; P79-Q82 PolarHBondContact O-N 3.32Å; Q82-K84 PolarHBondContact O-N 2.91Å; Q82-L85 WeakPolarHBondContact O-CB 3.33Å; Q82-L85 PolarHBondContact O-N 2.82Å; Q82-F86 HydrophobicContact CG-CD2 4.17Å; Q82-F86 HydrophobicContact CG-CE2 3.68Å; Q82-F86 VanDerWaalsContact O-CD2 3.31Å; Q82-F86 WeakPolarHBondContact O-CD2 3.41Å; Q82-F86 PolarHBondContact O-N 2.85Å; Q82-F86 VanDerWaalsContact O-N 3.13Å
83	A	79.6	Confident	74.7	Confident	60 Å²	60	80.7 Å²	80.7	50%	0.496	43%	0.426	S	S	.	.	H	α-helix	trans	-62.1	-38.3	175	0	0	0	0	0	113.3	P79 S87	P79-A83 PolarHBondContact O-N 2.94Å; A83-S87 WeakPolarHBondContact O-CB 3.44Å; A83-S87 PolarHBondContact O-N 3.46Å; A83-S87 VanDerWaalsContact O-N 3.13Å
84	K	80.6	Confident	76.7	Confident	92 Å²	92	80.4 Å²	80.4	40%	0.4	43%	0.433	S	S	.	.	H	α-helix	trans	-67.2	-38	174	-69.5	168.5	-163	160.5	0	112.3	L80 N81 Q82 S87 C88 F114	L80-K84 WeakPolarHBondContact O-CD 3.41Å; L80-K84 WeakPolarHBondContact O-CE 3.45Å; L80-K84 VanDerWaalsContact O-CG 3.31Å; L80-K84 WeakPolarHBondContact O-CG 3.43Å; N81-K84 PolarHBondContact O-N 3.36Å; N81-K84 PolarHBondContact OD1-NZ 3.43Å; Q82-K84 PolarHBondContact O-N 2.91Å; K84-S87 PolarHBondContact O-N 3.02Å; K84-C88 VanDerWaalsContact O-CB 3.25Å; K84-C88 WeakPolarHBondContact O-CB 3.44Å; K84-C88 PolarHBondContact O-N 3.03Å; K84-F114 HydrophobicContact CB-CB 4.02Å; K84-F114 HydrophobicContact CB-CD2 4.3Å; K84-F114 HydrophobicContact CB-CG 4.11Å; K84-F114 HydrophobicContact CD-CD2 4.5Å
85	L	85.2	Confident	78.7	Confident	14 Å²	14	77.4 Å²	77.4	7%	0.073	42%	0.421	C	S	.	.	H	α-helix	trans	-61	-50.1	177.2	177.2	59.2	0	0	0	111	L77 N81 Q82 C88 L89 T106 A109 M110 F114	L77-L85 HydrophobicContact CD1-CD2 4.24Å; N81-L85 WeakPolarHBondContact O-CB 3.44Å; N81-L85 PolarHBondContact O-N 2.99Å; Q82-L85 WeakPolarHBondContact O-CB 3.33Å; Q82-L85 PolarHBondContact O-N 2.82Å; L85-C88 WeakPolarHBondContact O-CB 3.43Å; L85-C88 PolarHBondContact O-N 3.47Å; L85-L89 HydrophobicContact CD1-CD1 3.95Å; L85-L89 HydrophobicContact CD1-CG 4.05Å; L85-L89 HydrophobicContact CG-CD1 3.95Å; L85-L89 HydrophobicContact CG-CG 4.45Å; L85-L89 WeakPolarHBondContact O-CB 3.43Å; L85-L89 VanDerWaalsContact O-CG 3.32Å; L85-L89 WeakPolarHBondContact O-CG 3.49Å; L85-L89 PolarHBondContact O-N 3.08Å; L85-T106 HydrophobicContact CD1-CG2 4.47Å; L85-T106 HydrophobicContact CD2-CG2 4.39Å; L85-A109 HydrophobicContact CD1-CB 3.64Å; L85-M110 HydrophobicContact CD2-CE 3.79Å; L85-F114 HydrophobicContact CB-CD1 3.88Å; L85-F114 HydrophobicContact CB-CE1 3.77Å; L85-F114 HydrophobicContact CD1-CD1 4.02Å; L85-F114 HydrophobicContact CD1-CE1 3.98Å; L85-F114 HydrophobicContact CG-CE1 4.32Å
86	F	86	Confident	79.8	Confident	95 Å²	95	74.1 Å²	74.1	42%	0.417	41%	0.407	S	S	.	.	H	α-helix	trans	-61.2	-47	176.8	-69.5	-56.2	0	0	0	112.2	Q82 C88 L89 D90	Q82-F86 HydrophobicContact CG-CD2 4.17Å; Q82-F86 HydrophobicContact CG-CE2 3.68Å; Q82-F86 VanDerWaalsContact O-CD2 3.31Å; Q82-F86 WeakPolarHBondContact O-CD2 3.41Å; Q82-F86 PolarHBondContact O-N 2.85Å; Q82-F86 VanDerWaalsContact O-N 3.13Å; F86-C88 PolarHBondContact O-N 2.81Å; F86-L89 PolarHBondContact O-N 2.98Å; F86-L89 VanDerWaalsContact O-N 3.13Å; F86-D90 PolarHBondContact O-N 2.93Å
87	S	85.9	Confident	80.9	Confident	84 Å²	84	67.5 Å²	67.5	59%	0.587	38%	0.38	S	S	*	.	H	α-helix	trans	-58.9	-34	176.4	-173.9	0	0	0	0	113.5	A83 K84 H91	A83-S87 WeakPolarHBondContact O-CB 3.44Å; A83-S87 PolarHBondContact O-N 3.46Å; A83-S87 VanDerWaalsContact O-N 3.13Å; K84-S87 PolarHBondContact O-N 3.02Å; S87-H91 PolarHBondContact O-N 3.32Å
88	C	85.4	Confident	81.3	Confident	4 Å²	4	72.9 Å²	72.9	3%	0.027	41%	0.409	C	S	.	.	H	α-helix	trans	-72.2	-47	173.4	-177.1	0	0	0	0	112	K84 L85 F86 D90 H91 M92 F114 P116	K84-C88 VanDerWaalsContact O-CB 3.25Å; K84-C88 WeakPolarHBondContact O-CB 3.44Å; K84-C88 PolarHBondContact O-N 3.03Å; L85-C88 WeakPolarHBondContact O-CB 3.43Å; L85-C88 PolarHBondContact O-N 3.47Å; F86-C88 PolarHBondContact O-N 2.81Å; C88-D90 PolarHBondContact O-N 2.9Å; C88-H91 WeakPolarHBondContact O-CB 3.36Å; C88-H91 PolarHBondContact O-N 2.95Å; C88-M92 WeakPolarHBondContact O-CG 3.39Å; C88-M92 PolarHBondContact O-N 2.86Å; C88-F114 HydrophobicContact CB-CB 4.49Å; C88-P116 VanDerWaalsContact SG-CA 3.57Å
89	L	85.6	Confident	81.3	Confident	8 Å²	8	72.3 Å²	72.3	4%	0.042	42%	0.418	C	S	.	.	H	α-helix	trans	-61.1	-43.3	179.9	-74.4	172.9	0	0	0	112.5	L85 F86 H91 M92 R93 L105	L85-L89 HydrophobicContact CD1-CD1 3.95Å; L85-L89 HydrophobicContact CD1-CG 4.05Å; L85-L89 HydrophobicContact CG-CD1 3.95Å; L85-L89 HydrophobicContact CG-CG 4.45Å; L85-L89 WeakPolarHBondContact O-CB 3.43Å; L85-L89 VanDerWaalsContact O-CG 3.32Å; L85-L89 WeakPolarHBondContact O-CG 3.49Å; L85-L89 PolarHBondContact O-N 3.08Å; F86-L89 PolarHBondContact O-N 2.98Å; F86-L89 VanDerWaalsContact O-N 3.13Å; L89-H91 VanDerWaalsContact C-N 3.28Å; L89-H91 PolarHBondContact O-N 2.89Å; L89-M92 PolarHBondContact O-N 3.5Å; L89-M92 VanDerWaalsContact O-N 3.14Å; L89-R93 WeakPolarHBondContact O-CB 3.48Å; L89-R93 VanDerWaalsContact O-CG 3.31Å; L89-R93 WeakPolarHBondContact O-CG 3.32Å; L89-R93 PolarHBondContact O-N 3.33Å; L89-L105 HydrophobicContact CD2-CB 3.57Å
90	D	85.6	Confident	81.4	Confident	88 Å²	88	68.8 Å²	68.8	47%	0.471	39%	0.394	S	S	.	.	H	α-helix	trans	-65	-34.8	177.5	-68.1	-23	0	0	0	111.7	F86 C88 R93 A94	F86-D90 PolarHBondContact O-N 2.93Å; C88-D90 PolarHBondContact O-N 2.9Å; D90-R93 PolarHBondContact O-N 2.89Å; D90-R93 IonicContact OD1-NH1 3.36Å; D90-R93 PolarHBondContact OD1-NH1 3.36Å; D90-A94 WeakPolarHBondContact O-CB 3.33Å; D90-A94 PolarHBondContact O-N 2.66Å
91	H	83.7	Confident	81.6	Confident	123 Å²	123	67.4 Å²	67.4	57%	0.569	39%	0.392	S	S	*	.	H	α-helix	trans	-67.7	-33.7	173.6	-138.3	105.1	0	0	0	112.7	S87 C88 L89 P116	S87-H91 PolarHBondContact O-N 3.32Å; C88-H91 WeakPolarHBondContact O-CB 3.36Å; C88-H91 PolarHBondContact O-N 2.95Å; L89-H91 VanDerWaalsContact C-N 3.28Å; L89-H91 PolarHBondContact O-N 2.89Å; H91-P116 HydrophobicContact CB-CB 4.03Å
92	M	82.6	Confident	81.5	Confident	1 Å²	1	67 Å²	67	1%	0.005	39%	0.39	C	S	.	.	H	α-helix	trans	-73.8	-44.1	174.4	-65.7	176.6	78	0	0	111.4	C88 L89 A94 V95 L96 L105 A108 A119 V123	C88-M92 WeakPolarHBondContact O-CG 3.39Å; C88-M92 PolarHBondContact O-N 2.86Å; L89-M92 PolarHBondContact O-N 3.5Å; L89-M92 VanDerWaalsContact O-N 3.14Å; M92-A94 VanDerWaalsContact C-N 3.32Å; M92-A94 PolarHBondContact O-N 2.68Å; M92-V95 PolarHBondContact O-N 3.13Å; M92-V95 VanDerWaalsContact O-N 3.09Å; M92-L96 PolarHBondContact O-N 3.26Å; M92-L105 HydrophobicContact CE-CD2 3.92Å; M92-A108 HydrophobicContact CE-CB 4.41Å; M92-A119 HydrophobicContact CE-CB 3.73Å; M92-A119 HydrophobicContact SD-CB 3.64Å; M92-V123 HydrophobicContact CE-CG2 3.81Å
93	R	84.4	Confident	81.4	Confident	97 Å²	97	65.7 Å²	65.7	37%	0.366	39%	0.391	S	S	.	.	H	α-helix	trans	-59.7	-39.5	175.6	-74.2	165.5	168.3	-177.2	-13.4	112.1	L89 D90 V95 G97 D102 L105	L89-R93 WeakPolarHBondContact O-CB 3.48Å; L89-R93 VanDerWaalsContact O-CG 3.31Å; L89-R93 WeakPolarHBondContact O-CG 3.32Å; L89-R93 PolarHBondContact O-N 3.33Å; D90-R93 PolarHBondContact O-N 2.89Å; D90-R93 IonicContact OD1-NH1 3.36Å; D90-R93 PolarHBondContact OD1-NH1 3.36Å; R93-V95 PolarHBondContact O-N 3.03Å; R93-V95 VanDerWaalsContact O-N 3.12Å; R93-G97 WeakPolarHBondContact O-CA 3.26Å; R93-G97 PolarHBondContact O-N 3.34Å; R93-D102 IonicContact CZ-OD1 3.34Å; R93-D102 IonicContact NE-OD1 3Å; R93-D102 PolarHBondContact NE-OD1 3.2Å; R93-D102 IonicContact NH2-OD1 2.96Å; R93-D102 PolarHBondContact NH2-OD1 2.88Å; R93-D102 IonicContact NH2-OD2 2.85Å; R93-D102 PolarHBondContact NH2-OD2 3.36Å; R93-L105 HydrophobicContact CG-CD1 4.27Å
94	A	84.9	Confident	81.5	Confident	86 Å²	86	64.7 Å²	64.7	71%	0.711	38%	0.379	S	S	*	.	H	α-helix	trans	-62	-16.7	175.8	0	0	0	0	0	114.5	D90 M92	D90-A94 WeakPolarHBondContact O-CB 3.33Å; D90-A94 PolarHBondContact O-N 2.66Å; M92-A94 VanDerWaalsContact C-N 3.32Å; M92-A94 PolarHBondContact O-N 2.68Å
95	V	81.8	Confident	81.6	Confident	96 Å²	96	60.4 Å²	60.4	58%	0.582	36%	0.36	S	S	*	.	H	α-helix	trans	-110	-37.3	179	-176.4	0	0	0	0	112.7	M92 R93 L120	M92-V95 PolarHBondContact O-N 3.13Å; M92-V95 VanDerWaalsContact O-N 3.09Å; R93-V95 PolarHBondContact O-N 3.03Å; R93-V95 VanDerWaalsContact O-N 3.12Å; V95-L120 HydrophobicContact CB-CD2 4.3Å; V95-L120 HydrophobicContact CG1-CD1 4.48Å; V95-L120 HydrophobicContact CG1-CD2 4.05Å; V95-L120 HydrophobicContact CG2-CD2 4.43Å
96	L	78.7	Confident	81.6	Confident	32 Å²	32	60.9 Å²	60.9	17%	0.168	36%	0.364	C	S	.	.	H	α-helix	trans	-93.1	-24.9	-176.9	-63.8	174.5	0	0	0	113.9	M92 A99 V100 L105 L120 V123 L124	M92-L96 PolarHBondContact O-N 3.26Å; L96-A99 WeakPolarHBondContact O-CB 3.45Å; L96-V100 HydrophobicContact CD1-CG2 4.32Å; L96-L105 HydrophobicContact CD1-CD2 3.58Å; L96-L120 HydrophobicContact CD1-CD1 3.76Å; L96-L120 HydrophobicContact CD2-CD1 3.76Å; L96-L120 HydrophobicContact CG-CD1 3.64Å; L96-V123 HydrophobicContact CD1-CG1 4.07Å; L96-L124 HydrophobicContact CD2-CD2 3.91Å; L96-L124 HydrophobicContact CD2-CG 4.47Å
97	G	75.4	Confident	81.3	Confident	33 Å²	33	62.5 Å²	62.5	34%	0.34	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	57.1	-155.9	-168.8	0	0	0	0	0	112.9	R93 A99	R93-G97 WeakPolarHBondContact O-CA 3.26Å; R93-G97 PolarHBondContact O-N 3.34Å; G97-A99 PolarHBondContact O-N 3.45Å
98	D	74.7	Confident	81.2	Confident	173 Å²	173	58.9 Å²	58.9	93%	0.925	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-73.8	10.8	-177.7	-47.8	-41.8	0	0	0	114	V100	D98-V100 VanDerWaalsContact C-N 3.34Å; D98-V100 PolarHBondContact O-N 3.32Å
99	A	75.2	Confident	81.1	Confident	87 Å²	87	58.7 Å²	58.7	72%	0.719	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-73.7	-22.2	-174.1	0	0	0	0	0	113.9	L96 G97	L96-A99 WeakPolarHBondContact O-CB 3.45Å; G97-A99 PolarHBondContact O-N 3.45Å
100	V	77.6	Confident	81	Confident	18 Å²	18	60.9 Å²	60.9	11%	0.109	36%	0.357	C	S	.	.	S	Bend	trans	-126.6	128.6	-176.3	-178.9	0	0	0	0	109.4	L96 D98 V104 L105 V123	L96-V100 HydrophobicContact CD1-CG2 4.32Å; D98-V100 VanDerWaalsContact C-N 3.34Å; D98-V100 PolarHBondContact O-N 3.32Å; V100-V104 HydrophobicContact CG1-CB 4.06Å; V100-V104 HydrophobicContact CG1-CG1 4.08Å; V100-L105 HydrophobicContact CB-CD2 4.01Å; V100-L105 HydrophobicContact CB-CG 4.47Å; V100-L105 HydrophobicContact CG1-CD2 3.67Å; V100-L105 HydrophobicContact CG1-CG 4.09Å; V100-V123 HydrophobicContact CG1-CG1 4.1Å; V100-V123 HydrophobicContact CG2-CG1 4.26Å
101	P	81.3	Confident	80.9	Confident	82 Å²	82	63 Å²	63	53%	0.532	36%	0.362	S	S	.	.			trans	-67.9	139.6	-177	26.6	-34.3	0	0	0	112.6	S103 V104 L105	P101-S103 PolarHBondContact O-N 3.21Å; P101-V104 HydrophobicContact CG-CG2 4.03Å; P101-V104 PolarHBondContact O-N 3.31Å; P101-L105 PolarHBondContact O-N 2.66Å
102	D	76.3	Confident	80.9	Confident	42 Å²	42	60.1 Å²	60.1	23%	0.225	35%	0.349	C	S	.	.	H	α-helix	trans	-50	-30.5	-176.2	-80.1	-39.5	0	0	0	114.5	S70 R93 V104 L105 T106	S70-D102 WeakPolarHBondContact CB-OD2 3.37Å; S70-D102 PolarHBondContact OG-OD2 2.87Å; R93-D102 IonicContact CZ-OD1 3.34Å; R93-D102 IonicContact NE-OD1 3Å; R93-D102 PolarHBondContact NE-OD1 3.2Å; R93-D102 IonicContact NH2-OD1 2.96Å; R93-D102 PolarHBondContact NH2-OD1 2.88Å; R93-D102 IonicContact NH2-OD2 2.85Å; R93-D102 PolarHBondContact NH2-OD2 3.36Å; D102-V104 VanDerWaalsContact C-N 3.34Å; D102-V104 PolarHBondContact O-N 3.23Å; D102-L105 PolarHBondContact O-N 2.71Å; D102-T106 VanDerWaalsContact O-CB 3.25Å; D102-T106 WeakPolarHBondContact O-CB 3.31Å; D102-T106 PolarHBondContact O-N 2.96Å; D102-T106 PolarHBondContact O-OG1 2.92Å
103	S	79.4	Confident	80.7	Confident	64 Å²	64	62.6 Å²	62.6	45%	0.448	38%	0.375	S	S	.	.	H	α-helix	trans	-65	-34.2	177.9	56	0	0	0	0	113.3	P101 Q107	P101-S103 PolarHBondContact O-N 3.21Å; S103-Q107 WeakPolarHBondContact O-CG 3.25Å; S103-Q107 PolarHBondContact O-N 3.46Å
104	V	81.8	Confident	80.6	Confident	40 Å²	40	60 Å²	60	24%	0.242	37%	0.366	C	S	.	.	H	α-helix	trans	-75.3	-43.9	175.4	176.3	0	0	0	0	110.2	V100 P101 D102 T106 Q107 A108 V123	V100-V104 HydrophobicContact CG1-CB 4.06Å; V100-V104 HydrophobicContact CG1-CG1 4.08Å; P101-V104 HydrophobicContact CG-CG2 4.03Å; P101-V104 PolarHBondContact O-N 3.31Å; D102-V104 VanDerWaalsContact C-N 3.34Å; D102-V104 PolarHBondContact O-N 3.23Å; V104-T106 VanDerWaalsContact C-N 3.31Å; V104-T106 PolarHBondContact O-N 3.5Å; V104-Q107 PolarHBondContact O-N 2.93Å; V104-A108 WeakPolarHBondContact O-CB 3.04Å; V104-A108 PolarHBondContact O-N 2.73Å; V104-V123 HydrophobicContact CG1-CG2 4.48Å
105	L	82.6	Confident	80.5	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-58.4	-44.4	175.7	-55.9	-179.8	0	0	0	111.1	L89 M92 R93 L96 V100 P101 D102 A108 A109 V123	L89-L105 HydrophobicContact CD2-CB 3.57Å; M92-L105 HydrophobicContact CE-CD2 3.92Å; R93-L105 HydrophobicContact CG-CD1 4.27Å; L96-L105 HydrophobicContact CD1-CD2 3.58Å; V100-L105 HydrophobicContact CB-CD2 4.01Å; V100-L105 HydrophobicContact CB-CG 4.47Å; V100-L105 HydrophobicContact CG1-CD2 3.67Å; V100-L105 HydrophobicContact CG1-CG 4.09Å; P101-L105 PolarHBondContact O-N 2.66Å; D102-L105 PolarHBondContact O-N 2.71Å; L105-A108 PolarHBondContact O-N 2.94Å; L105-A109 WeakPolarHBondContact O-CB 3.38Å; L105-A109 PolarHBondContact O-N 2.95Å; L105-V123 HydrophobicContact CD2-CG1 4.48Å; L105-V123 HydrophobicContact CD2-CG2 4.39Å
106	T	84	Confident	80.5	Confident	24 Å²	24	56.6 Å²	56.6	15%	0.147	34%	0.336	C	S	.	.	H	α-helix	trans	-63.2	-44.8	178.1	-60.1	0	0	0	0	111.9	F75 L85 D102 V104 A109 M110	F75-T106 HydrophobicContact CE2-CG2 4.35Å; L85-T106 HydrophobicContact CD1-CG2 4.47Å; L85-T106 HydrophobicContact CD2-CG2 4.39Å; D102-T106 VanDerWaalsContact O-CB 3.25Å; D102-T106 WeakPolarHBondContact O-CB 3.31Å; D102-T106 PolarHBondContact O-N 2.96Å; D102-T106 PolarHBondContact O-OG1 2.92Å; V104-T106 VanDerWaalsContact C-N 3.31Å; V104-T106 PolarHBondContact O-N 3.5Å; T106-A109 PolarHBondContact O-N 3.45Å; T106-M110 HydrophobicContact CG2-CE 3.84Å; T106-M110 WeakPolarHBondContact O-CG 3.08Å; T106-M110 PolarHBondContact O-N 2.85Å
107	Q	81.2	Confident	80.8	Confident	129 Å²	129	62.7 Å²	62.7	60%	0.603	36%	0.363	S	S	*	.	H	α-helix	trans	-64.6	-41.8	176.6	-75.2	180	10	0	0	112.1	S103 V104 M110 K111	S103-Q107 WeakPolarHBondContact O-CG 3.25Å; S103-Q107 PolarHBondContact O-N 3.46Å; V104-Q107 PolarHBondContact O-N 2.93Å; Q107-M110 PolarHBondContact O-N 2.83Å; Q107-K111 WeakPolarHBondContact O-CB 3.42Å; Q107-K111 PolarHBondContact O-N 2.96Å
108	A	82	Confident	81.2	Confident	9 Å²	9	68.6 Å²	68.6	7%	0.074	38%	0.375	C	S	.	.	H	α-helix	trans	-63.8	-45.2	175.6	0	0	0	0	0	112	M92 V104 L105 M110 K111 H112 A119 V123	M92-A108 HydrophobicContact CE-CB 4.41Å; V104-A108 WeakPolarHBondContact O-CB 3.04Å; V104-A108 PolarHBondContact O-N 2.73Å; L105-A108 PolarHBondContact O-N 2.94Å; A108-M110 PolarHBondContact O-N 3.37Å; A108-K111 PolarHBondContact O-N 3.36Å; A108-H112 PolarHBondContact O-CD2 2.71Å; A108-H112 PolarHBondContact O-N 2.92Å; A108-A119 HydrophobicContact CB-CB 4.35Å; A108-V123 HydrophobicContact CB-CG2 3.52Å
109	A	84.8	Confident	81.6	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-59.5	-42.9	177.4	0	0	0	0	0	112.2	L85 L105 T106 G113 F114	L85-A109 HydrophobicContact CD1-CB 3.64Å; L105-A109 WeakPolarHBondContact O-CB 3.38Å; L105-A109 PolarHBondContact O-N 2.95Å; T106-A109 PolarHBondContact O-N 3.45Å; A109-G113 PolarHBondContact O-N 2.89Å; A109-F114 WeakPolarHBondContact O-CA 3.4Å; A109-F114 PolarHBondContact O-N 2.95Å
110	M	83.7	Confident	82	Confident	53 Å²	53	57.6 Å²	57.6	26%	0.261	30%	0.304	S	S	.	.	H	α-helix	trans	-68.2	-46.3	174.7	-67.6	-166.7	-167.6	0	0	112.7	F75 L77 L85 T106 Q107 A108 H112 G113 F114	F75-M110 HydrophobicContact CB-CE 3.86Å; F75-M110 HydrophobicContact CD1-CE 4.39Å; F75-M110 HydrophobicContact CD2-CE 3.4Å; F75-M110 HydrophobicContact CD2-SD 4.36Å; F75-M110 HydrophobicContact CE2-CE 3.97Å; F75-M110 HydrophobicContact CG-CE 3.63Å; F75-M110 HydrophobicContact CG-SD 4.31Å; L77-M110 HydrophobicContact CD1-CE 3.66Å; L77-M110 HydrophobicContact CD1-SD 4.43Å; L85-M110 HydrophobicContact CD2-CE 3.79Å; T106-M110 HydrophobicContact CG2-CE 3.84Å; T106-M110 WeakPolarHBondContact O-CG 3.08Å; T106-M110 PolarHBondContact O-N 2.85Å; Q107-M110 PolarHBondContact O-N 2.83Å; A108-M110 PolarHBondContact O-N 3.37Å; M110-H112 PolarHBondContact O-N 2.91Å; M110-G113 PolarHBondContact O-N 2.94Å; M110-G113 VanDerWaalsContact O-N 3.14Å; M110-F114 HydrophobicContact CG-CE1 4.12Å
111	K	82.4	Confident	82.3	Confident	133 Å²	133	62.2 Å²	62.2	58%	0.578	33%	0.328	S	S	*	.	H	α-helix	trans	-57.5	-31.1	179.5	178.8	-178.5	170.5	-179.4	0	112.6	Q107 A108 E126	Q107-K111 WeakPolarHBondContact O-CB 3.42Å; Q107-K111 PolarHBondContact O-N 2.96Å; A108-K111 PolarHBondContact O-N 3.36Å; K111-E126 IonicContact NZ-OE1 2.61Å; K111-E126 PolarHBondContact NZ-OE1 2.87Å
112	H	83.7	Confident	82.4	Confident	62 Å²	62	58.8 Å²	58.8	29%	0.287	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	20.7	180	-65.1	-77.7	0	0	0	114.1	A108 M110 F114 D115 R118 A119 A122	A108-H112 PolarHBondContact O-CD2 2.71Å; A108-H112 PolarHBondContact O-N 2.92Å; M110-H112 PolarHBondContact O-N 2.91Å; H112-F114 VanDerWaalsContact C-N 3.32Å; H112-F114 PolarHBondContact O-N 2.77Å; H112-D115 PolarHBondContact O-N 3.13Å; H112-R118 HydrophobicContact CB-CB 4.07Å; H112-A119 HydrophobicContact CB-CB 4.45Å; H112-A122 WeakPolarHBondContact NE2-CB 3.16Å
113	G	79.1	Confident	82.7	Confident	54 Å²	54	57 Å²	57	56%	0.557	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	26.7	167.9	0	0	0	0	0	115.3	A109 M110 D115	A109-G113 PolarHBondContact O-N 2.89Å; M110-G113 PolarHBondContact O-N 2.94Å; M110-G113 VanDerWaalsContact O-N 3.14Å; G113-D115 VanDerWaalsContact C-N 3.31Å; G113-D115 PolarHBondContact O-N 3.49Å
114	F	81.4	Confident	82.8	Confident	41 Å²	41	58.5 Å²	58.5	18%	0.18	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	16.2	-176.5	-38.7	-73.2	0	0	0	115.7	L77 N81 K84 L85 C88 A109 M110 H112 P116	L77-F114 HydrophobicContact CD1-CZ 4.45Å; N81-F114 HydrophobicContact CB-CE2 3.98Å; N81-F114 HydrophobicContact CB-CZ 4.19Å; K84-F114 HydrophobicContact CB-CB 4.02Å; K84-F114 HydrophobicContact CB-CD2 4.3Å; K84-F114 HydrophobicContact CB-CG 4.11Å; K84-F114 HydrophobicContact CD-CD2 4.5Å; L85-F114 HydrophobicContact CB-CD1 3.88Å; L85-F114 HydrophobicContact CB-CE1 3.77Å; L85-F114 HydrophobicContact CD1-CD1 4.02Å; L85-F114 HydrophobicContact CD1-CE1 3.98Å; L85-F114 HydrophobicContact CG-CE1 4.32Å; C88-F114 HydrophobicContact CB-CB 4.49Å; A109-F114 WeakPolarHBondContact O-CA 3.4Å; A109-F114 PolarHBondContact O-N 2.95Å; M110-F114 HydrophobicContact CG-CE1 4.12Å; H112-F114 VanDerWaalsContact C-N 3.32Å; H112-F114 PolarHBondContact O-N 2.77Å; F114-P116 WeakPolarHBondContact O-CD 3.47Å
115	D	83.8	Confident	82.6	Confident	71 Å²	71	59.4 Å²	59.4	38%	0.38	31%	0.308	S	S	.	.			trans	-75.2	111.5	168.1	-84.4	-27.6	0	0	0	110.8	H112 G113 Q117 R118 A119	H112-D115 PolarHBondContact O-N 3.13Å; G113-D115 VanDerWaalsContact C-N 3.31Å; G113-D115 PolarHBondContact O-N 3.49Å; D115-Q117 PolarHBondContact O-N 3.09Å; D115-R118 HydrophobicContact CB-CB 4.03Å; D115-R118 HydrophobicContact CB-CG 4.26Å; D115-R118 PolarHBondContact O-N 3.14Å; D115-R118 WeakPolarHBondContact OD2-CD 3.07Å; D115-R118 IonicContact OD2-CZ 3.63Å; D115-R118 IonicContact OD2-NE 3.89Å; D115-R118 IonicContact OD2-NH1 2.68Å; D115-R118 PolarHBondContact OD2-NH1 3.38Å; D115-A119 WeakPolarHBondContact O-CB 3.33Å; D115-A119 PolarHBondContact O-N 2.84Å
116	P	81.9	Confident	81.9	Confident	41 Å²	41	62.7 Å²	62.7	27%	0.266	32%	0.323	S	S	.	.	H	α-helix	trans	-66.4	-37.4	-172	24.7	-33.8	0	0	0	113.5	C88 H91 F114 L120	C88-P116 VanDerWaalsContact SG-CA 3.57Å; H91-P116 HydrophobicContact CB-CB 4.03Å; F114-P116 WeakPolarHBondContact O-CD 3.47Å; P116-L120 WeakPolarHBondContact O-CB 3.47Å; P116-L120 PolarHBondContact O-N 3.07Å
117	Q	83.9	Confident	80.8	Confident	160 Å²	160	65.3 Å²	65.3	75%	0.748	34%	0.337	S	S	*	.	H	α-helix	trans	-65.6	-41.2	178.8	-69	-179.2	-22.3	0	0	111.9	D115 L120 D121	D115-Q117 PolarHBondContact O-N 3.09Å; Q117-L120 PolarHBondContact O-N 3Å; Q117-D121 PolarHBondContact O-N 3.05Å
118	R	84.1	Confident	79.4	Confident	156 Å²	156	63.2 Å²	63.2	59%	0.589	34%	0.336	S	S	*	.	H	α-helix	trans	-72.4	-38.2	179.1	-71.9	177.6	170.1	148.8	-7.2	112.4	H112 D115 L120 A122	H112-R118 HydrophobicContact CB-CB 4.07Å; D115-R118 HydrophobicContact CB-CB 4.03Å; D115-R118 HydrophobicContact CB-CG 4.26Å; D115-R118 PolarHBondContact O-N 3.14Å; D115-R118 WeakPolarHBondContact OD2-CD 3.07Å; D115-R118 IonicContact OD2-CZ 3.63Å; D115-R118 IonicContact OD2-NE 3.89Å; D115-R118 IonicContact OD2-NH1 2.68Å; D115-R118 PolarHBondContact OD2-NH1 3.38Å; R118-L120 VanDerWaalsContact C-N 3.33Å; R118-A122 VanDerWaalsContact O-CB 3.28Å; R118-A122 WeakPolarHBondContact O-CB 3.4Å; R118-A122 PolarHBondContact O-N 3.31Å
119	A	84.1	Confident	77.7	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-65.1	-38.5	173.8	0	0	0	0	0	111.4	M92 A108 H112 D115 A122 V123	M92-A119 HydrophobicContact CE-CB 3.73Å; M92-A119 HydrophobicContact SD-CB 3.64Å; A108-A119 HydrophobicContact CB-CB 4.35Å; H112-A119 HydrophobicContact CB-CB 4.45Å; D115-A119 WeakPolarHBondContact O-CB 3.33Å; D115-A119 PolarHBondContact O-N 2.84Å; A119-A122 PolarHBondContact O-N 3.18Å; A119-V123 WeakPolarHBondContact O-CG2 3.27Å; A119-V123 PolarHBondContact O-N 3.11Å
120	L	83.9	Confident	75.5	Confident	30 Å²	30	78.6 Å²	78.6	16%	0.157	40%	0.4	C	S	.	.	H	α-helix	trans	-67.1	-49.3	176.9	-176.8	62.6	0	0	0	112.4	V95 L96 P116 Q117 R118 A122 V123 L124	V95-L120 HydrophobicContact CB-CD2 4.3Å; V95-L120 HydrophobicContact CG1-CD1 4.48Å; V95-L120 HydrophobicContact CG1-CD2 4.05Å; V95-L120 HydrophobicContact CG2-CD2 4.43Å; L96-L120 HydrophobicContact CD1-CD1 3.76Å; L96-L120 HydrophobicContact CD2-CD1 3.76Å; L96-L120 HydrophobicContact CG-CD1 3.64Å; P116-L120 WeakPolarHBondContact O-CB 3.47Å; P116-L120 PolarHBondContact O-N 3.07Å; Q117-L120 PolarHBondContact O-N 3Å; R118-L120 VanDerWaalsContact C-N 3.33Å; L120-A122 VanDerWaalsContact C-N 3.26Å; L120-A122 PolarHBondContact O-N 2.81Å; L120-V123 PolarHBondContact O-N 2.92Å; L120-L124 HydrophobicContact CD1-CD1 4.11Å; L120-L124 HydrophobicContact CD1-CG 4.39Å; L120-L124 HydrophobicContact CG-CD1 4.01Å; L120-L124 WeakPolarHBondContact O-CB 3.14Å; L120-L124 WeakPolarHBondContact O-CG 3.48Å; L120-L124 PolarHBondContact O-N 3.29Å
121	D	84	Confident	73.1	Confident	114 Å²	114	79 Å²	79	61%	0.61	41%	0.412	S	S	*	.	H	α-helix	trans	-57.3	-40.6	174.2	-80.3	-16.5	0	0	0	111.3	Q117 S125	Q117-D121 PolarHBondContact O-N 3.05Å; D121-S125 VanDerWaalsContact O-CB 3.31Å; D121-S125 WeakPolarHBondContact O-CB 3.46Å; D121-S125 PolarHBondContact O-N 3.47Å; D121-S125 PolarHBondContact O-OG 3.02Å
122	A	81.6	Confident	70.6	Confident	10 Å²	10	78.6 Å²	78.6	8%	0.083	42%	0.422	C	S	.	.	H	α-helix	trans	-61.8	-50.7	177	0	0	0	0	0	112.2	H112 R118 A119 L120 L124 S125 E126	H112-A122 WeakPolarHBondContact NE2-CB 3.16Å; R118-A122 VanDerWaalsContact O-CB 3.28Å; R118-A122 WeakPolarHBondContact O-CB 3.4Å; R118-A122 PolarHBondContact O-N 3.31Å; A119-A122 PolarHBondContact O-N 3.18Å; L120-A122 VanDerWaalsContact C-N 3.26Å; L120-A122 PolarHBondContact O-N 2.81Å; A122-L124 PolarHBondContact O-N 2.99Å; A122-S125 PolarHBondContact O-N 3.06Å; A122-S125 PolarHBondContact O-OG 3.06Å; A122-E126 PolarHBondContact O-N 3.33Å
123	V	83.4	Confident	68	Low	6 Å²	6	81.5 Å²	81.5	4%	0.036	44%	0.444	C	S	.	.	H	α-helix	trans	-59.5	-46.3	178.2	170.1	0	0	0	0	111.3	M92 L96 V100 V104 L105 A108 A119 L120 S125 E126 D127	M92-V123 HydrophobicContact CE-CG2 3.81Å; L96-V123 HydrophobicContact CD1-CG1 4.07Å; V100-V123 HydrophobicContact CG1-CG1 4.1Å; V100-V123 HydrophobicContact CG2-CG1 4.26Å; V104-V123 HydrophobicContact CG1-CG2 4.48Å; L105-V123 HydrophobicContact CD2-CG1 4.48Å; L105-V123 HydrophobicContact CD2-CG2 4.39Å; A108-V123 HydrophobicContact CB-CG2 3.52Å; A119-V123 WeakPolarHBondContact O-CG2 3.27Å; A119-V123 PolarHBondContact O-N 3.11Å; L120-V123 PolarHBondContact O-N 2.92Å; V123-S125 VanDerWaalsContact C-N 3.29Å; V123-S125 PolarHBondContact O-N 2.94Å; V123-E126 PolarHBondContact O-N 3.23Å; V123-D127 PolarHBondContact O-N 3.44Å
124	L	81.3	Confident	65.6	Low	94 Å²	94	85.4 Å²	85.4	49%	0.492	46%	0.457	S	S	.	.	H	α-helix	trans	-64.3	-32.8	178.2	-68.5	171.3	0	0	0	112.4	L96 L120 A122 S128	L96-L124 HydrophobicContact CD2-CD2 3.91Å; L96-L124 HydrophobicContact CD2-CG 4.47Å; L120-L124 HydrophobicContact CD1-CD1 4.11Å; L120-L124 HydrophobicContact CD1-CG 4.39Å; L120-L124 HydrophobicContact CG-CD1 4.01Å; L120-L124 WeakPolarHBondContact O-CB 3.14Å; L120-L124 WeakPolarHBondContact O-CG 3.48Å; L120-L124 PolarHBondContact O-N 3.29Å; A122-L124 PolarHBondContact O-N 2.99Å; L124-S128 PolarHBondContact O-N 2.88Å
125	S	78.3	Confident	63.1	Low	60 Å²	60	94.7 Å²	94.7	42%	0.42	49%	0.491	S	S	.	.	H	α-helix	trans	-72.8	-40.9	174.4	76	0	0	0	0	113.2	D121 A122 V123 D127 S128 E129	D121-S125 VanDerWaalsContact O-CB 3.31Å; D121-S125 WeakPolarHBondContact O-CB 3.46Å; D121-S125 PolarHBondContact O-N 3.47Å; D121-S125 PolarHBondContact O-OG 3.02Å; A122-S125 PolarHBondContact O-N 3.06Å; A122-S125 PolarHBondContact O-OG 3.06Å; V123-S125 VanDerWaalsContact C-N 3.29Å; V123-S125 PolarHBondContact O-N 2.94Å; S125-D127 VanDerWaalsContact C-N 3.34Å; S125-D127 PolarHBondContact O-N 2.97Å; S125-S128 WeakPolarHBondContact O-CB 3.4Å; S125-S128 PolarHBondContact O-N 2.94Å; S125-S128 VanDerWaalsContact O-N 3.09Å; S125-S128 PolarHBondContact O-OG 3Å; S125-E129 PolarHBondContact O-N 3.11Å
126	E	67.9	Low	60.3	Low	69 Å²	69	97.2 Å²	97.2	32%	0.322	51%	0.514	S	S	.	.	H	α-helix	trans	-68.2	-31.6	-180	-73.8	-172.3	-159.5	0	0	112.3	K111 A122 V123 R130	K111-E126 IonicContact NZ-OE1 2.61Å; K111-E126 PolarHBondContact NZ-OE1 2.87Å; A122-E126 PolarHBondContact O-N 3.33Å; V123-E126 PolarHBondContact O-N 3.23Å; E126-R130 WeakPolarHBondContact O-CG 3.07Å; E126-R130 PolarHBondContact O-N 2.95Å
127	D	59.5	Low	57.8	Low	80 Å²	80	100.1 Å²	100.1	43%	0.428	54%	0.542	S	S	.	.	H	α-helix	trans	-72.3	-28.6	170.6	-88.7	-15.5	0	0	0	112.8	V123 S125 E129 R130	V123-D127 PolarHBondContact O-N 3.44Å; S125-D127 VanDerWaalsContact C-N 3.34Å; S125-D127 PolarHBondContact O-N 2.97Å; D127-E129 VanDerWaalsContact C-N 3.31Å; D127-E129 PolarHBondContact O-N 2.97Å; D127-R130 PolarHBondContact O-N 2.93Å; D127-R130 VanDerWaalsContact O-N 3.16Å; D127-R130 IonicContact OD1-NH1 3.78Å
128	S	52.7	Low	55.2	Low	84 Å²	84	96.7 Å²	96.7	59%	0.587	54%	0.541	S	S	*	.	H	α-helix	trans	-66.8	-31	174.4	81.9	0	0	0	0	113.1	L124 S125 R130	L124-S128 PolarHBondContact O-N 2.88Å; S125-S128 WeakPolarHBondContact O-CB 3.4Å; S125-S128 PolarHBondContact O-N 2.94Å; S125-S128 VanDerWaalsContact O-N 3.09Å; S125-S128 PolarHBondContact O-OG 3Å; S128-R130 VanDerWaalsContact C-N 3.33Å
129	E	46	Very low	52.6	Low	171 Å²	171	97.8 Å²	97.8	80%	0.799	55%	0.552	S	S	*	*	H	α-helix	trans	-79.3	-14.8	173.6	-66.3	-160.6	145.9	0	0	113.1	S125 D127	S125-E129 PolarHBondContact O-N 3.11Å; D127-E129 VanDerWaalsContact C-N 3.31Å; D127-E129 PolarHBondContact O-N 2.97Å
130	R	39.3	Very low	50	Low	162 Å²	162	105 Å²	105	61%	0.611	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-7.4	178.5	-73.9	172.6	179.8	178.2	3.8	114.1	E126 D127 S128	E126-R130 WeakPolarHBondContact O-CG 3.07Å; E126-R130 PolarHBondContact O-N 2.95Å; D127-R130 PolarHBondContact O-N 2.93Å; D127-R130 VanDerWaalsContact O-N 3.16Å; D127-R130 IonicContact OD1-NH1 3.78Å; S128-R130 VanDerWaalsContact C-N 3.33Å
131	A	32.8	Very low	47.4	Very low	62 Å²	62	112.7 Å²	112.7	51%	0.512	63%	0.629	S	S	.	*	S	Bend	trans	-70.5	123.3	171.1	0	0	0	0	0	110.9	V133	A131-V133 PolarHBondContact O-N 2.88Å; A131-V133 VanDerWaalsContact O-N 3.16Å
132	P	30.5	Very low	44.7	Very low	123 Å²	123	111.4 Å²	111.4	80%	0.799	63%	0.634	S	S	*	*			trans	-71.4	113.7	-175	27.5	-34.3	0	0	0	112	T134	P132-T134 PolarHBondContact O-N 2.91Å
133	V	29.7	Very low	43.1	Very low	123 Å²	123	116.4 Å²	116.4	75%	0.745	67%	0.665	S	S	*	*			trans	-70.4	95.9	-179.1	-176.8	0	0	0	0	112	A131 R135	A131-V133 PolarHBondContact O-N 2.88Å; A131-V133 VanDerWaalsContact O-N 3.16Å; V133-R135 HydrophobicContact CG1-CG 3.92Å; V133-R135 PolarHBondContact O-N 3.04Å
134	T	27.4	Very low	40.4	Very low	136 Å²	136	122.8 Å²	122.8	83%	0.834	70%	0.704	S	S	*	*			trans	-76.2	112.5	151.6	40.6	0	0	0	0	109.2	P132	P132-T134 PolarHBondContact O-N 2.91Å
135	R	28.3	Very low	37.8	Very low	237 Å²	237	122 Å²	122	89%	0.894	72%	0.719	S	S	*	*			trans	-76.2	124.3	-173.2	-65.2	176.8	175.5	169.2	-3.1	113.6	V133	V133-R135 HydrophobicContact CG1-CG 3.92Å; V133-R135 PolarHBondContact O-N 3.04Å
136	S	26.8	Very low	35.2	Very low	124 Å²	124	130.6 Å²	130.6	87%	0.867	74%	0.742	S	S	*	*			trans	-149.9	142.5	138.7	50.8	0	0	0	0	108.6
137	A	29.4	Very low	33.2	Very low	102 Å²	102	133.3 Å²	133.3	84%	0.843	76%	0.763	S	S	*	*			trans	-114.1	150	-168.5	0	0	0	0	0	112.3
138	A	28	Very low	31.6	Very low	88 Å²	88	133.7 Å²	133.7	73%	0.727	78%	0.777	S	S	*	*				-177	125.4	124.1	0	0	0	0	0	112.7
139	E	30.7	Very low	30.3	Very low	178 Å²	178	137.5 Å²	137.5	83%	0.832	79%	0.786	S	S	*	*			trans	56	107.5	134.1	-62.1	173.4	174.7	0	0	121.9
140	D	28.4	Very low	29.3	Very low	151 Å²	151	135.5 Å²	135.5	81%	0.807	78%	0.777	S	S	*	*				22.3	115.4	127.4	-60.1	-31.2	0	0	0	120.3
141	M	29	Very low	28.7	Very low	193 Å²	193	135.5 Å²	135.5	95%	0.951	78%	0.784	S	S	*	*				-178.8	163.8	93.8	-93.9	-152.6	175.3	0	0	113
142	A	27.9	Very low	28.4	Very low	87 Å²	87	138.8 Å²	138.8	72%	0.719	80%	0.797	S	S	*	*			trans	-119.9	-178.4	-177.8	0	0	0	0	0	110.1
143	P	48.8	Very low	28.7	Very low	114 Å²	114	138.4 Å²	138.4	74%	0.74	80%	0.795	S	S	*	*			cis	-136.1	-165	-45.7	32.9	-13.1	0	0	0	112.5
144	V	26.4	Very low	28.6	Very low	141 Å²	141	140 Å²	140	86%	0.855	80%	0.798	S	S	*	*			trans	75.3	126	158.5	177.8	0	0	0	0	118.6
145	G	25.6	Very low	29.1	Very low	78 Å²	78	138.7 Å²	138.7	80%	0.804	79%	0.792	S	S	*	*			trans	-169.2	124.2	161.7	0	0	0	0	0	111.2
146	R	25.1	Very low	29.1	Very low	239 Å²	239	135.4 Å²	135.4	90%	0.902	79%	0.787	S	S	*	*			trans	-110.8	170.6	179.7	-77	-179	169.2	178.1	-3.4	111.3
147	V	25.6	Very low	29	Very low	127 Å²	127	140.1 Å²	140.1	77%	0.77	79%	0.786	S	S	*	*			trans	89	91.9	156.7	-166	0	0	0	0	117.7
148	A	25.2	Very low	28.7	Very low	88 Å²	88	140.1 Å²	140.1	73%	0.727	78%	0.776	S	S	*	*				51.6	172.1	116.9	0	0	0	0	0	123.2
149	Q	26.5	Very low	28.7	Very low	163 Å²	163	144.3 Å²	144.3	76%	0.762	78%	0.777	S	S	*	*			trans	72.8	138.4	173.3	-65.6	-170.5	-76.6	0	0	116.6
150	E	25.1	Very low	28.4	Very low	130 Å²	130	143 Å²	143	61%	0.607	77%	0.771	S	S	*	*			cis	-163.2	179.6	-19.7	-137.9	179.6	99.7	0	0	111.3
151	Q	25.7	Very low	28.3	Very low	162 Å²	162	143.6 Å²	143.6	76%	0.757	77%	0.769	S	S	*	*			trans	68	115.3	152.1	-71.4	165.4	31.9	0	0	121.4
152	T	25.7	Very low	28.2	Very low	131 Å²	131	139 Å²	139	80%	0.804	76%	0.762	S	S	*	*			trans	-58.5	166.6	148	46.4	0	0	0	0	111.6
153	P	37.8	Very low	28.1	Very low	114 Å²	114	141.6 Å²	141.6	74%	0.74	77%	0.768	S	S	*	*			cis	-149.4	-176.4	32.7	42.9	-20.6	0	0	0	119.7
154	L	27	Very low	27.1	Very low	157 Å²	157	140.7 Å²	140.7	82%	0.822	77%	0.77	S	S	*	*			trans	-15.5	160.7	150.5	-65.5	161.7	0	0	0	118.3
155	P	39.2	Very low	27.1	Very low	109 Å²	109	140.9 Å²	140.9	71%	0.708	76%	0.762	S	S	*	*			cis	-145.3	173	26.3	40.9	-20.5	0	0	0	119.6
156	Q	26.7	Very low	27.1	Very low	167 Å²	167	145.5 Å²	145.5	78%	0.78	76%	0.76	S	S	*	*			trans	10.4	140.7	144.5	-52.1	173.9	4.2	0	0	121.3
157	R	25.2	Very low	27.2	Very low	223 Å²	223	139 Å²	139	84%	0.842	76%	0.757	S	S	*	*				-173.8	135	100.9	-110.5	-174.2	176.2	177.5	-1.1	118.5
158	T	24.3	Very low	27.4	Very low	103 Å²	103	143.1 Å²	143.1	63%	0.632	77%	0.765	S	S	*	*			trans	38.7	127.7	141.9	51.3	0	0	0	0	124.5
159	K	26.6	Very low	27.4	Very low	176 Å²	176	144.1 Å²	144.1	77%	0.765	77%	0.767	S	S	*	*			trans	70	163.6	133.7	-63.3	179.9	178.2	-170.2	0	116.9
160	Q	25.4	Very low	27.5	Very low	150 Å²	150	146.7 Å²	146.7	70%	0.701	77%	0.769	S	S	*	*			cis	-147.8	178.1	8.2	-148.6	148.3	-26.4	0	0	114.2
161	E	25.9	Very low	27.5	Very low	164 Å²	164	146.5 Å²	146.5	77%	0.766	77%	0.772	S	S	*	*			trans	-76.5	147	-176.6	-51.8	128.1	114.9	0	0	115.9
162	A	26.2	Very low	27.5	Very low	96 Å²	96	143.6 Å²	143.6	79%	0.793	78%	0.776	S	S	*	*			trans	-173.8	137.3	145.2	0	0	0	0	0	107.8
163	V	25.7	Very low	27.6	Very low	141 Å²	141	141.7 Å²	141.7	86%	0.855	77%	0.774	S	S	*	*			cis	85.7	80.7	20.9	-168.2	0	0	0	0	115.8
164	A	27.6	Very low	27.7	Very low	95 Å²	95	142.2 Å²	142.2	79%	0.785	78%	0.777	S	S	*	*			trans	-172.6	125.5	148.3	0	0	0	0	0	107.7
165	E	26.9	Very low	27.8	Very low	146 Å²	146	140.4 Å²	140.4	68%	0.682	77%	0.768	S	S	*	*				88.7	102.7	57.4	-89.2	-105.2	116.8	0	0	115.4
166	K	26.1	Very low	27.3	Very low	175 Å²	175	143.1 Å²	143.1	76%	0.761	77%	0.769	S	S	*	*			trans	64.6	166.8	151.1	-63.1	166.1	-178	142.2	0	116.6
167	A	26.2	Very low	27.5	Very low	102 Å²	102	143.4 Å²	143.4	84%	0.843	78%	0.775	S	S	*	*			cis	-139.6	-163.8	10.6	0	0	0	0	0	113.6
168	K	30.4	Very low	27.7	Very low	213 Å²	213	139.2 Å²	139.2	93%	0.926	77%	0.769	S	S	*	*			trans	-113.8	148.5	-174.4	-64.2	175.1	175.6	177.7	0	114
169	S	25.9	Very low	28	Very low	110 Å²	110	140.1 Å²	140.1	77%	0.769	78%	0.78	S	S	*	*			trans	-154.5	142.4	144	61.6	0	0	0	0	107
170	R	27.1	Very low	28.2	Very low	216 Å²	216	140.3 Å²	140.3	82%	0.815	78%	0.783	S	S	*	*			cis	61.3	130.9	43.4	-67.2	-167.4	119.4	156.6	5.6	112.5
171	D	26.1	Very low	28.5	Very low	126 Å²	126	139.8 Å²	139.8	67%	0.674	79%	0.79	S	S	*	*			cis	-157.9	178.3	-4	-115.2	-35.9	0	0	0	110.3
172	A	25.3	Very low	28.7	Very low	102 Å²	102	137.2 Å²	137.2	84%	0.843	79%	0.786	S	S	*	*			trans	80.5	151.7	163.3	0	0	0	0	0	120.8
173	A	28.6	Very low	29	Very low	90 Å²	90	138.3 Å²	138.3	74%	0.744	79%	0.785	S	S	*	*			trans	-123	-178.5	173	0	0	0	0	0	109.8
174	P	40	Very low	29.1	Very low	125 Å²	125	141.6 Å²	141.6	81%	0.812	79%	0.787	S	S	*	*				-145.6	177.8	109.3	38.6	-23	0	0	0	116.9
175	D	28.2	Very low	29.3	Very low	120 Å²	120	143.9 Å²	143.9	64%	0.642	79%	0.791	S	S	*	*			trans	-35.3	139.1	-171.2	-73.3	-89.3	0	0	0	123.6
176	K	29.3	Very low	29.4	Very low	166 Å²	166	141.6 Å²	141.6	72%	0.722	80%	0.797	S	S	*	*				44.7	137.6	124.1	-55.7	175.7	-174.1	125.5	0	122.9
177	L	31.5	Very low	29.5	Very low	172 Å²	172	144.4 Å²	144.4	90%	0.901	80%	0.803	S	S	*	*				-146.2	154.9	120.1	-108.4	168.1	0	0	0	109.8
178	D	29.5	Very low	29.6	Very low	136 Å²	136	148.1 Å²	148.1	73%	0.727	81%	0.805	S	S	*	*			trans	-90.9	155.1	-168.4	-58.1	-72.3	0	0	0	114.9
179	S	30.1	Very low	29.5	Very low	121 Å²	121	144.3 Å²	144.3	85%	0.846	80%	0.8	S	S	*	*			trans	-170.6	112	147.9	-81.4	0	0	0	0	111.7
180	E	30.1	Very low	29.7	Very low	180 Å²	180	145.7 Å²	145.7	84%	0.841	80%	0.803	S	S	*	*			trans	-84	140.9	167.2	-69.6	-173.1	107.9	0	0	111.5
181	V	31.6	Very low	29.7	Very low	140 Å²	140	141.4 Å²	141.4	85%	0.848	81%	0.806	S	S	*	*			trans	-136.5	115.9	157.9	-178.4	0	0	0	0	109.2
182	V	31.1	Very low	29.8	Very low	110 Å²	110	138.4 Å²	138.4	67%	0.667	81%	0.805	S	S	*	*			trans	-114.1	121.6	-179.7	-178.9	0	0	0	0	110
183	P	31.1	Very low	30	Very low	119 Å²	119	144 Å²	144	77%	0.773	81%	0.811	S	S	*	*			trans	-74	133	171.8	29.9	-32.5	0	0	0	110.8
184	K	28.6	Very low	30	Very low	209 Å²	209	149.2 Å²	149.2	91%	0.909	82%	0.816	S	S	*	*			trans	-81.6	133.8	-178.3	-63.5	170.3	-179	170.8	0	111.2
185	V	31.2	Very low	29.3	Very low	144 Å²	144	152 Å²	152	87%	0.873	82%	0.819	S	S	*	*			trans	-130.5	134.2	156.3	-177.4	0	0	0	0	107.9
186	A	29.6	Very low	29.3	Very low	98 Å²	98	152.3 Å²	152.3	81%	0.81	83%	0.825	S	S	*	*			trans	-71.7	138.7	-169.8	0	0	0	0	0	112.9
187	R	28.3	Very low	29.3	Very low	234 Å²	234	153.6 Å²	153.6	88%	0.883	84%	0.836	S	S	*	*			trans	-116.7	117.9	160.5	-83.8	-177.8	164.2	177.4	-4	108.5
188	M	28.7	Very low	29.1	Very low	180 Å²	180	148.7 Å²	148.7	89%	0.887	83%	0.827	S	S	*	*			trans	-74.2	123.5	165	-74.1	175.1	64.5	0	0	109.2
189	T	28.8	Very low	28.8	Very low	132 Å²	132	151.6 Å²	151.6	81%	0.81	83%	0.834	S	S	*	*			trans	-117.4	123.1	167.7	39.7	0	0	0	0	108.7
190	V	29.8	Very low	28.9	Very low	139 Å²	139	152.5 Å²	152.5	84%	0.842	83%	0.829	S	S	*	*			trans	-118.7	115.6	172.7	-178.6	0	0	0	0	108.8
191	S	27.4	Very low	29	Very low	126 Å²	126	150.4 Å²	150.4	88%	0.881	83%	0.828	S	S	*	*			trans	-148.1	133.3	169.2	177.7	0	0	0	0	106.5
192	G	26.7	Very low	29.1	Very low	63 Å²	63	149.4 Å²	149.4	65%	0.649	82%	0.824	S	S	*	*			cis	159.5	148.5	-0.3	0	0	0	0	0	108.9
193	K	29	Very low	28.8	Very low	220 Å²	220	149.8 Å²	149.8	96%	0.957	83%	0.832	S	S	*	*			trans	-149.7	149.3	175.3	-108.4	167.5	-174.7	176.8	0	111.8
194	K	29.3	Very low	28.7	Very low	199 Å²	199	149.8 Å²	149.8	87%	0.865	84%	0.835	S	S	*	*			trans	-92.2	146.5	-174.2	-60.5	174.6	175.9	179.3	0	111.9
195	Q	26.4	Very low	28.5	Very low	185 Å²	185	143.2 Å²	143.2	86%	0.864	83%	0.826	S	S	*	*			trans	160	149.5	147.6	-96.2	165.3	-10.5	0	0	108.3
196	T	27.4	Very low	28.4	Very low	126 Å²	126	144.6 Å²	144.6	77%	0.773	82%	0.823	S	S	*	*			cis	-157.7	165.7	-21.9	0.8	0	0	0	0	107.8
197	M	29.3	Very low	28.4	Very low	192 Å²	192	146.8 Å²	146.8	95%	0.946	82%	0.822	S	S	*	*			trans	-66.4	130	164.2	-66.9	-78	-75.9	0	0	109.5
198	G	26.7	Very low	28.3	Very low	70 Å²	70	139.6 Å²	139.6	72%	0.722	82%	0.82	S	S	*	*			trans	172.4	95.8	175.8	0	0	0	0	0	118.5
199	F	24.4	Very low	28.3	Very low	197 Å²	197	137.3 Å²	137.3	86%	0.864	82%	0.816	S	S	*	*			trans	73.7	147.8	135.3	-121.2	-93.5	0	0	0	123.4
200	D	31.5	Very low	28.3	Very low	139 Å²	139	139 Å²	139	74%	0.743	82%	0.819	S	S	*	*			trans	-76.9	160.2	179.7	-55.3	-104	0	0	0	115.3
201	V	31.9	Very low	28.2	Very low	137 Å²	137	136.7 Å²	136.7	83%	0.83	82%	0.815	S	S	*	*			trans	-150.7	154.5	167.5	-121.7	0	0	0	0	109.2
202	P	33.7	Very low	28.1	Very low	118 Å²	118	136 Å²	136	77%	0.766	81%	0.81	S	S	*	*				-133.3	171.3	-85.7	41.7	-28.7	0	0	0	114.7
203	S	25.6	Very low	28.9	Very low	119 Å²	119	138.9 Å²	138.9	83%	0.832	82%	0.817	S	S	*	*			trans	-146.5	130.5	142.2	62.7	0	0	0	0	112.7
204	S	28.3	Very low	28.8	Very low	118 Å²	118	132.3 Å²	132.3	83%	0.825	80%	0.804	S	S	*	*			trans	-80.2	153.3	161.3	46.4	0	0	0	0	109.8
205	G	25.2	Very low	28.7	Very low	71 Å²	71	132.3 Å²	132.3	73%	0.732	80%	0.798	S	S	*	*			cis	113.5	99.3	-1.8	0	0	0	0	0	113.6
206	E	28.5	Very low	28.7	Very low	173 Å²	173	134 Å²	134	81%	0.808	80%	0.797	S	S	*	*			trans	-149.3	131.7	160.5	-94.3	-153.8	78.8	0	0	112.2
207	N	28.9	Very low	28.4	Very low	145 Å²	145	131.8 Å²	131.8	78%	0.775	80%	0.799	S	S	*	*			trans	43.1	121.9	139.7	-59.9	-38.8	0	0	0	121.9
208	G	26.7	Very low	28.2	Very low	82 Å²	82	129.9 Å²	129.9	85%	0.845	79%	0.793	S	S	*	*			trans	-173.8	23.7	175.4	0	0	0	0	0	120.1
209	V	29.4	Very low	28.4	Very low	133 Å²	133	131.3 Å²	131.3	81%	0.806	79%	0.791	S	S	*	*			trans	-17.7	124	176.6	-177	0	0	0	0	119.8
210	L	29.3	Very low	29.5	Very low	167 Å²	167	127.1 Å²	127.1	87%	0.874	78%	0.784	S	S	*	*			trans	159.5	147.6	137.3	-95.4	137.9	0	0	0	109.5
211	A	27.1	Very low	29.4	Very low	91 Å²	91	128.5 Å²	128.5	75%	0.752	79%	0.786	S	S	*	*			cis	-159.4	153	-38	0	0	0	0	0	108
212	S	25.3	Very low	29.2	Very low	112 Å²	112	127.8 Å²	127.8	78%	0.783	78%	0.777	S	S	*	*			trans	-87.4	-178.8	178	60.6	0	0	0	0	110.8
213	P	42.3	Very low	28.9	Very low	122 Å²	122	127.2 Å²	127.2	79%	0.792	77%	0.772	S	S	*	*			cis	-141.6	-152.9	16.8	41	-18	0	0	0	115
214	A	28.4	Very low	28.8	Very low	82 Å²	82	131 Å²	131	68%	0.678	77%	0.773	S	S	*	*				178.4	167.1	-71.3	0	0	0	0	0	111
215	R	27.3	Very low	28.7	Very low	200 Å²	200	129.6 Å²	129.6	76%	0.755	77%	0.769	S	S	*	*			trans	81.1	120.7	158.3	-65	-176.6	171.6	-174.2	-0.5	121.6
216	R	25	Very low	28.7	Very low	221 Å²	221	132.8 Å²	132.8	83%	0.834	77%	0.774	S	S	*	*				59.1	140.5	122.4	-58.7	175.8	179.3	-174.1	-3.5	121.2
217	G	22	Very low	29.4	Very low	79 Å²	79	129.5 Å²	129.5	81%	0.814	77%	0.768	S	S	*	*			trans	156.4	124.1	142	0	0	0	0	0	114.5
218	D	25.8	Very low	29.4	Very low	152 Å²	152	129 Å²	129	81%	0.813	77%	0.77	S	S	*	*			trans	-90.8	140.4	173.8	-107.5	-72.5	0	0	0	112.1
219	S	30.3	Very low	30.1	Very low	99 Å²	99	129.9 Å²	129.9	69%	0.692	76%	0.761	S	S	*	*				44.1	163.1	124.7	-50.4	0	0	0	0	121.6
220	P	48	Very low	29.8	Very low	109 Å²	109	132.6 Å²	132.6	71%	0.708	77%	0.765	S	S	*	*			cis	-136.4	-169.1	1.5	43.6	-25.5	0	0	0	116
221	E	28.2	Very low	29.7	Very low	169 Å²	169	129.1 Å²	129.1	79%	0.79	76%	0.76	S	S	*	*			trans	70.4	143.6	154.9	-85.9	-164	99.6	0	0	120.3
222	N	28.4	Very low	29.9	Very low	121 Å²	121	129.4 Å²	129.4	65%	0.647	76%	0.762	S	S	*	*			cis	-159.7	-171.3	-9.3	-145.7	-13.3	0	0	0	107.3
223	T	26.6	Very low	30.3	Very low	107 Å²	107	130.2 Å²	130.2	66%	0.656	77%	0.765	S	S	*	*			cis	-157.5	164.9	8.9	-26.5	0	0	0	0	111.3
224	K	24.6	Very low	29.5	Very low	198 Å²	198	134 Å²	134	86%	0.861	77%	0.769	S	S	*	*			trans	75.7	139.6	165.5	-63.3	178.4	-179	177.8	0	116.9
225	A	26.1	Very low	29.2	Very low	89 Å²	89	141.3 Å²	141.3	74%	0.736	78%	0.779	S	S	*	*			cis	-157.6	169.1	-10.9	0	0	0	0	0	111.5
226	T	25.1	Very low	29.7	Very low	137 Å²	137	136.9 Å²	136.9	84%	0.84	78%	0.777	S	S	*	*			trans	-145.7	-174.7	-175	52.4	0	0	0	0	109.2
227	P	43.3	Very low	29.7	Very low	105 Å²	105	134.1 Å²	134.1	68%	0.682	77%	0.773	S	S	*	*			cis	-142.7	167	3.3	43.7	-25	0	0	0	118.8
228	V	27.6	Very low	29.8	Very low	133 Å²	133	136.2 Å²	136.2	81%	0.806	77%	0.77	S	S	*	*			trans	65.2	150	134.4	159.6	0	0	0	0	121
229	P	42	Very low	30.2	Very low	102 Å²	102	133.9 Å²	133.9	66%	0.662	76%	0.763	S	S	*	*			cis	-143.9	-155.5	-32.4	43.1	-20.9	0	0	0	115.1
230	E	23.8	Very low	30	Very low	189 Å²	189	134.1 Å²	134.1	88%	0.883	77%	0.765	S	S	*	*			trans	87.8	-178	147.6	-101.5	-177.3	127.5	0	0	124.2
231	A	26.6	Very low	29	Very low	94 Å²	94	137.4 Å²	137.4	78%	0.777	77%	0.768	S	S	*	*			trans	-126.7	-175.7	-142.5	0	0	0	0	0	116.6
232	A	32.2	Very low	28.7	Very low	97 Å²	97	135.1 Å²	135.1	80%	0.802	77%	0.766	S	S	*	*			trans	-90.7	156.3	-160.2	0	0	0	0	0	117.8
233	P	33.1	Very low	28.7	Very low	129 Å²	129	134.8 Å²	134.8	84%	0.838	77%	0.773	S	S	*	*			trans	-130.7	-162.5	147.4	35.7	-20.2	0	0	0	114.3
234	K	24.3	Very low	28.6	Very low	203 Å²	203	137.5 Å²	137.5	88%	0.883	78%	0.784	S	S	*	*			trans	-128.1	152.6	-157.4	-56.7	168.3	178.6	170.1	0	115.9
235	R	22.8	Very low	28.6	Very low	234 Å²	234	131.6 Å²	131.6	88%	0.883	78%	0.779	S	S	*	*			trans	65.2	172.5	149.5	-98.9	-161.1	172.6	-176.6	-1.7	117.6
236	P	38.5	Very low	28.6	Very low	108 Å²	108	135.3 Å²	135.3	70%	0.701	79%	0.787	S	S	*	*			cis	-107.7	-146.8	6.5	25.5	-0.9	0	0	0	112.3
237	E	24.5	Very low	28.7	Very low	163 Å²	163	137.6 Å²	137.6	76%	0.762	79%	0.788	S	S	*	*			cis	-138.6	-118.9	9.1	-72.7	-165.6	155.6	0	0	114.7
238	T	24.7	Very low	27.9	Very low	122 Å²	122	139.1 Å²	139.1	75%	0.748	80%	0.795	S	S	*	*			trans	-170.5	178.2	-146.4	22.3	0	0	0	0	112.4
239	P	34.6	Very low	27.9	Very low	103 Å²	103	138.3 Å²	138.3	67%	0.669	80%	0.795	S	S	*	*			cis	-141.7	171.8	-28	36.9	-18.5	0	0	0	116.9
240	S	25.1	Very low	27.2	Very low	105 Å²	105	138.4 Å²	138.4	73%	0.734	80%	0.804	S	S	*	*			trans	73.5	163	147.7	81.9	0	0	0	0	119.2
241	K	26.7	Very low	27.6	Very low	177 Å²	177	134.6 Å²	134.6	77%	0.77	81%	0.806	S	S	*	*			cis	-160	153.7	6.2	-142.3	165.1	-176.8	178.9	0	111.7
242	T	22.9	Very low	27.6	Very low	121 Å²	121	134.5 Å²	134.5	74%	0.742	81%	0.805	S	S	*	*			trans	20.8	138.2	152.2	53.3	0	0	0	0	121.1
243	S	27	Very low	27.8	Very low	115 Å²	115	136.7 Å²	136.7	80%	0.804	81%	0.808	S	S	*	*				-167.6	-175.9	72.6	55.1	0	0	0	0	115.8
244	N	25	Very low	27.7	Very low	163 Å²	163	135.8 Å²	135.8	87%	0.872	80%	0.803	S	S	*	*			trans	-84.8	169	-171.2	-45.7	-11.6	0	0	0	114.8
245	G	25.2	Very low	27.8	Very low	75 Å²	75	129 Å²	129	77%	0.773	79%	0.791	S	S	*	*			trans	169.9	124.4	159.8	0	0	0	0	0	114.2
246	D	26.3	Very low	28.6	Very low	166 Å²	166	130.2 Å²	130.2	89%	0.888	80%	0.795	S	S	*	*			trans	-90.8	-179.7	-174.4	-75	-79.2	0	0	0	115.4
247	E	25.8	Very low	28.2	Very low	185 Å²	185	130.5 Å²	130.5	86%	0.864	80%	0.799	S	S	*	*			trans	70.8	90.7	160.7	-66.8	-167.3	129.4	0	0	121
248	V	28.2	Very low	28.7	Very low	138 Å²	138	128.5 Å²	128.5	84%	0.836	80%	0.803	S	S	*	*				18.1	111.6	119.8	-171	0	0	0	0	117.7
249	S	26.1	Very low	29.2	Very low	115 Å²	115	125.9 Å²	125.9	80%	0.804	80%	0.801	S	S	*	*				172.9	120.7	110.3	46.9	0	0	0	0	114.4
250	A	27	Very low	29.3	Very low	104 Å²	104	131.3 Å²	131.3	86%	0.86	81%	0.814	S	S	*	*			trans	-179.1	135.6	150	0	0	0	0	0	109
251	A	32.8	Very low	29.8	Very low	110 Å²	110	132.5 Å²	132.5	91%	0.909	82%	0.817	S	S	*	*			trans	-88.3	125.7	176.8	0	0	0	0	0	111.2
252	A	26.4	Very low	30.8	Very low	92 Å²	92	131.2 Å²	131.2	76%	0.76	81%	0.807	S	S	*	*			trans	-141.6	136.7	166.8	0	0	0	0	0	109.4	P254	A252-P254 VanDerWaalsContact O-CD 3.23Å; A252-P254 WeakPolarHBondContact O-CD 3.37Å
253	T	37.5	Very low	31.7	Very low	142 Å²	142	133.9 Å²	133.9	87%	0.871	81%	0.811	S	S	*	*			trans	-82.5	120	-169.4	-47.8	0	0	0	0	112.8
254	P	30.9	Very low	32.5	Very low	111 Å²	111	132.8 Å²	132.8	72%	0.721	81%	0.809	S	S	*	*			trans	-85	142.8	148.7	34	-28.9	0	0	0	108.8	A252	A252-P254 VanDerWaalsContact O-CD 3.23Å; A252-P254 WeakPolarHBondContact O-CD 3.37Å
255	G	26.6	Very low	33.9	Very low	61 Å²	61	128 Å²	128	63%	0.629	78%	0.783	S	S	*	*			cis	101.6	102.2	31.2	0	0	0	0	0	107.1	S257	G255-S257 PolarHBondContact O-N 2.85Å
256	R	39.2	Very low	35.3	Very low	259 Å²	259	129.7 Å²	129.7	98%	0.977	77%	0.774	S	S	*	*			trans	-58	90.3	-166.3	-173.4	-176.4	-171.1	176.5	3.2	112.4
257	S	29.2	Very low	36.8	Very low	113 Å²	113	122.7 Å²	122.7	79%	0.79	74%	0.737	S	S	*	*			trans	-75.3	131.8	177.9	49.3	0	0	0	0	111.6	G255	G255-S257 PolarHBondContact O-N 2.85Å
258	S	35.5	Very low	38.2	Very low	121 Å²	121	118.5 Å²	118.5	85%	0.846	72%	0.715	S	S	*	*			trans	-75	155.8	171.8	45.6	0	0	0	0	111.1
259	G	35.9	Very low	39.3	Very low	68 Å²	68	114.1 Å²	114.1	70%	0.701	69%	0.694	S	S	*	*			trans	83.1	66.1	169.3	0	0	0	0	0	115.5	T261	G259-T261 PolarHBondContact O-N 2.94Å
260	K	36.1	Very low	40.8	Very low	216 Å²	216	110.7 Å²	110.7	94%	0.939	67%	0.665	S	S	*	*			trans	-65.8	88.7	147.8	-85.9	-169.7	174.3	-173.9	0	108.1	R262	K260-R262 PolarHBondContact O-N 2.89Å
261	T	36.7	Very low	42.1	Very low	130 Å²	130	108.8 Å²	108.8	80%	0.798	64%	0.64	S	S	*	*			trans	-48.4	130	164.1	-59.3	0	0	0	0	108.2	G259 Q263	G259-T261 PolarHBondContact O-N 2.94Å; T261-Q263 PolarHBondContact O-N 3.13Å
262	R	46.8	Very low	43.1	Very low	151 Å²	151	110.4 Å²	110.4	57%	0.57	63%	0.629	S	S	*	*			trans	-51.5	112.6	179.3	-82.6	-174.6	169.3	-167.2	-5.8	109.3	K260 A264 D538	K260-R262 PolarHBondContact O-N 2.89Å; R262-A264 PolarHBondContact O-N 3.42Å; R262-D538 IonicContact CZ-OD1 3.76Å; R262-D538 IonicContact NH1-OD1 2.74Å; R262-D538 PolarHBondContact NH1-OD1 3.09Å; R262-D538 IonicContact NH2-OD1 3.71Å; R262-D538 PolarHBondContact NH2-OD1 2.97Å
263	Q	41.2	Very low	44.4	Very low	177 Å²	177	114.4 Å²	114.4	83%	0.827	62%	0.624	S	S	*	*			trans	-65.5	106.3	155.3	-77.3	-178.9	-33.1	0	0	105.3	T261 I265	T261-Q263 PolarHBondContact O-N 3.13Å; Q263-I265 VanDerWaalsContact C-N 3.26Å; Q263-I265 PolarHBondContact O-N 3.39Å
264	A	44	Very low	45.3	Very low	91 Å²	91	111.2 Å²	111.2	75%	0.752	60%	0.596	S	S	*	*			trans	-65.7	93.8	171.2	0	0	0	0	0	107.2	R262 N266	R262-A264 PolarHBondContact O-N 3.42Å; A264-N266 PolarHBondContact O-N 3.08Å
265	I	54.6	Low	46.3	Very low	64 Å²	64	108.6 Å²	108.6	33%	0.328	57%	0.574	S	S	.	*			trans	-52.8	126.4	177.5	-60.6	175.4	0	0	0	107	Q263 I267 E270	Q263-I265 VanDerWaalsContact C-N 3.26Å; Q263-I265 PolarHBondContact O-N 3.39Å; I265-I267 WeakPolarHBondContact O-CD1 3.45Å; I265-I267 WeakPolarHBondContact O-CG1 3.36Å; I265-I267 PolarHBondContact O-N 2.71Å; I265-E270 HydrophobicContact CG2-CB 3.84Å; I265-E270 HydrophobicContact CG2-CG 3.85Å
266	N	54.7	Low	47.4	Very low	110 Å²	110	109.4 Å²	109.4	59%	0.588	58%	0.583	S	S	*	*			trans	-74.4	83.4	178.8	-174.9	-0.4	0	0	0	108.8	A264 K268 A269 E270	A264-N266 PolarHBondContact O-N 3.08Å; N266-K268 PolarHBondContact O-N 3.39Å; N266-A269 HydrophobicContact CB-CB 4.37Å; N266-A269 PolarHBondContact O-N 2.94Å; N266-E270 PolarHBondContact O-N 3Å
267	I	58.4	Low	48.2	Very low	19 Å²	19	99.6 Å²	99.6	10%	0.097	56%	0.563	C	S	.	*	H	α-helix	trans	-51.7	-33.4	-170.3	-66.4	127.4	0	0	0	112.4	I265 L271 I504 F533 W563 V565	I265-I267 WeakPolarHBondContact O-CD1 3.45Å; I265-I267 WeakPolarHBondContact O-CG1 3.36Å; I265-I267 PolarHBondContact O-N 2.71Å; I267-L271 WeakPolarHBondContact O-CB 3.24Å; I267-L271 PolarHBondContact O-N 3.07Å; I267-I504 HydrophobicContact CG2-CG2 4.28Å; I267-F533 HydrophobicContact CD1-CD1 4.02Å; I267-F533 HydrophobicContact CD1-CD2 3.53Å; I267-F533 HydrophobicContact CD1-CE1 4.01Å; I267-F533 HydrophobicContact CD1-CE2 3.53Å; I267-F533 HydrophobicContact CD1-CG 3.79Å; I267-F533 HydrophobicContact CD1-CZ 3.78Å; I267-F533 HydrophobicContact CG1-CD2 4.39Å; I267-F533 HydrophobicContact CG2-CB 4.47Å; I267-W563 HydrophobicContact CG2-CE3 4.4Å; I267-W563 HydrophobicContact CG2-CZ3 4.33Å; I267-V565 HydrophobicContact CG2-CG1 3.38Å
268	K	55	Low	50.3	Low	96 Å²	96	96.9 Å²	96.9	42%	0.417	54%	0.536	S	S	.	.	H	α-helix	trans	-66.9	-44.8	176.8	-75.8	174.9	168.9	167.1	0	112.7	N266 E272 D505	N266-K268 PolarHBondContact O-N 3.39Å; K268-E272 WeakPolarHBondContact O-CG 3.28Å; K268-E272 PolarHBondContact O-N 3.19Å; K268-D505 IonicContact NZ-OD1 2.7Å; K268-D505 PolarHBondContact NZ-OD1 2.81Å; K268-D505 IonicContact NZ-OD2 3.43Å; K268-D505 PolarHBondContact NZ-OD2 3.03Å
269	A	51.7	Low	52.4	Low	47 Å²	47	93.7 Å²	93.7	39%	0.388	51%	0.513	S	S	.	.	H	α-helix	trans	-72.7	-33.8	175.7	0	0	0	0	0	112.6	N266 R273	N266-A269 HydrophobicContact CB-CB 4.37Å; N266-A269 PolarHBondContact O-N 2.94Å; A269-R273 WeakPolarHBondContact O-CB 3.34Å; A269-R273 PolarHBondContact O-N 2.8Å; A269-R273 VanDerWaalsContact O-N 3.13Å
270	E	56.1	Low	54.7	Low	43 Å²	43	91.3 Å²	91.3	20%	0.201	48%	0.484	C	S	.	.	H	α-helix	trans	-76.5	-25.4	179.1	-165.1	58.7	-165.8	0	0	112.2	I265 N266 R273 R274 W563	I265-E270 HydrophobicContact CG2-CB 3.84Å; I265-E270 HydrophobicContact CG2-CG 3.85Å; N266-E270 PolarHBondContact O-N 3Å; E270-R273 PolarHBondContact O-N 3.08Å; E270-R273 IonicContact OE1-CZ 3.32Å; E270-R273 IonicContact OE1-NE 2.72Å; E270-R273 PolarHBondContact OE1-NE 2.66Å; E270-R273 IonicContact OE1-NH2 3.4Å; E270-R273 PolarHBondContact OE1-NH2 3.05Å; E270-R273 IonicContact OE2-CZ 2.77Å; E270-R273 IonicContact OE2-NE 3.19Å; E270-R273 PolarHBondContact OE2-NE 3.26Å; E270-R273 IonicContact OE2-NH2 3.52Å; E270-R273 PolarHBondContact OE2-NH2 2.86Å; E270-R274 WeakPolarHBondContact O-CB 3.38Å; E270-R274 PolarHBondContact O-N 2.99Å; E270-W563 HydrophobicContact CB-CZ2 3.96Å; E270-W563 HydrophobicContact CG-CZ2 3.64Å
271	L	54.2	Low	57.3	Low	64 Å²	64	81 Å²	81	34%	0.335	44%	0.44	S	S	.	.	H	α-helix	trans	-65.9	-49.6	168.6	-176.3	71.2	0	0	0	111.7	I267 R273 R274 I504 W563 V565	I267-L271 WeakPolarHBondContact O-CB 3.24Å; I267-L271 PolarHBondContact O-N 3.07Å; L271-R273 PolarHBondContact O-N 2.73Å; L271-R274 PolarHBondContact O-N 3.21Å; L271-I504 HydrophobicContact CD2-CD1 3.84Å; L271-W563 HydrophobicContact CB-CH2 4.17Å; L271-W563 HydrophobicContact CD1-CH2 4.04Å; L271-W563 HydrophobicContact CD1-CZ3 4.35Å; L271-V565 HydrophobicContact CD1-CG2 3.79Å
272	E	54.6	Low	59.9	Low	143 Å²	143	74.9 Å²	74.9	67%	0.668	40%	0.402	S	S	*	.	H	α-helix	trans	-56.9	-36.2	174.3	-69.3	171.3	165.6	0	0	111.2	K268 G277	K268-E272 WeakPolarHBondContact O-CG 3.28Å; K268-E272 PolarHBondContact O-N 3.19Å; E272-G277 PolarHBondContact O-N 3.17Å; E272-G277 VanDerWaalsContact O-N 3.14Å
273	R	54.5	Low	62.1	Low	177 Å²	177	67.7 Å²	67.7	67%	0.668	38%	0.375	S	S	*	.	H	α-helix	trans	-74.6	-34.2	178.1	-158.9	172.1	79.5	94.8	3.9	114.3	A269 E270 L271	A269-R273 WeakPolarHBondContact O-CB 3.34Å; A269-R273 PolarHBondContact O-N 2.8Å; A269-R273 VanDerWaalsContact O-N 3.13Å; E270-R273 PolarHBondContact O-N 3.08Å; E270-R273 IonicContact OE1-CZ 3.32Å; E270-R273 IonicContact OE1-NE 2.72Å; E270-R273 PolarHBondContact OE1-NE 2.66Å; E270-R273 IonicContact OE1-NH2 3.4Å; E270-R273 PolarHBondContact OE1-NH2 3.05Å; E270-R273 IonicContact OE2-CZ 2.77Å; E270-R273 IonicContact OE2-NE 3.19Å; E270-R273 PolarHBondContact OE2-NE 3.26Å; E270-R273 IonicContact OE2-NH2 3.52Å; E270-R273 PolarHBondContact OE2-NH2 2.86Å; L271-R273 PolarHBondContact O-N 2.73Å
274	R	55.4	Low	64.6	Low	75 Å²	75	59.3 Å²	59.3	28%	0.283	34%	0.335	S	S	.	.	H	α-helix	trans	-72.5	-31.2	-164.9	-111	-159.2	-171.9	160.9	0.1	116.4	E270 L271 W563	E270-R274 WeakPolarHBondContact O-CB 3.38Å; E270-R274 PolarHBondContact O-N 2.99Å; L271-R274 PolarHBondContact O-N 3.21Å; R274-W563 HydrophobicContact CB-CZ2 4.39Å; R274-W563 VanDerWaalsContact CD-CZ2 3.41Å; R274-W563 HydrophobicContact CG-CH2 4.45Å; R274-W563 HydrophobicContact CG-CZ2 3.88Å; R274-W563 VanDerWaalsContact NH1-CD2 3.3Å; R274-W563 VanDerWaalsContact NH1-CE2 3.31Å; R274-W563 PolarHBondContact NH1-O 3.5Å; R274-W563 VanDerWaalsContact NH2-CD1 3.28Å; R274-W563 PolarHBondContact NH2-O 3.47Å
275	Q	51.4	Low	67	Low	55 Å²	55	55 Å²	55	26%	0.257	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	24.9	-178.6	-64.6	-171.9	-0.5	0	0	112.1	G277 K278	Q275-G277 PolarHBondContact O-N 2.75Å; Q275-K278 HydrophobicContact CB-CB 4.25Å; Q275-K278 WeakPolarHBondContact CB-O 3.34Å; Q275-K278 WeakPolarHBondContact O-CB 3.4Å; Q275-K278 PolarHBondContact O-N 3.16Å; Q275-K278 PolarHBondContact OE1-O 2.78Å
276	G	49.6	Very low	68.9	Low	78 Å²	78	52 Å²	52	80%	0.804	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	28.1	-176.2	0	0	0	0	0	113.6
277	G	57.5	Low	70.7	Confident	54 Å²	54	46.7 Å²	46.7	56%	0.557	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	-3.5	-173.9	0	0	0	0	0	116.4	E272 Q275 P279	E272-G277 PolarHBondContact O-N 3.17Å; E272-G277 VanDerWaalsContact O-N 3.14Å; Q275-G277 PolarHBondContact O-N 2.75Å; G277-P279 WeakPolarHBondContact O-CD 3.28Å
278	K	72.6	Confident	72.3	Confident	55 Å²	55	47.2 Å²	47.2	24%	0.239	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-67.1	129.3	171.9	-64.3	-170	-176.4	-174	0	110.3	Q275 E354 T355 S357 V359	Q275-K278 HydrophobicContact CB-CB 4.25Å; Q275-K278 WeakPolarHBondContact CB-O 3.34Å; Q275-K278 WeakPolarHBondContact O-CB 3.4Å; Q275-K278 PolarHBondContact O-N 3.16Å; Q275-K278 PolarHBondContact OE1-O 2.78Å; K278-E354 IonicContact NZ-OE2 3.59Å; K278-E354 PolarHBondContact NZ-OE2 3.46Å; K278-T355 PolarHBondContact NZ-O 3.19Å; K278-S357 WeakPolarHBondContact CA-O 3.49Å; K278-V359 HydrophobicContact CB-CG2 4.33Å; K278-V359 HydrophobicContact CD-CG2 4.18Å
279	P	79.1	Confident	73.8	Confident	55 Å²	55	44.4 Å²	44.4	36%	0.357	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-86.4	148.5	171	32.8	-32.3	0	0	0	112	G277 S357 K358 V359 A499	G277-P279 WeakPolarHBondContact O-CD 3.28Å; P279-S357 VanDerWaalsContact CD-O 3.3Å; P279-S357 WeakPolarHBondContact CD-O 3.41Å; P279-K358 HydrophobicContact CG-CD 4.42Å; P279-K358 HydrophobicContact CG-CG 4.09Å; P279-K358 WeakPolarHBondContact O-CB 3.42Å; P279-V359 PolarHBondContact O-N 3.1Å; P279-A499 HydrophobicContact CB-CB 4.06Å; P279-A499 HydrophobicContact CG-CB 4.16Å
280	L	84.6	Confident	75.5	Confident	18 Å²	18	46.3 Å²	46.3	9%	0.094	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	136.6	171	-79.2	162.3	0	0	0	112.2	V359 R502 D568	L280-V359 WeakPolarHBondContact CA-O 3.45Å; L280-V359 HydrophobicContact CD2-CB 3.81Å; L280-V359 HydrophobicContact CD2-CG1 3.72Å; L280-R502 PolarHBondContact O-NH2 3.5Å; L280-D568 WeakPolarHBondContact CD1-OD1 3.15Å
281	L	89.7	Confident	77	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	125.4	175.1	-168	71.1	0	0	0	110.9	K358 V359 V360 T361 D383 V384 F497	L281-K358 HydrophobicContact CB-CD 4.33Å; L281-K358 HydrophobicContact CD2-CD 4.22Å; L281-V359 PolarHBondContact N-O 3Å; L281-V360 WeakPolarHBondContact O-CA 3.24Å; L281-T361 PolarHBondContact O-N 3.46Å; L281-D383 HydrophobicContact CD1-CB 4.17Å; L281-V384 HydrophobicContact CD1-CG2 3.84Å; L281-V384 HydrophobicContact CD2-CG2 4.2Å; L281-V384 HydrophobicContact CG-CG2 4.24Å; L281-F497 HydrophobicContact CD2-CB 4.17Å
282	N	91.3	Very high	78.7	Confident	1 Å²	1	42 Å²	42	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	122.5	177	-60.5	-15.4	0	0	0	109.1	M363 Q381 D383 V384 G567 H569	N282-M363 HydrophobicContact CB-CE 3.8Å; N282-Q381 PolarHBondContact ND2-O 3.4Å; N282-D383 WeakPolarHBondContact CB-OD2 3.44Å; N282-D383 PolarHBondContact N-OD2 3.2Å; N282-D383 PolarHBondContact O-N 2.78Å; N282-V384 PolarHBondContact O-N 3.09Å; N282-G567 PolarHBondContact ND2-O 2.96Å; N282-G567 VanDerWaalsContact ND2-O 3.07Å; N282-H569 VanDerWaalsContact CB-NE2 3.34Å; N282-H569 WeakPolarHBondContact CB-NE2 3.41Å; N282-H569 PolarHBondContact ND2-CD2 3.32Å; N282-H569 PolarHBondContact ND2-NE2 2.65Å; N282-H569 PolarHBondContact OD1-NE2 2.67Å
283	L	93.4	Very high	80.4	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122.2	-172.3	-177.2	152.2	0	0	0	110.7	V285 V360 T361 L362 M363 V384 V386 I494	L283-V285 HydrophobicContact CD2-CG2 3.81Å; L283-V360 HydrophobicContact CB-CG1 3.86Å; L283-V360 HydrophobicContact CD1-CG1 4.37Å; L283-T361 PolarHBondContact N-O 3.3Å; L283-L362 HydrophobicContact CD2-CD1 3.57Å; L283-L362 CarbonylContact O-C 3.52Å; L283-L362 WeakPolarHBondContact O-CA 3.44Å; L283-M363 PolarHBondContact O-N 2.94Å; L283-V384 WeakPolarHBondContact CA-O 3.47Å; L283-V384 HydrophobicContact CD1-CG1 4.48Å; L283-V386 HydrophobicContact CD1-CG2 3.94Å; L283-V386 HydrophobicContact CD2-CG2 3.78Å; L283-V386 HydrophobicContact CG-CG2 4.13Å; L283-I494 HydrophobicContact CD1-CB 4.42Å; L283-I494 HydrophobicContact CD1-CD1 3.98Å; L283-I494 HydrophobicContact CD1-CG1 3.79Å; L283-I494 HydrophobicContact CD1-CG2 3.84Å
284	V	94.7	Very high	82.2	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	141.4	173.9	66.4	0	0	0	0	111.6	I286 M363 A365 A379 A382 V384 A385 V386	V284-I286 HydrophobicContact CG1-CG2 4.25Å; V284-I286 HydrophobicContact CG2-CG2 4Å; V284-M363 CarbonylContact C-O 3.48Å; V284-M363 WeakPolarHBondContact CA-O 3.46Å; V284-M363 HydrophobicContact CB-CB 4.41Å; V284-M363 HydrophobicContact CG2-CB 4.34Å; V284-A365 HydrophobicContact CG2-CB 3.86Å; V284-A379 HydrophobicContact CG1-CB 4.13Å; V284-A379 HydrophobicContact CG2-CB 4.24Å; V284-A382 HydrophobicContact CB-CB 3.62Å; V284-A382 HydrophobicContact CG1-CB 3.62Å; V284-V384 PolarHBondContact N-O 3.35Å; V284-A385 HydrophobicContact CG1-CB 3.7Å; V284-A385 CarbonylContact O-C 3.59Å; V284-A385 VanDerWaalsContact O-CA 3.23Å; V284-A385 WeakPolarHBondContact O-CA 3.48Å; V284-V386 PolarHBondContact O-N 2.97Å
285	V	94.6	Very high	84	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	126.4	175	-174.9	0	0	0	0	109.2	L283 K293 M297 L362 M363 A365 V386 V388	L283-V285 HydrophobicContact CD2-CG2 3.81Å; V285-K293 HydrophobicContact CG1-CB 3.99Å; V285-K293 HydrophobicContact CG1-CG 4.32Å; V285-M297 HydrophobicContact CB-CG 4.37Å; V285-M297 HydrophobicContact CG1-CG 4.18Å; V285-M297 HydrophobicContact CG2-CG 3.77Å; V285-M297 HydrophobicContact CG2-SD 3.69Å; V285-L362 HydrophobicContact CG2-CD1 3.52Å; V285-M363 PolarHBondContact N-O 3.37Å; V285-A365 WeakPolarHBondContact O-CB 3.4Å; V285-A365 PolarHBondContact O-N 2.9Å; V285-A365 VanDerWaalsContact O-N 3.14Å; V285-V386 WeakPolarHBondContact CA-O 3.15Å; V285-V386 HydrophobicContact CG2-CB 4.33Å; V285-V388 HydrophobicContact CG1-CG2 3.61Å
286	I	94.3	Very high	85.9	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	150.8	-173.2	63.9	177.9	0	0	0	109.7	V284 A365 M375 A385 V386 L387 V388 H409 V413	V284-I286 HydrophobicContact CG1-CG2 4.25Å; V284-I286 HydrophobicContact CG2-CG2 4Å; I286-A365 HydrophobicContact CG2-CB 4.46Å; I286-M375 HydrophobicContact CG2-CG 4.37Å; I286-M375 HydrophobicContact CG2-SD 4.25Å; I286-A385 HydrophobicContact CD1-CB 4.28Å; I286-V386 PolarHBondContact N-O 3.08Å; I286-L387 HydrophobicContact CD1-CB 4.34Å; I286-L387 HydrophobicContact CD1-CD1 3.93Å; I286-L387 HydrophobicContact CG1-CB 4.13Å; I286-L387 HydrophobicContact CG1-CD1 3.73Å; I286-L387 CarbonylContact O-C 3.51Å; I286-L387 WeakPolarHBondContact O-CA 3.23Å; I286-V388 PolarHBondContact O-N 3.04Å; I286-H409 HydrophobicContact CB-CB 4.16Å; I286-H409 HydrophobicContact CD1-CB 4.26Å; I286-V413 HydrophobicContact CD1-CB 4.04Å; I286-V413 HydrophobicContact CD1-CG1 4.33Å; I286-V413 HydrophobicContact CD1-CG2 3.6Å; I286-V413 HydrophobicContact CG2-CG2 4.04Å
287	G	92.6	Very high	87.9	Confident	0 Å²	0	19 Å²	19	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.8	-176.5	177.5	0	0	0	0	0	112.1	V388 H409	G287-V388 VanDerWaalsContact CA-O 3.3Å; G287-V388 WeakPolarHBondContact CA-O 3.31Å; G287-H409 PolarHBondContact N-ND1 3.03Å; G287-H409 PolarHBondContact O-CE1 3.33Å; G287-H409 PolarHBondContact O-ND1 3.31Å
288	H	90.9	Very high	89.5	Confident	30 Å²	30	16.4 Å²	16.4	14%	0.139	9%	0.093	C	C	.	.			trans	-59.1	168.3	171.6	-160.8	22.3	0	0	0	111.2	D290 A291 K293 Q405	H288-D290 IonicContact NE2-OD2 2.8Å; H288-A291 HydrophobicContact CB-CB 3.98Å; H288-K293 PolarHBondContact O-NZ 3.4Å; H288-Q405 PolarHBondContact ND1-OE1 2.9Å
289	V	86.9	Confident	90.4	Very high	37 Å²	37	14.3 Å²	14.3	22%	0.224	8%	0.084	C	C	.	.	S	Bend	trans	-56.3	-61.6	169.4	177.2	0	0	0	0	109	A291 K293 Q405	V289-A291 VanDerWaalsContact C-N 3.29Å; V289-A291 PolarHBondContact O-N 3.16Å; V289-K293 PolarHBondContact O-NZ 3.06Å; V289-Q405 VanDerWaalsContact N-OE1 3.14Å
290	D	86.8	Confident	91	Very high	87 Å²	87	11.8 Å²	11.8	47%	0.465	7%	0.068	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-11.1	-167.7	-52	-77	0	0	0	114.7	H288 G292 E395 K427	H288-D290 IonicContact NE2-OD2 2.8Å; D290-G292 PolarHBondContact O-N 2.72Å; D290-E395 VanDerWaalsContact CB-OE2 3.3Å; D290-E395 WeakPolarHBondContact CB-OE2 3.41Å; D290-K427 VanDerWaalsContact O-CE 3.27Å; D290-K427 WeakPolarHBondContact O-CE 3.36Å; D290-K427 PolarHBondContact O-NZ 2.99Å
291	A	88.9	Confident	91.4	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-1.2	177.6	0	0	0	0	0	114.2	H288 V289 V388 N426	H288-A291 HydrophobicContact CB-CB 3.98Å; V289-A291 VanDerWaalsContact C-N 3.29Å; V289-A291 PolarHBondContact O-N 3.16Å; A291-V388 HydrophobicContact CB-CG1 4.24Å; A291-V388 WeakPolarHBondContact O-CG1 3.42Å; A291-N426 PolarHBondContact O-ND2 3.32Å
292	G	89.1	Confident	91.4	Very high	16 Å²	16	14.1 Å²	14.1	17%	0.165	8%	0.076	C	C	.	.			trans	72.2	34.2	167.3	0	0	0	0	0	115.4	D290 T295 L296	D290-G292 PolarHBondContact O-N 2.72Å; G292-T295 PolarHBondContact O-N 2.7Å; G292-L296 VanDerWaalsContact O-CB 3.3Å; G292-L296 WeakPolarHBondContact O-CB 3.32Å; G292-L296 PolarHBondContact O-N 3.43Å
293	K	91.6	Very high	91.3	Very high	10 Å²	10	17.5 Å²	17.5	4%	0.043	9%	0.093	C	C	.	.	H	α-helix	trans	-48.1	-61.3	-179.7	-58.1	173	-56	-54.8	0	112.7	V285 H288 V289 T295 L296 M297 A365 V388	V285-K293 HydrophobicContact CG1-CB 3.99Å; V285-K293 HydrophobicContact CG1-CG 4.32Å; H288-K293 PolarHBondContact O-NZ 3.4Å; V289-K293 PolarHBondContact O-NZ 3.06Å; K293-T295 PolarHBondContact O-N 3.14Å; K293-L296 WeakPolarHBondContact O-CB 3.39Å; K293-L296 PolarHBondContact O-N 2.92Å; K293-M297 WeakPolarHBondContact O-CG 3.39Å; K293-M297 PolarHBondContact O-N 3.29Å; K293-A365 WeakPolarHBondContact CE-O 3.34Å; K293-V388 HydrophobicContact CG-CB 4.19Å; K293-V388 HydrophobicContact CG-CG2 4.23Å
294	S	92	Very high	91	Very high	9 Å²	9	19.8 Å²	19.8	6%	0.063	11%	0.105	C	C	.	.	H	α-helix	trans	-65.6	-38.1	-175.2	-35.8	0	0	0	0	111.5	M297 G298 T345 D364	S294-M297 PolarHBondContact O-N 2.68Å; S294-G298 PolarHBondContact O-N 2.67Å; S294-T345 PolarHBondContact OG-OG1 2.98Å; S294-T345 VanDerWaalsContact OG-OG1 3.1Å; S294-D364 VanDerWaalsContact CA-OD2 3.26Å; S294-D364 WeakPolarHBondContact CA-OD2 3.46Å; S294-D364 WeakPolarHBondContact CB-OD2 3.36Å; S294-D364 PolarHBondContact OG-OD2 2.82Å
295	T	92	Very high	90.6	Very high	25 Å²	25	22.2 Å²	22.2	15%	0.153	13%	0.13	C	C	.	.	H	α-helix	trans	-62.1	-48.3	172	-47.6	0	0	0	0	112.1	G292 K293 M297 H299 Y329	G292-T295 PolarHBondContact O-N 2.7Å; K293-T295 PolarHBondContact O-N 3.14Å; T295-M297 VanDerWaalsContact C-N 3.28Å; T295-M297 PolarHBondContact O-N 2.89Å; T295-H299 WeakPolarHBondContact O-CB 3.19Å; T295-H299 PolarHBondContact O-N 2.91Å; T295-Y329 HydrophobicContact CG2-CD2 4.27Å
296	L	92.3	Very high	90.2	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.1	-39	178.1	-173.6	77.7	0	0	0	111.2	G292 K293 L300 V388 A424 L472 L490	G292-L296 VanDerWaalsContact O-CB 3.3Å; G292-L296 WeakPolarHBondContact O-CB 3.32Å; G292-L296 PolarHBondContact O-N 3.43Å; K293-L296 WeakPolarHBondContact O-CB 3.39Å; K293-L296 PolarHBondContact O-N 2.92Å; L296-L300 WeakPolarHBondContact O-CB 3.19Å; L296-L300 PolarHBondContact O-N 3.21Å; L296-L300 VanDerWaalsContact O-N 3.15Å; L296-V388 HydrophobicContact CD2-CG1 3.93Å; L296-V388 HydrophobicContact CD2-CG2 3.78Å; L296-A424 HydrophobicContact CD2-CB 4Å; L296-L472 HydrophobicContact CD1-CD2 3.61Å; L296-L472 HydrophobicContact CG-CD2 4.05Å; L296-L490 HydrophobicContact CD2-CD2 4.21Å
297	M	91.6	Very high	89.8	Confident	1 Å²	1	27 Å²	27	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-80.1	-43.9	-178.9	-71.3	-55.9	101	0	0	114	V285 K293 S294 T295 H299 L300 L301 L333 L362 L490	V285-M297 HydrophobicContact CB-CG 4.37Å; V285-M297 HydrophobicContact CG1-CG 4.18Å; V285-M297 HydrophobicContact CG2-CG 3.77Å; V285-M297 HydrophobicContact CG2-SD 3.69Å; K293-M297 WeakPolarHBondContact O-CG 3.39Å; K293-M297 PolarHBondContact O-N 3.29Å; S294-M297 PolarHBondContact O-N 2.68Å; T295-M297 VanDerWaalsContact C-N 3.28Å; T295-M297 PolarHBondContact O-N 2.89Å; M297-H299 VanDerWaalsContact C-N 3.26Å; M297-H299 PolarHBondContact O-N 2.84Å; M297-L300 HydrophobicContact CE-CD2 4.14Å; M297-L300 WeakPolarHBondContact O-CA 3.39Å; M297-L300 WeakPolarHBondContact O-CB 3.23Å; M297-L300 PolarHBondContact O-N 3.4Å; M297-L300 VanDerWaalsContact O-N 3.08Å; M297-L300 HydrophobicContact SD-CD2 4.18Å; M297-L301 WeakPolarHBondContact O-CG 3.49Å; M297-L301 PolarHBondContact O-N 3.37Å; M297-L333 HydrophobicContact CB-CD1 3.58Å; M297-L362 HydrophobicContact CB-CD2 4.08Å; M297-L362 HydrophobicContact CG-CD1 4.32Å; M297-L362 HydrophobicContact CG-CD2 4.19Å; M297-L362 HydrophobicContact SD-CD1 3.81Å; M297-L362 HydrophobicContact SD-CD2 4.04Å; M297-L490 HydrophobicContact CE-CD2 3.99Å
298	G	91.8	Very high	89.7	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.3	-36.8	174.5	0	0	0	0	0	112.1	S294 L301 Y302 Y329	S294-G298 PolarHBondContact O-N 2.67Å; G298-L301 PolarHBondContact O-N 3.48Å; G298-Y302 WeakPolarHBondContact O-CB 3.38Å; G298-Y302 PolarHBondContact O-N 3.4Å; G298-Y329 WeakPolarHBondContact CA-O 3.31Å
299	H	91.5	Very high	89.6	Confident	11 Å²	11	38.6 Å²	38.6	5%	0.051	21%	0.212	C	C	.	.	H	α-helix	trans	-68.5	-38.6	171.7	-161.3	171.3	0	0	0	111.9	T295 M297 L301 Y302 L303 Y329 G466 G469 L472	T295-H299 WeakPolarHBondContact O-CB 3.19Å; T295-H299 PolarHBondContact O-N 2.91Å; M297-H299 VanDerWaalsContact C-N 3.26Å; M297-H299 PolarHBondContact O-N 2.84Å; H299-L301 PolarHBondContact O-N 3.44Å; H299-Y302 PolarHBondContact O-N 2.57Å; H299-L303 WeakPolarHBondContact O-CG 3.44Å; H299-L303 PolarHBondContact O-N 2.9Å; H299-Y329 HydrophobicContact CB-CD1 3.89Å; H299-Y329 HydrophobicContact CB-CD2 4.33Å; H299-Y329 HydrophobicContact CB-CE1 4.17Å; H299-Y329 HydrophobicContact CB-CG 3.99Å; H299-Y329 AromaticContact CD2-CE1 3.74Å; H299-Y329 AromaticContact CD2-CZ 3.88Å; H299-Y329 AromaticContact CE1-CZ 3.91Å; H299-Y329 AromaticContact CG-CE1 3.88Å; H299-Y329 AromaticContact CG-CZ 3.91Å; H299-Y329 AromaticContact ND1-CE2 3.92Å; H299-Y329 AromaticContact ND1-CZ 3.92Å; H299-Y329 AromaticContact NE2-CZ 3.92Å; H299-G466 PolarHBondContact ND1-O 3.22Å; H299-G469 WeakPolarHBondContact CE1-CA 3.49Å; H299-G469 PolarHBondContact CE1-N 3.43Å; H299-L472 HydrophobicContact CB-CD1 3.98Å
300	L	91.3	Very high	89.8	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-59.8	-45	172.9	-177.7	64.9	0	0	0	111.7	L296 M297 Y302 L303 L304 L472 T473 I494	L296-L300 WeakPolarHBondContact O-CB 3.19Å; L296-L300 PolarHBondContact O-N 3.21Å; L296-L300 VanDerWaalsContact O-N 3.15Å; M297-L300 HydrophobicContact CE-CD2 4.14Å; M297-L300 WeakPolarHBondContact O-CA 3.39Å; M297-L300 WeakPolarHBondContact O-CB 3.23Å; M297-L300 PolarHBondContact O-N 3.4Å; M297-L300 VanDerWaalsContact O-N 3.08Å; M297-L300 HydrophobicContact SD-CD2 4.18Å; L300-Y302 PolarHBondContact O-N 3.48Å; L300-L303 PolarHBondContact O-N 3.29Å; L300-L304 HydrophobicContact CD1-CD1 4.41Å; L300-L304 HydrophobicContact CG-CD1 4.11Å; L300-L304 WeakPolarHBondContact O-CB 3.37Å; L300-L304 VanDerWaalsContact O-CG 3.27Å; L300-L304 WeakPolarHBondContact O-CG 3.33Å; L300-L304 PolarHBondContact O-N 2.84Å; L300-L472 HydrophobicContact CD1-CB 4.18Å; L300-T473 HydrophobicContact CD1-CG2 3.72Å; L300-I494 HydrophobicContact CD2-CD1 4.3Å
301	L	91.3	Very high	89.9	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-65.2	-35.6	176.3	-68.4	172.8	0	0	0	112.9	M297 G298 H299 G305 N306 V307 V332 L333 T351 F353 L362	M297-L301 WeakPolarHBondContact O-CG 3.49Å; M297-L301 PolarHBondContact O-N 3.37Å; G298-L301 PolarHBondContact O-N 3.48Å; H299-L301 PolarHBondContact O-N 3.44Å; L301-G305 PolarHBondContact O-N 2.88Å; L301-N306 HydrophobicContact CD2-CB 4.42Å; L301-N306 PolarHBondContact O-N 2.97Å; L301-N306 VanDerWaalsContact O-N 3.16Å; L301-V307 HydrophobicContact CB-CG2 4.11Å; L301-V332 HydrophobicContact CB-CG1 4.41Å; L301-V332 HydrophobicContact CD1-CG1 3.96Å; L301-L333 HydrophobicContact CD1-CD2 3.88Å; L301-L333 HydrophobicContact CD1-CG 4.42Å; L301-T351 HydrophobicContact CD1-CG2 4.26Å; L301-F353 HydrophobicContact CD2-CB 3.96Å; L301-F353 HydrophobicContact CD2-CD1 4.04Å; L301-F353 HydrophobicContact CD2-CG 4.33Å; L301-L362 HydrophobicContact CD1-CD2 4.29Å; L301-L362 HydrophobicContact CG-CD2 4.49Å
302	Y	90.8	Very high	89.9	Confident	64 Å²	64	46.2 Å²	46.2	25%	0.251	24%	0.237	S	C	.	.	H	α-helix	trans	-66	-44.7	173	176.7	-113.5	0	0	0	112.2	G298 H299 L300 L304 G305 K309 M312 Y329	G298-Y302 WeakPolarHBondContact O-CB 3.38Å; G298-Y302 PolarHBondContact O-N 3.4Å; H299-Y302 PolarHBondContact O-N 2.57Å; L300-Y302 PolarHBondContact O-N 3.48Å; Y302-L304 VanDerWaalsContact C-N 3.34Å; Y302-L304 PolarHBondContact O-N 3.25Å; Y302-G305 PolarHBondContact O-N 2.83Å; Y302-G305 VanDerWaalsContact O-N 3.09Å; Y302-K309 HydrophobicContact CE2-CG 3.97Å; Y302-M312 HydrophobicContact CD2-CB 3.99Å; Y302-M312 HydrophobicContact CD2-CG 3.84Å; Y302-M312 HydrophobicContact CD2-SD 4.44Å; Y302-M312 HydrophobicContact CE2-CB 3.92Å; Y302-M312 HydrophobicContact CE2-CG 3.83Å; Y302-M312 HydrophobicContact CG-CG 4.45Å; Y302-Y329 AromaticContact CD1-CE1 3.94Å; Y302-Y329 HydrophobicContact CD1-CE1 3.94Å; Y302-Y329 HydrophobicContact CG-CE1 4.31Å
303	L	89.5	Confident	90	Very high	71 Å²	71	50.4 Å²	50.4	37%	0.372	25%	0.252	S	S	.	.	H	α-helix	trans	-69.1	-29.3	178.1	-69.7	173.3	0	0	0	113.4	H299 L300 L472 T473	H299-L303 WeakPolarHBondContact O-CG 3.44Å; H299-L303 PolarHBondContact O-N 2.9Å; L300-L303 PolarHBondContact O-N 3.29Å; L303-L472 HydrophobicContact CD1-CB 3.86Å; L303-L472 HydrophobicContact CD1-CD1 3.8Å; L303-L472 HydrophobicContact CD1-CG 4.45Å; L303-T473 HydrophobicContact CB-CG2 3.63Å; L303-T473 HydrophobicContact CD1-CG2 4.32Å
304	L	87.4	Confident	90	Very high	48 Å²	48	55 Å²	55	25%	0.251	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-14.6	171.4	-71.6	168.6	0	0	0	113	L300 Y302 N306 F353 T473 L491	L300-L304 HydrophobicContact CD1-CD1 4.41Å; L300-L304 HydrophobicContact CG-CD1 4.11Å; L300-L304 WeakPolarHBondContact O-CB 3.37Å; L300-L304 VanDerWaalsContact O-CG 3.27Å; L300-L304 WeakPolarHBondContact O-CG 3.33Å; L300-L304 PolarHBondContact O-N 2.84Å; Y302-L304 VanDerWaalsContact C-N 3.34Å; Y302-L304 PolarHBondContact O-N 3.25Å; L304-N306 VanDerWaalsContact C-N 3.33Å; L304-N306 WeakPolarHBondContact CB-OD1 3.14Å; L304-F353 HydrophobicContact CD1-CB 4.01Å; L304-F353 HydrophobicContact CD1-CD2 3.52Å; L304-F353 HydrophobicContact CD1-CE2 4.08Å; L304-F353 HydrophobicContact CD1-CG 3.84Å; L304-T473 HydrophobicContact CD2-CG2 4.31Å; L304-T473 HydrophobicContact CG-CG2 4.31Å; L304-L491 HydrophobicContact CD1-CD1 4.46Å; L304-L491 HydrophobicContact CD2-CD1 4.14Å; L304-L491 HydrophobicContact CD2-CD2 3.82Å
305	G	85.6	Confident	89.9	Confident	51 Å²	51	56.7 Å²	56.7	53%	0.526	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	6.6	-179.1	0	0	0	0	0	114.7	L301 Y302 V307	L301-G305 PolarHBondContact O-N 2.88Å; Y302-G305 PolarHBondContact O-N 2.83Å; Y302-G305 VanDerWaalsContact O-N 3.09Å; G305-V307 PolarHBondContact O-N 2.84Å
306	N	86.2	Confident	89.8	Confident	80 Å²	80	58.8 Å²	58.8	43%	0.428	29%	0.285	S	S	.	.			trans	-61.6	-32.3	173.8	-70.7	59.4	0	0	0	111.6	L301 L304 K352	L301-N306 HydrophobicContact CD2-CB 4.42Å; L301-N306 PolarHBondContact O-N 2.97Å; L301-N306 VanDerWaalsContact O-N 3.16Å; L304-N306 VanDerWaalsContact C-N 3.33Å; L304-N306 WeakPolarHBondContact CB-OD1 3.14Å; N306-K352 PolarHBondContact ND2-O 2.96Å
307	V	85.6	Confident	89.6	Confident	22 Å²	22	63.6 Å²	63.6	13%	0.133	31%	0.308	C	S	.	.	S	Bend	trans	-99.1	119.8	176.7	-173.8	0	0	0	0	110.1	L301 G305 K309 M312 V332	L301-V307 HydrophobicContact CB-CG2 4.11Å; G305-V307 PolarHBondContact O-N 2.84Å; V307-K309 PolarHBondContact O-N 2.89Å; V307-M312 HydrophobicContact CG1-CB 4.33Å; V307-V332 HydrophobicContact CG1-CG2 4.44Å; V307-V332 HydrophobicContact CG2-CG1 3.53Å; V307-V332 HydrophobicContact CG2-CG2 4.29Å
308	N	90.3	Very high	89.5	Confident	116 Å²	116	66.5 Å²	66.5	62%	0.62	32%	0.321	S	S	*	.			trans	-60.8	132.6	174.7	-80.4	-34.9	0	0	0	111.4	R310 T311 M312	N308-R310 PolarHBondContact O-N 3.35Å; N308-T311 WeakPolarHBondContact O-CA 3.32Å; N308-T311 WeakPolarHBondContact O-CB 3.32Å; N308-T311 PolarHBondContact O-N 2.96Å; N308-M312 PolarHBondContact O-N 3.25Å
309	K	88.9	Confident	89.3	Confident	157 Å²	157	66.5 Å²	66.5	68%	0.683	32%	0.321	S	S	*	.	H	α-helix	trans	-52.3	-34.1	178.7	-63.6	-172.7	172.9	-175.6	0	113.8	Y302 V307 M312 H313	Y302-K309 HydrophobicContact CE2-CG 3.97Å; V307-K309 PolarHBondContact O-N 2.89Å; K309-M312 PolarHBondContact O-N 2.69Å; K309-H313 WeakPolarHBondContact O-CB 3.43Å; K309-H313 PolarHBondContact O-N 2.75Å
310	R	91.1	Very high	89.2	Confident	226 Å²	226	71.4 Å²	71.4	85%	0.853	34%	0.342	S	S	*	.	H	α-helix	trans	-64.1	-39.8	174.6	-175.7	178.9	-179.7	-178.8	0.7	112.6	N308 K314	N308-R310 PolarHBondContact O-N 3.35Å; R310-K314 PolarHBondContact O-N 3.03Å; R310-K314 VanDerWaalsContact O-N 3.1Å
311	T	89.4	Confident	89.1	Confident	50 Å²	50	79.9 Å²	79.9	31%	0.307	38%	0.379	S	S	.	.	H	α-helix	trans	-71.6	-42.2	177.3	-42.9	0	0	0	0	110.4	N308 H313 K314 Y315	N308-T311 WeakPolarHBondContact O-CA 3.32Å; N308-T311 WeakPolarHBondContact O-CB 3.32Å; N308-T311 PolarHBondContact O-N 2.96Å; T311-H313 PolarHBondContact O-N 2.38Å; T311-K314 WeakPolarHBondContact O-CA 3.45Å; T311-K314 WeakPolarHBondContact O-CB 3.49Å; T311-K314 PolarHBondContact O-N 3.28Å; T311-K314 VanDerWaalsContact O-N 3.09Å; T311-Y315 HydrophobicContact CG2-CD2 4.32Å; T311-Y315 HydrophobicContact CG2-CE1 4.49Å; T311-Y315 HydrophobicContact CG2-CE2 3.61Å; T311-Y315 WeakPolarHBondContact O-CD2 3.5Å; T311-Y315 PolarHBondContact O-N 2.79Å
312	M	89.4	Confident	88.8	Confident	9 Å²	9	82 Å²	82	4%	0.044	40%	0.398	C	S	.	.	H	α-helix	trans	-57.8	-47.2	174.3	-173.8	64.8	-150.2	0	0	111.9	Y302 V307 N308 K309 K314 Y315 E316 A328 Y329 V332	Y302-M312 HydrophobicContact CD2-CB 3.99Å; Y302-M312 HydrophobicContact CD2-CG 3.84Å; Y302-M312 HydrophobicContact CD2-SD 4.44Å; Y302-M312 HydrophobicContact CE2-CB 3.92Å; Y302-M312 HydrophobicContact CE2-CG 3.83Å; Y302-M312 HydrophobicContact CG-CG 4.45Å; V307-M312 HydrophobicContact CG1-CB 4.33Å; N308-M312 PolarHBondContact O-N 3.25Å; K309-M312 PolarHBondContact O-N 2.69Å; M312-K314 VanDerWaalsContact C-N 3.28Å; M312-K314 PolarHBondContact O-N 2.99Å; M312-Y315 PolarHBondContact O-N 3.36Å; M312-E316 WeakPolarHBondContact O-CB 3.3Å; M312-E316 PolarHBondContact O-N 3.38Å; M312-A328 HydrophobicContact CE-CB 3.84Å; M312-A328 WeakPolarHBondContact CE-O 3.41Å; M312-Y329 HydrophobicContact CE-CD1 3.34Å; M312-Y329 HydrophobicContact CE-CE1 3.49Å; M312-Y329 VanDerWaalsContact CE-CE1 3.49Å; M312-Y329 HydrophobicContact CE-CG 3.96Å; M312-Y329 HydrophobicContact SD-CD1 3.92Å; M312-Y329 HydrophobicContact SD-CE1 4.14Å; M312-V332 HydrophobicContact SD-CG2 4.13Å
313	H	89.8	Confident	88.3	Confident	103 Å²	103	82.3 Å²	82.3	48%	0.477	42%	0.42	S	S	.	.	H	α-helix	trans	-65.3	-29.4	176.1	-173.7	-91.3	0	0	0	113	K309 T311 Q317	K309-H313 WeakPolarHBondContact O-CB 3.43Å; K309-H313 PolarHBondContact O-N 2.75Å; T311-H313 PolarHBondContact O-N 2.38Å; H313-Q317 PolarHBondContact CE1-NE2 3.41Å; H313-Q317 VanDerWaalsContact CE1-NE2 3.34Å; H313-Q317 WeakPolarHBondContact O-CG 3.45Å; H313-Q317 PolarHBondContact O-N 3.01Å
314	K	91.3	Very high	88	Confident	106 Å²	106	81.1 Å²	81.1	46%	0.461	41%	0.412	S	S	.	.	H	α-helix	trans	-64.1	-51.8	170.8	-175.4	-167.1	163.8	-166.9	0	110.3	R310 T311 M312 E316 Q317 E318	R310-K314 PolarHBondContact O-N 3.03Å; R310-K314 VanDerWaalsContact O-N 3.1Å; T311-K314 WeakPolarHBondContact O-CA 3.45Å; T311-K314 WeakPolarHBondContact O-CB 3.49Å; T311-K314 PolarHBondContact O-N 3.28Å; T311-K314 VanDerWaalsContact O-N 3.09Å; M312-K314 VanDerWaalsContact C-N 3.28Å; M312-K314 PolarHBondContact O-N 2.99Å; K314-E316 VanDerWaalsContact C-N 3.27Å; K314-E316 PolarHBondContact O-N 2.92Å; K314-Q317 PolarHBondContact O-N 3.49Å; K314-Q317 VanDerWaalsContact O-N 3.09Å; K314-E318 WeakPolarHBondContact CE-OE1 3.4Å; K314-E318 VanDerWaalsContact CE-OE2 3.23Å; K314-E318 WeakPolarHBondContact CE-OE2 3.22Å; K314-E318 IonicContact NZ-OE1 2.73Å; K314-E318 PolarHBondContact NZ-OE1 3.18Å; K314-E318 IonicContact NZ-OE2 3.08Å; K314-E318 WeakPolarHBondContact O-CG 3.38Å; K314-E318 PolarHBondContact O-N 3.07Å
315	Y	91	Very high	87.3	Confident	46 Å²	46	81.2 Å²	81.2	18%	0.18	42%	0.419	C	S	.	.	H	α-helix	trans	-61.9	-34.6	177.1	-60.1	-41.4	0	0	0	112.5	T311 M312 Q317 E318 S319 W331 V332	T311-Y315 HydrophobicContact CG2-CD2 4.32Å; T311-Y315 HydrophobicContact CG2-CE1 4.49Å; T311-Y315 HydrophobicContact CG2-CE2 3.61Å; T311-Y315 WeakPolarHBondContact O-CD2 3.5Å; T311-Y315 PolarHBondContact O-N 2.79Å; M312-Y315 PolarHBondContact O-N 3.36Å; Y315-Q317 VanDerWaalsContact C-N 3.35Å; Y315-E318 PolarHBondContact O-N 2.98Å; Y315-S319 VanDerWaalsContact O-CB 3.28Å; Y315-S319 WeakPolarHBondContact O-CB 3.23Å; Y315-S319 PolarHBondContact O-N 2.92Å; Y315-S319 PolarHBondContact O-OG 2.89Å; Y315-W331 HydrophobicContact CD1-CE3 4.42Å; Y315-W331 HydrophobicContact CG-CB 4.31Å; Y315-V332 HydrophobicContact CD2-CG2 4.39Å
316	E	89.1	Confident	86.9	Confident	68 Å²	68	82.5 Å²	82.5	32%	0.318	42%	0.42	S	S	.	.	H	α-helix	trans	-65.8	-34.5	173.9	-162.3	-166.3	157	0	0	112.7	M312 K314 S319 K320 A328	M312-E316 WeakPolarHBondContact O-CB 3.3Å; M312-E316 PolarHBondContact O-N 3.38Å; K314-E316 VanDerWaalsContact C-N 3.27Å; K314-E316 PolarHBondContact O-N 2.92Å; E316-S319 PolarHBondContact O-OG 2.89Å; E316-K320 WeakPolarHBondContact O-CB 3.21Å; E316-K320 VanDerWaalsContact O-CD 3.27Å; E316-K320 WeakPolarHBondContact O-CD 3.32Å; E316-K320 WeakPolarHBondContact O-CG 3.33Å; E316-K320 PolarHBondContact O-N 2.84Å; E316-K320 WeakPolarHBondContact OE1-CE 3.46Å; E316-K320 IonicContact OE1-NZ 3.79Å; E316-K320 PolarHBondContact OE1-NZ 2.91Å; E316-A328 HydrophobicContact CB-CB 4.18Å; E316-A328 HydrophobicContact CG-CB 4.16Å
317	Q	89.6	Confident	86.6	Confident	102 Å²	102	82.2 Å²	82.2	48%	0.477	42%	0.416	S	S	.	.	H	α-helix	trans	-74.1	-39.2	172.8	-75.1	-176.6	-27.3	0	0	112.4	H313 K314 Y315 K321	H313-Q317 PolarHBondContact CE1-NE2 3.41Å; H313-Q317 VanDerWaalsContact CE1-NE2 3.34Å; H313-Q317 WeakPolarHBondContact O-CG 3.45Å; H313-Q317 PolarHBondContact O-N 3.01Å; K314-Q317 PolarHBondContact O-N 3.49Å; K314-Q317 VanDerWaalsContact O-N 3.09Å; Y315-Q317 VanDerWaalsContact C-N 3.35Å; Q317-K321 WeakPolarHBondContact O-CG 3.3Å; Q317-K321 PolarHBondContact O-N 2.96Å; Q317-K321 VanDerWaalsContact O-N 3.1Å
318	E	88.7	Confident	86.6	Confident	62 Å²	62	81.5 Å²	81.5	29%	0.29	41%	0.412	S	S	.	.	H	α-helix	trans	-71.7	-41.2	179.6	-67.6	175.5	149.3	0	0	111.7	K314 Y315 K320 K321 A322 W331	K314-E318 WeakPolarHBondContact CE-OE1 3.4Å; K314-E318 VanDerWaalsContact CE-OE2 3.23Å; K314-E318 WeakPolarHBondContact CE-OE2 3.22Å; K314-E318 IonicContact NZ-OE1 2.73Å; K314-E318 PolarHBondContact NZ-OE1 3.18Å; K314-E318 IonicContact NZ-OE2 3.08Å; K314-E318 WeakPolarHBondContact O-CG 3.38Å; K314-E318 PolarHBondContact O-N 3.07Å; Y315-E318 PolarHBondContact O-N 2.98Å; E318-K320 PolarHBondContact O-N 2.95Å; E318-K321 WeakPolarHBondContact O-CB 3.23Å; E318-K321 PolarHBondContact O-N 2.89Å; E318-A322 PolarHBondContact O-N 2.88Å; E318-W331 HydrophobicContact CB-CE3 4.32Å; E318-W331 HydrophobicContact CB-CH2 4.21Å; E318-W331 HydrophobicContact CB-CZ3 3.53Å
319	S	88.4	Confident	86.6	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-66.5	-35.9	175.4	74.6	0	0	0	0	112.3	Y315 E316 A322 G323 K324 A325	Y315-S319 VanDerWaalsContact O-CB 3.28Å; Y315-S319 WeakPolarHBondContact O-CB 3.23Å; Y315-S319 PolarHBondContact O-N 2.92Å; Y315-S319 PolarHBondContact O-OG 2.89Å; E316-S319 PolarHBondContact O-OG 2.89Å; S319-A322 CarbonylContact O-C 3.51Å; S319-A322 PolarHBondContact O-N 2.97Å; S319-G323 PolarHBondContact O-N 3.29Å; S319-K324 CarbonylContact O-C 3.36Å; S319-K324 WeakPolarHBondContact O-CA 3.21Å; S319-K324 PolarHBondContact O-N 2.53Å; S319-A325 PolarHBondContact O-N 2.61Å
320	K	88.7	Confident	86.6	Confident	113 Å²	113	70.9 Å²	70.9	49%	0.491	36%	0.36	S	S	.	.	H	α-helix	trans	-62.9	-41.7	170.6	-77.9	170.1	-170.3	170.9	0	112.4	E316 E318 A322 G323 A325	E316-K320 WeakPolarHBondContact O-CB 3.21Å; E316-K320 VanDerWaalsContact O-CD 3.27Å; E316-K320 WeakPolarHBondContact O-CD 3.32Å; E316-K320 WeakPolarHBondContact O-CG 3.33Å; E316-K320 PolarHBondContact O-N 2.84Å; E316-K320 WeakPolarHBondContact OE1-CE 3.46Å; E316-K320 IonicContact OE1-NZ 3.79Å; E316-K320 PolarHBondContact OE1-NZ 2.91Å; E318-K320 PolarHBondContact O-N 2.95Å; K320-A322 VanDerWaalsContact C-N 3.32Å; K320-G323 PolarHBondContact O-N 2.92Å; K320-A325 HydrophobicContact CG-CB 3.62Å
321	K	88.2	Confident	86.5	Confident	180 Å²	180	60.9 Å²	60.9	78%	0.783	32%	0.322	S	S	*	.	H	α-helix	trans	-64.3	-36.6	174.4	-73.7	172	179.6	-177	0	112.3	Q317 E318 G323	Q317-K321 WeakPolarHBondContact O-CG 3.3Å; Q317-K321 PolarHBondContact O-N 2.96Å; Q317-K321 VanDerWaalsContact O-N 3.1Å; E318-K321 WeakPolarHBondContact O-CB 3.23Å; E318-K321 PolarHBondContact O-N 2.89Å; K321-G323 PolarHBondContact O-N 2.96Å
322	A	84.9	Confident	86.6	Confident	49 Å²	49	59.4 Å²	59.4	41%	0.405	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	9.8	175.1	0	0	0	0	0	114.1	E318 S319 K320 K324 W331	E318-A322 PolarHBondContact O-N 2.88Å; S319-A322 CarbonylContact O-C 3.51Å; S319-A322 PolarHBondContact O-N 2.97Å; K320-A322 VanDerWaalsContact C-N 3.32Å; A322-K324 PolarHBondContact O-N 3.41Å; A322-K324 VanDerWaalsContact O-N 3.13Å; A322-W331 HydrophobicContact CB-CH2 4.08Å; A322-W331 HydrophobicContact CB-CZ2 4.14Å
323	G	82.1	Confident	86.5	Confident	70 Å²	70	59.3 Å²	59.3	72%	0.722	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	-1.3	-178.8	0	0	0	0	0	115.7	S319 K320 K321	S319-G323 PolarHBondContact O-N 3.29Å; K320-G323 PolarHBondContact O-N 2.92Å; K321-G323 PolarHBondContact O-N 2.96Å
324	K	82.7	Confident	86.5	Confident	45 Å²	45	54.6 Å²	54.6	20%	0.196	29%	0.291	C	S	.	.			trans	-106.9	43.9	-172.4	-66.4	-172.3	-171.6	-174.5	0	113.1	S319 A322 S326 F327 R340 D341 R342 G343	S319-K324 CarbonylContact O-C 3.36Å; S319-K324 WeakPolarHBondContact O-CA 3.21Å; S319-K324 PolarHBondContact O-N 2.53Å; A322-K324 PolarHBondContact O-N 3.41Å; A322-K324 VanDerWaalsContact O-N 3.13Å; K324-S326 PolarHBondContact O-N 2.66Å; K324-F327 HydrophobicContact CB-CB 4.45Å; K324-F327 HydrophobicContact CB-CD2 3.89Å; K324-F327 HydrophobicContact CG-CD2 4.44Å; K324-F327 PolarHBondContact O-N 3.49Å; K324-R340 PolarHBondContact NZ-O 2.83Å; K324-D341 PolarHBondContact NZ-O 2.93Å; K324-R342 PolarHBondContact NZ-O 2.8Å; K324-G343 VanDerWaalsContact NZ-N 3.18Å
325	A	72.9	Confident	86.2	Confident	50 Å²	50	56.8 Å²	56.8	41%	0.413	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-52.7	-31.4	-173.2	0	0	0	0	0	115	S319 K320 F327	S319-A325 PolarHBondContact O-N 2.61Å; K320-A325 HydrophobicContact CG-CB 3.62Å; A325-F327 VanDerWaalsContact C-N 3.29Å; A325-F327 PolarHBondContact O-N 3.23Å
326	S	75.8	Confident	86.1	Confident	78 Å²	78	57.5 Å²	57.5	55%	0.545	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-69.9	-18.8	177.8	46.3	0	0	0	0	114.6	K324	K324-S326 PolarHBondContact O-N 2.66Å
327	F	80.8	Confident	86	Confident	75 Å²	75	56.4 Å²	56.4	33%	0.329	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-94.3	7.7	-173.6	-66.4	-93.1	0	0	0	113.8	K324 A325 Y329 A330 W331	K324-F327 HydrophobicContact CB-CB 4.45Å; K324-F327 HydrophobicContact CB-CD2 3.89Å; K324-F327 HydrophobicContact CG-CD2 4.44Å; K324-F327 PolarHBondContact O-N 3.49Å; A325-F327 VanDerWaalsContact C-N 3.29Å; A325-F327 PolarHBondContact O-N 3.23Å; F327-Y329 PolarHBondContact O-N 3.33Å; F327-A330 WeakPolarHBondContact O-CB 3.41Å; F327-A330 PolarHBondContact O-N 3.46Å; F327-W331 VanDerWaalsContact O-CD1 3.25Å; F327-W331 PolarHBondContact O-N 2.93Å
328	A	86.1	Confident	85.9	Confident	7 Å²	7	57.1 Å²	57.1	6%	0.058	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-30.8	-174.9	0	0	0	0	0	114.7	M312 E316	M312-A328 HydrophobicContact CE-CB 3.84Å; M312-A328 WeakPolarHBondContact CE-O 3.41Å; E316-A328 HydrophobicContact CB-CB 4.18Å; E316-A328 HydrophobicContact CG-CB 4.16Å
329	Y	89.1	Confident	85.9	Confident	46 Å²	46	54.6 Å²	54.6	18%	0.18	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-32.2	174.5	-65.6	-65.8	0	0	0	113.4	T295 G298 H299 Y302 M312 F327 W331 V332 L467	T295-Y329 HydrophobicContact CG2-CD2 4.27Å; G298-Y329 WeakPolarHBondContact CA-O 3.31Å; H299-Y329 HydrophobicContact CB-CD1 3.89Å; H299-Y329 HydrophobicContact CB-CD2 4.33Å; H299-Y329 HydrophobicContact CB-CE1 4.17Å; H299-Y329 HydrophobicContact CB-CG 3.99Å; H299-Y329 AromaticContact CD2-CE1 3.74Å; H299-Y329 AromaticContact CD2-CZ 3.88Å; H299-Y329 AromaticContact CE1-CZ 3.91Å; H299-Y329 AromaticContact CG-CE1 3.88Å; H299-Y329 AromaticContact CG-CZ 3.91Å; H299-Y329 AromaticContact ND1-CE2 3.92Å; H299-Y329 AromaticContact ND1-CZ 3.92Å; H299-Y329 AromaticContact NE2-CZ 3.92Å; Y302-Y329 AromaticContact CD1-CE1 3.94Å; Y302-Y329 HydrophobicContact CD1-CE1 3.94Å; Y302-Y329 HydrophobicContact CG-CE1 4.31Å; M312-Y329 HydrophobicContact CE-CD1 3.34Å; M312-Y329 HydrophobicContact CE-CE1 3.49Å; M312-Y329 VanDerWaalsContact CE-CE1 3.49Å; M312-Y329 HydrophobicContact CE-CG 3.96Å; M312-Y329 HydrophobicContact SD-CD1 3.92Å; M312-Y329 HydrophobicContact SD-CE1 4.14Å; F327-Y329 PolarHBondContact O-N 3.33Å; Y329-W331 VanDerWaalsContact C-N 3.3Å; Y329-W331 PolarHBondContact O-N 3.45Å; Y329-V332 VanDerWaalsContact O-CB 3.3Å; Y329-V332 WeakPolarHBondContact O-CB 3.47Å; Y329-V332 WeakPolarHBondContact O-CG2 3.47Å; Y329-V332 PolarHBondContact O-N 2.89Å; Y329-L467 HydrophobicContact CE2-CD1 4.45Å
330	A	89.4	Confident	85.9	Confident	3 Å²	3	56.8 Å²	56.8	3%	0.025	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-67.3	-33.9	179.5	0	0	0	0	0	111.5	F327 V332 L333 D334	F327-A330 WeakPolarHBondContact O-CB 3.41Å; F327-A330 PolarHBondContact O-N 3.46Å; A330-V332 PolarHBondContact O-N 3.22Å; A330-L333 PolarHBondContact O-N 2.83Å; A330-D334 VanDerWaalsContact CB-OD2 3.3Å; A330-D334 WeakPolarHBondContact CB-OD2 3.4Å; A330-D334 PolarHBondContact O-N 3.29Å
331	W	89.9	Confident	85.8	Confident	17 Å²	17	57.2 Å²	57.2	6%	0.064	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-61.3	-8.3	175.8	-72.6	36.9	0	0	0	115.2	Y315 E318 A322 F327 Y329 L333 R340	Y315-W331 HydrophobicContact CD1-CE3 4.42Å; Y315-W331 HydrophobicContact CG-CB 4.31Å; E318-W331 HydrophobicContact CB-CE3 4.32Å; E318-W331 HydrophobicContact CB-CH2 4.21Å; E318-W331 HydrophobicContact CB-CZ3 3.53Å; A322-W331 HydrophobicContact CB-CH2 4.08Å; A322-W331 HydrophobicContact CB-CZ2 4.14Å; F327-W331 VanDerWaalsContact O-CD1 3.25Å; F327-W331 PolarHBondContact O-N 2.93Å; Y329-W331 VanDerWaalsContact C-N 3.3Å; Y329-W331 PolarHBondContact O-N 3.45Å; W331-L333 VanDerWaalsContact C-N 3.3Å; W331-R340 HydrophobicContact CD2-CG 3.91Å; W331-R340 HydrophobicContact CE3-CG 4.33Å; W331-R340 HydrophobicContact CG-CG 4.21Å; W331-R340 HydrophobicContact CH2-CB 4.36Å; W331-R340 HydrophobicContact CZ2-CB 3.88Å; W331-R340 HydrophobicContact CZ2-CG 4.18Å; W331-R340 PolarHBondContact O-NH2 2.85Å
332	V	90	Very high	85.8	Confident	18 Å²	18	55.5 Å²	55.5	11%	0.109	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-71.6	-25.4	168.5	172.6	0	0	0	0	112.1	L301 V307 M312 Y315 Y329 A330	L301-V332 HydrophobicContact CB-CG1 4.41Å; L301-V332 HydrophobicContact CD1-CG1 3.96Å; V307-V332 HydrophobicContact CG1-CG2 4.44Å; V307-V332 HydrophobicContact CG2-CG1 3.53Å; V307-V332 HydrophobicContact CG2-CG2 4.29Å; M312-V332 HydrophobicContact SD-CG2 4.13Å; Y315-V332 HydrophobicContact CD2-CG2 4.39Å; Y329-V332 VanDerWaalsContact O-CB 3.3Å; Y329-V332 WeakPolarHBondContact O-CB 3.47Å; Y329-V332 WeakPolarHBondContact O-CG2 3.47Å; Y329-V332 PolarHBondContact O-N 2.89Å; A330-V332 PolarHBondContact O-N 3.22Å
333	L	88.3	Confident	85.8	Confident	8 Å²	8	54 Å²	54	4%	0.042	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-38.7	-175.4	-66.9	167	0	0	0	111.6	M297 L301 A330 W331 E335 T351 D364	M297-L333 HydrophobicContact CB-CD1 3.58Å; L301-L333 HydrophobicContact CD1-CD2 3.88Å; L301-L333 HydrophobicContact CD1-CG 4.42Å; A330-L333 PolarHBondContact O-N 2.83Å; W331-L333 VanDerWaalsContact C-N 3.3Å; L333-E335 PolarHBondContact O-N 3.05Å; L333-T351 HydrophobicContact CD2-CG2 3.68Å; L333-D364 HydrophobicContact CD1-CB 4.12Å
334	D	90.1	Very high	86.1	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.021	28%	0.282	C	S	.	.			trans	-70.9	90.9	170	-55.5	-43.6	0	0	0	108.3	A330 E339 R340 T345	A330-D334 VanDerWaalsContact CB-OD2 3.3Å; A330-D334 WeakPolarHBondContact CB-OD2 3.4Å; A330-D334 PolarHBondContact O-N 3.29Å; D334-E339 HydrophobicContact CB-CB 3.89Å; D334-R340 HydrophobicContact CB-CG 4.34Å; D334-R340 PolarHBondContact O-NE 3.13Å; D334-R340 PolarHBondContact O-NH2 2.89Å; D334-T345 WeakPolarHBondContact OD1-CB 3.45Å; D334-T345 PolarHBondContact OD1-OG1 2.85Å
335	E	84.9	Confident	86.4	Confident	151 Å²	151	50.9 Å²	50.9	71%	0.706	28%	0.275	S	S	*	.			trans	-82.2	-30.9	179.5	-70.7	-159.4	155.2	0	0	113	L333	L333-E335 PolarHBondContact O-N 3.05Å
336	T	88.1	Confident	87.3	Confident	62 Å²	62	50 Å²	50	38%	0.38	26%	0.262	S	S	.	.	S	Bend	trans	-77.7	157.4	-174	72.7	0	0	0	0	112.8	E339 R340	T336-E339 WeakPolarHBondContact CB-OE2 3.19Å; T336-E339 WeakPolarHBondContact CG2-OE2 3.39Å; T336-E339 PolarHBondContact N-OE2 3.31Å; T336-E339 WeakPolarHBondContact OG1-CB 3.47Å; T336-E339 WeakPolarHBondContact OG1-CG 3.49Å; T336-E339 PolarHBondContact OG1-N 3.4Å; T336-E339 PolarHBondContact OG1-OE2 3.09Å; T336-R340 WeakPolarHBondContact O-CG 3.45Å
337	G	86.4	Confident	87.9	Confident	44 Å²	44	50.7 Å²	50.7	45%	0.454	26%	0.26	S	S	.	.	H	α-helix	trans	-63.8	-47.9	172.6	0	0	0	0	0	111.9	E339 R340 D341	G337-E339 VanDerWaalsContact C-N 3.32Å; G337-E339 PolarHBondContact O-N 3.33Å; G337-R340 PolarHBondContact O-N 2.83Å; G337-R340 VanDerWaalsContact O-N 3.08Å; G337-D341 WeakPolarHBondContact O-CB 3.41Å; G337-D341 VanDerWaalsContact O-CG 3.3Å; G337-D341 PolarHBondContact O-N 2.82Å
338	E	88.1	Confident	88.3	Confident	117 Å²	117	48.4 Å²	48.4	55%	0.547	25%	0.252	S	S	.	.	H	α-helix	trans	-59.3	-38.6	-177.6	-66.6	-168.5	-141.5	0	0	113.4	R342	E338-R342 VanDerWaalsContact O-CB 3.29Å; E338-R342 WeakPolarHBondContact O-CB 3.19Å; E338-R342 WeakPolarHBondContact O-CG 2.97Å; E338-R342 PolarHBondContact O-N 3.28Å; E338-R342 IonicContact OE2-CZ 2.75Å; E338-R342 IonicContact OE2-NH1 2.78Å; E338-R342 PolarHBondContact OE2-NH1 2.82Å; E338-R342 IonicContact OE2-NH2 3.86Å
339	E	88.3	Confident	88.4	Confident	9 Å²	9	49 Å²	49	4%	0.042	26%	0.259	C	S	.	.	H	α-helix	trans	-66.6	-37.6	177	-72.6	167.7	138.3	0	0	112.1	D334 T336 G337 G343 V344 M346 D347	D334-E339 HydrophobicContact CB-CB 3.89Å; T336-E339 WeakPolarHBondContact CB-OE2 3.19Å; T336-E339 WeakPolarHBondContact CG2-OE2 3.39Å; T336-E339 PolarHBondContact N-OE2 3.31Å; T336-E339 WeakPolarHBondContact OG1-CB 3.47Å; T336-E339 WeakPolarHBondContact OG1-CG 3.49Å; T336-E339 PolarHBondContact OG1-N 3.4Å; T336-E339 PolarHBondContact OG1-OE2 3.09Å; G337-E339 VanDerWaalsContact C-N 3.32Å; G337-E339 PolarHBondContact O-N 3.33Å; E339-G343 CarbonylContact O-C 3.59Å; E339-G343 WeakPolarHBondContact O-CA 3.27Å; E339-G343 PolarHBondContact O-N 3.12Å; E339-V344 PolarHBondContact O-N 3.36Å; E339-V344 VanDerWaalsContact O-N 3.16Å; E339-M346 HydrophobicContact CG-CB 3.74Å; E339-M346 HydrophobicContact CG-CG 3.5Å; E339-M346 PolarHBondContact OE1-N 3.16Å; E339-D347 PolarHBondContact OE1-N 3.42Å; E339-D347 VanDerWaalsContact OE1-N 3.09Å
340	R	88.6	Confident	88.3	Confident	47 Å²	47	50.9 Å²	50.9	18%	0.177	27%	0.27	C	S	.	.	H	α-helix	trans	-72.8	-44.3	176.9	-67	172.7	-179	161.8	3.7	111.5	K324 W331 D334 T336 G337 R342 G343	K324-R340 PolarHBondContact NZ-O 2.83Å; W331-R340 HydrophobicContact CD2-CG 3.91Å; W331-R340 HydrophobicContact CE3-CG 4.33Å; W331-R340 HydrophobicContact CG-CG 4.21Å; W331-R340 HydrophobicContact CH2-CB 4.36Å; W331-R340 HydrophobicContact CZ2-CB 3.88Å; W331-R340 HydrophobicContact CZ2-CG 4.18Å; W331-R340 PolarHBondContact O-NH2 2.85Å; D334-R340 HydrophobicContact CB-CG 4.34Å; D334-R340 PolarHBondContact O-NE 3.13Å; D334-R340 PolarHBondContact O-NH2 2.89Å; T336-R340 WeakPolarHBondContact O-CG 3.45Å; G337-R340 PolarHBondContact O-N 2.83Å; G337-R340 VanDerWaalsContact O-N 3.08Å; R340-R342 VanDerWaalsContact C-N 3.34Å; R340-R342 PolarHBondContact O-N 3.03Å; R340-G343 PolarHBondContact O-N 2.82Å
341	D	87.9	Confident	88.3	Confident	122 Å²	122	52.4 Å²	52.4	65%	0.652	28%	0.279	S	S	*	.	H	α-helix	trans	-69.3	-30.6	-179.3	-67.3	-21	0	0	0	112	K324 G337	K324-D341 PolarHBondContact NZ-O 2.93Å; G337-D341 WeakPolarHBondContact O-CB 3.41Å; G337-D341 VanDerWaalsContact O-CG 3.3Å; G337-D341 PolarHBondContact O-N 2.82Å
342	R	86.9	Confident	88.2	Confident	144 Å²	144	54.3 Å²	54.3	54%	0.543	29%	0.288	S	S	.	.	H	α-helix	trans	-83.7	-35.4	167.8	-67.8	179.3	176.3	130.3	8.6	113	K324 E338 R340 V344	K324-R342 PolarHBondContact NZ-O 2.8Å; E338-R342 VanDerWaalsContact O-CB 3.29Å; E338-R342 WeakPolarHBondContact O-CB 3.19Å; E338-R342 WeakPolarHBondContact O-CG 2.97Å; E338-R342 PolarHBondContact O-N 3.28Å; E338-R342 IonicContact OE2-CZ 2.75Å; E338-R342 IonicContact OE2-NH1 2.78Å; E338-R342 PolarHBondContact OE2-NH1 2.82Å; E338-R342 IonicContact OE2-NH2 3.86Å; R340-R342 VanDerWaalsContact C-N 3.34Å; R340-R342 PolarHBondContact O-N 3.03Å; R342-V344 HydrophobicContact CB-CB 4.5Å
343	G	86	Confident	88.2	Confident	18 Å²	18	53.5 Å²	53.5	19%	0.186	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	25.4	-170.9	0	0	0	0	0	112.6	K324 E339 R340	K324-G343 VanDerWaalsContact NZ-N 3.18Å; E339-G343 CarbonylContact O-C 3.59Å; E339-G343 WeakPolarHBondContact O-CA 3.27Å; E339-G343 PolarHBondContact O-N 3.12Å; R340-G343 PolarHBondContact O-N 2.82Å
344	V	88.2	Confident	88.2	Confident	41 Å²	41	57.7 Å²	57.7	25%	0.248	30%	0.302	C	S	.	.	S	Bend	trans	-140.4	117.3	-176	-179.9	0	0	0	0	107.9	E339 R342 M346 H368	E339-V344 PolarHBondContact O-N 3.36Å; E339-V344 VanDerWaalsContact O-N 3.16Å; R342-V344 HydrophobicContact CB-CB 4.5Å; V344-M346 PolarHBondContact O-N 3.07Å; V344-H368 HydrophobicContact CG1-CB 4.46Å
345	T	89.7	Confident	88	Confident	8 Å²	8	58 Å²	58	5%	0.049	30%	0.304	C	S	.	.			trans	-56.4	130.9	171.6	-41.7	0	0	0	0	110.3	S294 D334 D347 P366	S294-T345 PolarHBondContact OG-OG1 2.98Å; S294-T345 VanDerWaalsContact OG-OG1 3.1Å; D334-T345 WeakPolarHBondContact OD1-CB 3.45Å; D334-T345 PolarHBondContact OD1-OG1 2.85Å; T345-D347 WeakPolarHBondContact CG2-O 3.3Å; T345-P366 WeakPolarHBondContact O-CB 3.36Å
346	M	89.9	Confident	87.9	Confident	31 Å²	31	58 Å²	58	15%	0.153	31%	0.31	C	S	.	.			trans	-108.3	-48.9	-172.1	-63.5	-80.8	-59.4	0	0	110.2	E339 V344 F371 N374	E339-M346 HydrophobicContact CG-CB 3.74Å; E339-M346 HydrophobicContact CG-CG 3.5Å; E339-M346 PolarHBondContact OE1-N 3.16Å; V344-M346 PolarHBondContact O-N 3.07Å; M346-F371 HydrophobicContact CE-CD1 4.33Å; M346-F371 HydrophobicContact CE-CE1 3.58Å; M346-F371 HydrophobicContact CE-CE2 4.05Å; M346-F371 HydrophobicContact CE-CZ 3.43Å; M346-F371 VanDerWaalsContact CE-CZ 3.43Å; M346-F371 HydrophobicContact SD-CD2 4.09Å; M346-F371 HydrophobicContact SD-CE1 4.05Å; M346-F371 HydrophobicContact SD-CE2 3.36Å; M346-F371 WeakPolarHBondContact SD-CE2 3.3Å; M346-F371 HydrophobicContact SD-CZ 3.35Å; M346-F371 WeakPolarHBondContact SD-CZ 3.46Å; M346-N374 PolarHBondContact O-ND2 2.8Å
347	D	88.8	Confident	87.7	Confident	92 Å²	92	57.5 Å²	57.5	49%	0.492	31%	0.308	S	S	.	.	S	Bend	trans	-106.9	-175.5	-179.4	-77.8	-47.9	0	0	0	111.4	E339 T345 N374	E339-D347 PolarHBondContact OE1-N 3.42Å; E339-D347 VanDerWaalsContact OE1-N 3.09Å; T345-D347 WeakPolarHBondContact CG2-O 3.3Å; D347-N374 PolarHBondContact OD1-ND2 2.65Å
348	V	89.1	Confident	87.7	Confident	28 Å²	28	56.2 Å²	56.2	17%	0.17	29%	0.29	C	S	.	.			trans	-99.2	96.1	-175.9	179.2	0	0	0	0	110.2	M350 M363 D364 N374	V348-M350 PolarHBondContact O-N 2.85Å; V348-M363 HydrophobicContact CG1-CB 3.72Å; V348-M363 HydrophobicContact CG1-CG 4.16Å; V348-D364 WeakPolarHBondContact CA-O 3.41Å; V348-N374 HydrophobicContact CG2-CB 4.34Å; V348-N374 WeakPolarHBondContact CG2-O 3.14Å
349	G	87.9	Confident	87.7	Confident	19 Å²	19	50.9 Å²	50.9	20%	0.196	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	118.9	174.7	0	0	0	0	0	111.6	M363 D364	G349-M363 WeakPolarHBondContact O-CA 3.46Å; G349-D364 PolarHBondContact N-O 2.96Å; G349-D364 PolarHBondContact O-N 3.03Å
350	M	87.7	Confident	87.8	Confident	86 Å²	86	50.4 Å²	50.4	42%	0.424	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	122.1	179.8	-65.9	-162.8	-176.1	0	0	111.8	V348 L362 M363	V348-M350 PolarHBondContact O-N 2.85Å; M350-L362 WeakPolarHBondContact CA-O 3.35Å; M350-M363 HydrophobicContact CG-CG 4.27Å
351	T	89.1	Confident	87.9	Confident	34 Å²	34	48.2 Å²	48.2	21%	0.209	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	149.6	176.2	49.2	0	0	0	0	112.3	L301 L333 L362	L301-T351 HydrophobicContact CD1-CG2 4.26Å; L333-T351 HydrophobicContact CD2-CG2 3.68Å; T351-L362 PolarHBondContact N-O 3.04Å; T351-L362 WeakPolarHBondContact O-CB 3.49Å; T351-L362 PolarHBondContact O-N 3.49Å
352	K	89.2	Confident	88.1	Confident	57 Å²	57	42.5 Å²	42.5	25%	0.248	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	129.9	177.4	178.1	-170.6	174.4	-171.5	0	109.3	N306 V359 H557 E559	N306-K352 PolarHBondContact ND2-O 2.96Å; K352-V359 HydrophobicContact CD-CG1 4.48Å; K352-V359 HydrophobicContact CG-CG1 4.09Å; K352-H557 HydrophobicContact CD-CB 3.97Å; K352-E559 IonicContact NZ-OE1 3.74Å; K352-E559 PolarHBondContact NZ-OE1 2.65Å
353	F	89.7	Confident	88.4	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.009	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	161.8	164.7	72.6	-94.4	0	0	0	111.9	L301 L304 T355 V360 L362 L491 I494	L301-F353 HydrophobicContact CD2-CB 3.96Å; L301-F353 HydrophobicContact CD2-CD1 4.04Å; L301-F353 HydrophobicContact CD2-CG 4.33Å; L304-F353 HydrophobicContact CD1-CB 4.01Å; L304-F353 HydrophobicContact CD1-CD2 3.52Å; L304-F353 HydrophobicContact CD1-CE2 4.08Å; L304-F353 HydrophobicContact CD1-CG 3.84Å; F353-T355 HydrophobicContact CD2-CG2 4.38Å; F353-T355 HydrophobicContact CE2-CG2 3.9Å; F353-V360 HydrophobicContact CD1-CB 4.3Å; F353-V360 HydrophobicContact CD1-CG1 4.46Å; F353-V360 HydrophobicContact CD2-CB 4.24Å; F353-V360 HydrophobicContact CE1-CB 3.96Å; F353-V360 HydrophobicContact CE1-CG1 3.74Å; F353-V360 HydrophobicContact CE2-CB 3.89Å; F353-V360 HydrophobicContact CE2-CG1 4.31Å; F353-V360 HydrophobicContact CE2-CG2 4.07Å; F353-V360 HydrophobicContact CG-CB 4.45Å; F353-V360 HydrophobicContact CZ-CB 3.74Å; F353-V360 HydrophobicContact CZ-CG1 3.65Å; F353-V360 HydrophobicContact CZ-CG2 4.21Å; F353-V360 PolarHBondContact N-O 2.99Å; F353-V360 PolarHBondContact O-N 2.97Å; F353-L362 HydrophobicContact CD1-CB 4.2Å; F353-L362 HydrophobicContact CE1-CB 4.04Å; F353-L362 HydrophobicContact CE1-CD2 4.39Å; F353-L491 HydrophobicContact CE2-CD1 4.05Å; F353-I494 HydrophobicContact CZ-CD1 4.37Å; F353-I494 HydrophobicContact CZ-CG2 4.27Å
354	E	87.4	Confident	88.7	Confident	95 Å²	95	34.8 Å²	34.8	44%	0.444	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	138.8	178.8	-63.5	-158.2	-166.9	0	0	111.2	K278 V359	K278-E354 IonicContact NZ-OE2 3.59Å; K278-E354 PolarHBondContact NZ-OE2 3.46Å; E354-V359 HydrophobicContact CG-CG1 4.46Å; E354-V359 HydrophobicContact CG-CG2 4.17Å
355	T	85.4	Confident	88.9	Confident	10 Å²	10	32.8 Å²	32.8	6%	0.061	18%	0.178	C	C	.	.			trans	-100.7	-179.3	165.9	70.9	0	0	0	0	109.7	K278 F353 S357 K358 V360 L491 D495	K278-T355 PolarHBondContact NZ-O 3.19Å; F353-T355 HydrophobicContact CD2-CG2 4.38Å; F353-T355 HydrophobicContact CE2-CG2 3.9Å; T355-S357 VanDerWaalsContact C-N 3.32Å; T355-S357 PolarHBondContact O-N 2.98Å; T355-S357 PolarHBondContact OG1-N 2.9Å; T355-K358 PolarHBondContact N-O 2.91Å; T355-K358 PolarHBondContact OG1-N 3.31Å; T355-K358 PolarHBondContact OG1-O 2.87Å; T355-V360 HydrophobicContact CG2-CG2 3.99Å; T355-L491 HydrophobicContact CG2-CD1 3.96Å; T355-D495 WeakPolarHBondContact CB-OD1 3.11Å; T355-D495 HydrophobicContact CG2-CB 4.48Å; T355-D495 PolarHBondContact OG1-OD1 3.33Å
356	N	83.1	Confident	88.9	Confident	153 Å²	153	32.5 Å²	32.5	82%	0.818	18%	0.176	S	C	*	.	S	Bend	trans	-60.3	-42	173	-64.6	-45.1	0	0	0	111.6
357	S	83.8	Confident	88.7	Confident	50 Å²	50	31.1 Å²	31.1	35%	0.35	17%	0.17	S	C	.	.	S	Bend	trans	-103.9	-15	-177	85.2	0	0	0	0	116.3	K278 P279 T355 D495	K278-S357 WeakPolarHBondContact CA-O 3.49Å; P279-S357 VanDerWaalsContact CD-O 3.3Å; P279-S357 WeakPolarHBondContact CD-O 3.41Å; T355-S357 VanDerWaalsContact C-N 3.32Å; T355-S357 PolarHBondContact O-N 2.98Å; T355-S357 PolarHBondContact OG1-N 2.9Å; S357-D495 WeakPolarHBondContact CB-OD1 3.24Å; S357-D495 PolarHBondContact N-OD1 2.95Å; S357-D495 PolarHBondContact N-OD2 3.23Å; S357-D495 VanDerWaalsContact OG-CG 3.27Å; S357-D495 PolarHBondContact OG-OD1 2.85Å; S357-D495 PolarHBondContact OG-OD2 3.15Å
358	K	87.1	Confident	88.7	Confident	17 Å²	17	30.1 Å²	30.1	7%	0.074	16%	0.162	C	C	.	.			trans	-139.4	164.8	-170.2	-56.2	-170.8	-178.3	60.9	0	113.6	P279 L281 T355 V360 D495 F497	P279-K358 HydrophobicContact CG-CD 4.42Å; P279-K358 HydrophobicContact CG-CG 4.09Å; P279-K358 WeakPolarHBondContact O-CB 3.42Å; L281-K358 HydrophobicContact CB-CD 4.33Å; L281-K358 HydrophobicContact CD2-CD 4.22Å; T355-K358 PolarHBondContact N-O 2.91Å; T355-K358 PolarHBondContact OG1-N 3.31Å; T355-K358 PolarHBondContact OG1-O 2.87Å; K358-V360 HydrophobicContact CB-CG2 4.33Å; K358-D495 PolarHBondContact NZ-O 3.36Å; K358-D495 IonicContact NZ-OD1 2.74Å; K358-F497 WeakPolarHBondContact CE-O 3.37Å; K358-F497 PolarHBondContact NZ-O 2.93Å
359	V	88.3	Confident	88.5	Confident	5 Å²	5	35.1 Å²	35.1	3%	0.03	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	128.7	160.1	-178	0	0	0	0	107.1	K278 P279 L280 L281 K352 E354	K278-V359 HydrophobicContact CB-CG2 4.33Å; K278-V359 HydrophobicContact CD-CG2 4.18Å; P279-V359 PolarHBondContact O-N 3.1Å; L280-V359 WeakPolarHBondContact CA-O 3.45Å; L280-V359 HydrophobicContact CD2-CB 3.81Å; L280-V359 HydrophobicContact CD2-CG1 3.72Å; L281-V359 PolarHBondContact N-O 3Å; K352-V359 HydrophobicContact CD-CG1 4.48Å; K352-V359 HydrophobicContact CG-CG1 4.09Å; E354-V359 HydrophobicContact CG-CG1 4.46Å; E354-V359 HydrophobicContact CG-CG2 4.17Å
360	V	90.9	Very high	88.5	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.8	-174.6	-175.8	0	0	0	0	109.6	L281 L283 F353 T355 K358 I494	L281-V360 WeakPolarHBondContact O-CA 3.24Å; L283-V360 HydrophobicContact CB-CG1 3.86Å; L283-V360 HydrophobicContact CD1-CG1 4.37Å; F353-V360 HydrophobicContact CD1-CB 4.3Å; F353-V360 HydrophobicContact CD1-CG1 4.46Å; F353-V360 HydrophobicContact CD2-CB 4.24Å; F353-V360 HydrophobicContact CE1-CB 3.96Å; F353-V360 HydrophobicContact CE1-CG1 3.74Å; F353-V360 HydrophobicContact CE2-CB 3.89Å; F353-V360 HydrophobicContact CE2-CG1 4.31Å; F353-V360 HydrophobicContact CE2-CG2 4.07Å; F353-V360 HydrophobicContact CG-CB 4.45Å; F353-V360 HydrophobicContact CZ-CB 3.74Å; F353-V360 HydrophobicContact CZ-CG1 3.65Å; F353-V360 HydrophobicContact CZ-CG2 4.21Å; F353-V360 PolarHBondContact N-O 2.99Å; F353-V360 PolarHBondContact O-N 2.97Å; T355-V360 HydrophobicContact CG2-CG2 3.99Å; K358-V360 HydrophobicContact CB-CG2 4.33Å; V360-I494 HydrophobicContact CG1-CG2 4.44Å; V360-I494 HydrophobicContact CG2-CG2 4.04Å
361	T	90.6	Very high	88.6	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	107	169.8	-57.3	0	0	0	0	107.8	L281 L283 M363 H557	L281-T361 PolarHBondContact O-N 3.46Å; L283-T361 PolarHBondContact N-O 3.3Å; T361-M363 HydrophobicContact CG2-CE 4.4Å; T361-H557 PolarHBondContact OG1-NE2 2.96Å
362	L	92.3	Very high	88.6	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	136	178.2	179.6	62.2	0	0	0	110.1	L283 V285 M297 L301 M350 T351 F353	L283-L362 HydrophobicContact CD2-CD1 3.57Å; L283-L362 CarbonylContact O-C 3.52Å; L283-L362 WeakPolarHBondContact O-CA 3.44Å; V285-L362 HydrophobicContact CG2-CD1 3.52Å; M297-L362 HydrophobicContact CB-CD2 4.08Å; M297-L362 HydrophobicContact CG-CD1 4.32Å; M297-L362 HydrophobicContact CG-CD2 4.19Å; M297-L362 HydrophobicContact SD-CD1 3.81Å; M297-L362 HydrophobicContact SD-CD2 4.04Å; L301-L362 HydrophobicContact CD1-CD2 4.29Å; L301-L362 HydrophobicContact CG-CD2 4.49Å; M350-L362 WeakPolarHBondContact CA-O 3.35Å; T351-L362 PolarHBondContact N-O 3.04Å; T351-L362 WeakPolarHBondContact O-CB 3.49Å; T351-L362 PolarHBondContact O-N 3.49Å; F353-L362 HydrophobicContact CD1-CB 4.2Å; F353-L362 HydrophobicContact CE1-CB 4.04Å; F353-L362 HydrophobicContact CE1-CD2 4.39Å
363	M	92.2	Very high	88.6	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	104.7	170.7	-65.8	166.2	-142.1	0	0	107.3	N282 L283 V284 V285 V348 G349 M350 T361 G378 Q381 A382 H569	N282-M363 HydrophobicContact CB-CE 3.8Å; L283-M363 PolarHBondContact O-N 2.94Å; V284-M363 CarbonylContact C-O 3.48Å; V284-M363 WeakPolarHBondContact CA-O 3.46Å; V284-M363 HydrophobicContact CB-CB 4.41Å; V284-M363 HydrophobicContact CG2-CB 4.34Å; V285-M363 PolarHBondContact N-O 3.37Å; V348-M363 HydrophobicContact CG1-CB 3.72Å; V348-M363 HydrophobicContact CG1-CG 4.16Å; G349-M363 WeakPolarHBondContact O-CA 3.46Å; M350-M363 HydrophobicContact CG-CG 4.27Å; T361-M363 HydrophobicContact CG2-CE 4.4Å; M363-G378 VanDerWaalsContact SD-O 3.41Å; M363-Q381 HydrophobicContact CE-CB 4.11Å; M363-Q381 HydrophobicContact SD-CB 4Å; M363-A382 HydrophobicContact SD-CB 4.44Å; M363-H569 WeakPolarHBondContact CE-CE1 3.07Å; M363-H569 WeakPolarHBondContact CE-NE2 3.09Å
364	D	93.3	Very high	88.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	128.6	169.5	-164.5	35.5	0	0	0	108.7	S294 L333 V348 G349	S294-D364 VanDerWaalsContact CA-OD2 3.26Å; S294-D364 WeakPolarHBondContact CA-OD2 3.46Å; S294-D364 WeakPolarHBondContact CB-OD2 3.36Å; S294-D364 PolarHBondContact OG-OD2 2.82Å; L333-D364 HydrophobicContact CD1-CB 4.12Å; V348-D364 WeakPolarHBondContact CA-O 3.41Å; G349-D364 PolarHBondContact N-O 2.96Å; G349-D364 PolarHBondContact O-N 3.03Å
365	A	91.2	Very high	88.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.162	C	C	.	.			trans	-108.9	140.2	-175.5	0	0	0	0	0	111.2	V284 V285 I286 K293 M375	V284-A365 HydrophobicContact CG2-CB 3.86Å; V285-A365 WeakPolarHBondContact O-CB 3.4Å; V285-A365 PolarHBondContact O-N 2.9Å; V285-A365 VanDerWaalsContact O-N 3.14Å; I286-A365 HydrophobicContact CG2-CB 4.46Å; K293-A365 WeakPolarHBondContact CE-O 3.34Å; A365-M375 HydrophobicContact CB-CB 4.21Å; A365-M375 HydrophobicContact CB-CG 3.59Å
366	P	90.7	Very high	89.1	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.006	16%	0.159	C	C	.	.			trans	-64.4	146.1	-174.3	28.9	-38.2	0	0	0	111.5	T345 F371 N374 M375	T345-P366 WeakPolarHBondContact O-CB 3.36Å; P366-F371 HydrophobicContact CB-CB 3.69Å; P366-F371 HydrophobicContact CG-CB 3.67Å; P366-F371 WeakPolarHBondContact CG-O 3.34Å; P366-N374 HydrophobicContact CG-CB 3.92Å; P366-M375 HydrophobicContact CG-CB 4.35Å
367	G	85.4	Confident	89.4	Confident	2 Å²	2	25.7 Å²	25.7	2%	0.021	13%	0.13	C	C	.	.			trans	-86	-23	-176.7	0	0	0	0	0	114.9	Q405	G367-Q405 PolarHBondContact O-NE2 2.92Å; G367-Q405 PolarHBondContact O-OE1 3.24Å
368	H	88.1	Confident	89.7	Confident	71 Å²	71	23.3 Å²	23.3	33%	0.329	11%	0.113	S	C	.	.	S	Bend	trans	-77.7	151.4	-167.7	-154.7	-112.8	0	0	0	113.6	V344 D370 F371 I372	V344-H368 HydrophobicContact CG1-CB 4.46Å; H368-D370 IonicContact CE1-OD2 3.68Å; H368-D370 PolarHBondContact CE1-OD2 2.98Å; H368-D370 IonicContact ND1-OD2 2.72Å; H368-D370 PolarHBondContact ND1-OD2 3.38Å; H368-D370 PolarHBondContact O-N 2.96Å; H368-F371 HydrophobicContact CB-CD2 3.52Å; H368-F371 HydrophobicContact CB-CE2 3.8Å; H368-F371 HydrophobicContact CB-CG 4.4Å; H368-F371 PolarHBondContact O-N 2.87Å; H368-I372 PolarHBondContact O-N 2.85Å
369	R	84.9	Confident	89.8	Confident	133 Å²	133	22.6 Å²	22.6	50%	0.502	11%	0.11	S	C	.	.	S	Bend	trans	-60.8	-29.3	-178.7	-83.8	178.5	173.9	154.5	-2	113.5	I372 G403 Q405 R688	R369-I372 WeakPolarHBondContact O-CG1 3.25Å; R369-G403 PolarHBondContact NH2-O 2.85Å; R369-Q405 HydrophobicContact CG-CG 4.11Å; R369-R688 PolarHBondContact O-NH2 3.26Å; R369-R688 VanDerWaalsContact O-NH2 3.14Å
370	D	88.5	Confident	89.8	Confident	100 Å²	100	22.9 Å²	22.9	54%	0.535	11%	0.113	S	C	.	.	S	Bend	trans	-79.2	-32.6	-179.1	-52.3	-48.2	0	0	0	112.2	H368 I372 P373	H368-D370 IonicContact CE1-OD2 3.68Å; H368-D370 PolarHBondContact CE1-OD2 2.98Å; H368-D370 IonicContact ND1-OD2 2.72Å; H368-D370 PolarHBondContact ND1-OD2 3.38Å; H368-D370 PolarHBondContact O-N 2.96Å; D370-I372 VanDerWaalsContact C-N 3.33Å; D370-P373 WeakPolarHBondContact O-CD 3.36Å
371	F	89.4	Confident	89.6	Confident	47 Å²	47	23.3 Å²	23.3	21%	0.206	12%	0.115	C	C	.	.	S	Bend	trans	-91.5	8.1	-177.6	-46	-43.6	0	0	0	113.5	M346 P366 H368 N374 M375	M346-F371 HydrophobicContact CE-CD1 4.33Å; M346-F371 HydrophobicContact CE-CE1 3.58Å; M346-F371 HydrophobicContact CE-CE2 4.05Å; M346-F371 HydrophobicContact CE-CZ 3.43Å; M346-F371 VanDerWaalsContact CE-CZ 3.43Å; M346-F371 HydrophobicContact SD-CD2 4.09Å; M346-F371 HydrophobicContact SD-CE1 4.05Å; M346-F371 HydrophobicContact SD-CE2 3.36Å; M346-F371 WeakPolarHBondContact SD-CE2 3.3Å; M346-F371 HydrophobicContact SD-CZ 3.35Å; M346-F371 WeakPolarHBondContact SD-CZ 3.46Å; P366-F371 HydrophobicContact CB-CB 3.69Å; P366-F371 HydrophobicContact CG-CB 3.67Å; P366-F371 WeakPolarHBondContact CG-O 3.34Å; H368-F371 HydrophobicContact CB-CD2 3.52Å; H368-F371 HydrophobicContact CB-CE2 3.8Å; H368-F371 HydrophobicContact CB-CG 4.4Å; H368-F371 PolarHBondContact O-N 2.87Å; F371-N374 WeakPolarHBondContact O-CA 3.46Å; F371-N374 WeakPolarHBondContact O-CB 2.86Å; F371-N374 PolarHBondContact O-N 3.34Å; F371-M375 PolarHBondContact O-N 3.43Å
372	I	89.4	Confident	89.6	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-48.8	-32.6	165.1	-59.8	-71.2	0	0	0	114.1	H368 R369 D370 N374 M375 I376 H409 L412 R688	H368-I372 PolarHBondContact O-N 2.85Å; R369-I372 WeakPolarHBondContact O-CG1 3.25Å; D370-I372 VanDerWaalsContact C-N 3.33Å; I372-N374 VanDerWaalsContact C-N 3.32Å; I372-N374 PolarHBondContact O-N 2.84Å; I372-M375 PolarHBondContact O-N 3.22Å; I372-I376 HydrophobicContact CG2-CD1 3.9Å; I372-I376 HydrophobicContact CG2-CG1 4.27Å; I372-I376 VanDerWaalsContact O-CG1 3.27Å; I372-I376 WeakPolarHBondContact O-CG1 2.97Å; I372-I376 PolarHBondContact O-N 3.09Å; I372-H409 VanDerWaalsContact CD1-CD2 3.5Å; I372-H409 WeakPolarHBondContact CD1-CD2 3.07Å; I372-H409 WeakPolarHBondContact CD1-NE2 3.45Å; I372-L412 HydrophobicContact CG2-CD1 3.81Å; I372-R688 VanDerWaalsContact CB-NH2 3.32Å; I372-R688 VanDerWaalsContact CG2-CZ 3.41Å
373	P	89.3	Confident	89.5	Confident	33 Å²	33	25 Å²	25	21%	0.214	13%	0.125	C	C	.	.	H	α-helix	trans	-55.3	-47.3	170.5	-27.1	38.8	0	0	0	112.1	D370 I376 T377 R688	D370-P373 WeakPolarHBondContact O-CD 3.36Å; P373-I376 WeakPolarHBondContact O-CB 3.48Å; P373-I376 PolarHBondContact O-N 2.81Å; P373-I376 VanDerWaalsContact O-N 3.15Å; P373-T377 WeakPolarHBondContact O-CG2 3.47Å; P373-T377 PolarHBondContact O-N 2.87Å; P373-R688 VanDerWaalsContact CD-NH1 3.31Å
374	N	90.6	Very high	89.5	Confident	44 Å²	44	25 Å²	25	24%	0.235	13%	0.125	C	C	.	.	H	α-helix	trans	-68.6	-39.8	178.9	-64.3	-4.7	0	0	0	110.5	M346 D347 V348 P366 F371 I372 I376 T377 G378	M346-N374 PolarHBondContact O-ND2 2.8Å; D347-N374 PolarHBondContact OD1-ND2 2.65Å; V348-N374 HydrophobicContact CG2-CB 4.34Å; V348-N374 WeakPolarHBondContact CG2-O 3.14Å; P366-N374 HydrophobicContact CG-CB 3.92Å; F371-N374 WeakPolarHBondContact O-CA 3.46Å; F371-N374 WeakPolarHBondContact O-CB 2.86Å; F371-N374 PolarHBondContact O-N 3.34Å; I372-N374 VanDerWaalsContact C-N 3.32Å; I372-N374 PolarHBondContact O-N 2.84Å; N374-I376 VanDerWaalsContact C-N 3.26Å; N374-I376 PolarHBondContact O-N 2.74Å; N374-T377 PolarHBondContact O-N 2.89Å; N374-T377 PolarHBondContact O-OG1 2.96Å; N374-G378 PolarHBondContact O-N 2.81Å
375	M	91.4	Very high	89.6	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59.6	-35.8	171	-165.9	-126.3	63	0	0	112.3	I286 A365 P366 F371 I372 A379 H409 L412	I286-M375 HydrophobicContact CG2-CG 4.37Å; I286-M375 HydrophobicContact CG2-SD 4.25Å; A365-M375 HydrophobicContact CB-CB 4.21Å; A365-M375 HydrophobicContact CB-CG 3.59Å; P366-M375 HydrophobicContact CG-CB 4.35Å; F371-M375 PolarHBondContact O-N 3.43Å; I372-M375 PolarHBondContact O-N 3.22Å; M375-A379 HydrophobicContact CE-CB 4.5Å; M375-A379 WeakPolarHBondContact O-CB 3.37Å; M375-A379 PolarHBondContact O-N 3.2Å; M375-H409 HydrophobicContact SD-CB 3.9Å; M375-H409 VanDerWaalsContact SD-CD2 3.51Å; M375-H409 VanDerWaalsContact SD-CG 3.53Å; M375-L412 HydrophobicContact CE-CB 3.99Å; M375-L412 HydrophobicContact CE-CD1 3.62Å; M375-L412 HydrophobicContact CE-CG 4.44Å
376	I	91.8	Very high	89.8	Confident	3 Å²	3	25 Å²	25	2%	0.015	13%	0.125	C	C	.	.	H	α-helix	trans	-70.2	-43.8	174.9	-70.4	165.8	0	0	0	111.3	I372 P373 N374 A379 A380 L412 H623 M686	I372-I376 HydrophobicContact CG2-CD1 3.9Å; I372-I376 HydrophobicContact CG2-CG1 4.27Å; I372-I376 VanDerWaalsContact O-CG1 3.27Å; I372-I376 WeakPolarHBondContact O-CG1 2.97Å; I372-I376 PolarHBondContact O-N 3.09Å; P373-I376 WeakPolarHBondContact O-CB 3.48Å; P373-I376 PolarHBondContact O-N 2.81Å; P373-I376 VanDerWaalsContact O-N 3.15Å; N374-I376 VanDerWaalsContact C-N 3.26Å; N374-I376 PolarHBondContact O-N 2.74Å; I376-A379 PolarHBondContact O-N 2.7Å; I376-A380 VanDerWaalsContact O-CB 3.23Å; I376-A380 WeakPolarHBondContact O-CB 3.19Å; I376-A380 PolarHBondContact O-N 3.24Å; I376-L412 HydrophobicContact CD1-CD1 4.21Å; I376-L412 HydrophobicContact CD1-CD2 3.91Å; I376-L412 HydrophobicContact CG1-CD1 4.07Å; I376-L412 HydrophobicContact CG1-CD2 4.06Å; I376-H623 HydrophobicContact CG2-CB 3.94Å; I376-M686 HydrophobicContact CD1-CB 4.43Å; I376-M686 HydrophobicContact CD1-CG 4.29Å; I376-M686 HydrophobicContact CG2-CG 4.46Å
377	T	89.3	Confident	90	Very high	32 Å²	32	25 Å²	25	20%	0.196	13%	0.125	C	C	.	.	H	α-helix	trans	-65.8	-40.4	179.9	61.7	0	0	0	0	111.8	P373 N374 Q381	P373-T377 WeakPolarHBondContact O-CG2 3.47Å; P373-T377 PolarHBondContact O-N 2.87Å; N374-T377 PolarHBondContact O-N 2.89Å; N374-T377 PolarHBondContact O-OG1 2.96Å; T377-Q381 WeakPolarHBondContact O-CG 3.47Å; T377-Q381 PolarHBondContact O-NE2 3.28Å
378	G	88.9	Confident	90.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.3	-52.3	172.3	0	0	0	0	0	112.2	M363 N374 A380 Q381 A382	M363-G378 VanDerWaalsContact SD-O 3.41Å; N374-G378 PolarHBondContact O-N 2.81Å; G378-A380 PolarHBondContact O-N 2.99Å; G378-Q381 WeakPolarHBondContact O-CB 3.3Å; G378-Q381 PolarHBondContact O-N 3.19Å; G378-A382 PolarHBondContact O-N 2.91Å
379	A	90.3	Very high	90.7	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.008	11%	0.11	C	C	.	.	H	α-helix	trans	-65.9	-21.5	-179.1	0	0	0	0	0	114.2	V284 M375 I376 Q381 V413 L416	V284-A379 HydrophobicContact CG1-CB 4.13Å; V284-A379 HydrophobicContact CG2-CB 4.24Å; M375-A379 HydrophobicContact CE-CB 4.5Å; M375-A379 WeakPolarHBondContact O-CB 3.37Å; M375-A379 PolarHBondContact O-N 3.2Å; I376-A379 PolarHBondContact O-N 2.7Å; A379-Q381 VanDerWaalsContact C-N 3.25Å; A379-Q381 PolarHBondContact O-N 2.94Å; A379-V413 HydrophobicContact CB-CG2 3.91Å; A379-L416 HydrophobicContact CB-CD1 3.44Å; A379-L416 VanDerWaalsContact CB-CD1 3.44Å
380	A	88.3	Confident	91.1	Very high	11 Å²	11	15.5 Å²	15.5	9%	0.091	9%	0.087	C	C	.	.	H	α-helix	trans	-71.6	-21.3	173.4	0	0	0	0	0	112.7	I376 G378 L416	I376-A380 VanDerWaalsContact O-CB 3.23Å; I376-A380 WeakPolarHBondContact O-CB 3.19Å; I376-A380 PolarHBondContact O-N 3.24Å; G378-A380 PolarHBondContact O-N 2.99Å; A380-L416 HydrophobicContact CB-CD2 4.08Å
381	Q	86.7	Confident	91.4	Very high	10 Å²	10	10.8 Å²	10.8	5%	0.047	6%	0.061	C	C	.	.	H	α-helix	trans	-91.5	-20.1	179.3	-65.5	170.1	74.3	0	0	112.5	N282 M363 T377 G378 A379 S513 K528 H569	N282-Q381 PolarHBondContact ND2-O 3.4Å; M363-Q381 HydrophobicContact CE-CB 4.11Å; M363-Q381 HydrophobicContact SD-CB 4Å; T377-Q381 WeakPolarHBondContact O-CG 3.47Å; T377-Q381 PolarHBondContact O-NE2 3.28Å; G378-Q381 WeakPolarHBondContact O-CB 3.3Å; G378-Q381 PolarHBondContact O-N 3.19Å; A379-Q381 VanDerWaalsContact C-N 3.25Å; A379-Q381 PolarHBondContact O-N 2.94Å; Q381-S513 PolarHBondContact OE1-OG 3.07Å; Q381-K528 HydrophobicContact CB-CD 3.84Å; Q381-K528 HydrophobicContact CG-CB 4.37Å; Q381-K528 HydrophobicContact CG-CD 4.23Å; Q381-K528 WeakPolarHBondContact O-CD 3.42Å; Q381-K528 WeakPolarHBondContact O-CE 3.37Å; Q381-K528 PolarHBondContact O-NZ 3.15Å; Q381-H569 WeakPolarHBondContact CB-CE1 3.34Å; Q381-H569 VanDerWaalsContact CG-CE1 3.47Å; Q381-H569 WeakPolarHBondContact CG-CE1 3.29Å; Q381-H569 PolarHBondContact O-NE2 2.96Å; Q381-H569 PolarHBondContact OE1-CE1 3.02Å
382	A	90.2	Very high	91.5	Very high	11 Å²	11	9.6 Å²	9.6	9%	0.091	6%	0.059	C	C	.	.			trans	-82.2	152.4	-176.8	0	0	0	0	0	115.1	V284 M363 G378	V284-A382 HydrophobicContact CB-CB 3.62Å; V284-A382 HydrophobicContact CG1-CB 3.62Å; M363-A382 HydrophobicContact SD-CB 4.44Å; G378-A382 PolarHBondContact O-N 2.91Å
383	D	90.1	Very high	91.4	Very high	25 Å²	25	18.1 Å²	18.1	13%	0.134	9%	0.091	C	C	.	.	S	Bend	trans	-98.1	-30.2	176.6	-54.7	-56.1	0	0	0	112.3	L281 N282 P500 R502	L281-D383 HydrophobicContact CD1-CB 4.17Å; N282-D383 WeakPolarHBondContact CB-OD2 3.44Å; N282-D383 PolarHBondContact N-OD2 3.2Å; N282-D383 PolarHBondContact O-N 2.78Å; D383-P500 HydrophobicContact CB-CG 3.85Å; D383-P500 WeakPolarHBondContact OD1-CG 3.48Å; D383-R502 VanDerWaalsContact CG-NH1 3.25Å; D383-R502 IonicContact OD1-CZ 3.33Å; D383-R502 IonicContact OD1-NH1 2.71Å; D383-R502 PolarHBondContact OD1-NH1 3.07Å; D383-R502 IonicContact OD1-NH2 3.7Å; D383-R502 IonicContact OD2-CZ 3.87Å; D383-R502 VanDerWaalsContact OD2-CZ 3.32Å; D383-R502 IonicContact OD2-NH1 3.94Å; D383-R502 PolarHBondContact OD2-NH1 2.92Å; D383-R502 VanDerWaalsContact OD2-NH1 3.08Å; D383-R502 IonicContact OD2-NH2 3.32Å; D383-R502 PolarHBondContact OD2-NH2 2.88Å
384	V	92.8	Very high	91.3	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	151.4	-171.4	174.5	0	0	0	0	108.1	L281 N282 L283 V284 Q420 F497	L281-V384 HydrophobicContact CD1-CG2 3.84Å; L281-V384 HydrophobicContact CD2-CG2 4.2Å; L281-V384 HydrophobicContact CG-CG2 4.24Å; N282-V384 PolarHBondContact O-N 3.09Å; L283-V384 WeakPolarHBondContact CA-O 3.47Å; L283-V384 HydrophobicContact CD1-CG1 4.48Å; V284-V384 PolarHBondContact N-O 3.35Å; V384-Q420 HydrophobicContact CG2-CB 4.28Å; V384-F497 HydrophobicContact CG1-CD1 4.34Å; V384-F497 HydrophobicContact CG1-CD2 3.49Å; V384-F497 VanDerWaalsContact CG1-CD2 3.49Å; V384-F497 HydrophobicContact CG1-CE1 4.36Å; V384-F497 HydrophobicContact CG1-CE2 3.53Å; V384-F497 HydrophobicContact CG1-CG 3.93Å; V384-F497 HydrophobicContact CG1-CZ 3.98Å; V384-F497 HydrophobicContact CG2-CB 4.34Å; V384-F497 HydrophobicContact CG2-CG 4.38Å
385	A	94.4	Very high	91.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	151.6	175.3	0	0	0	0	0	113.1	V284 I286 V413 V418 Q420 L421 A422	V284-A385 HydrophobicContact CG1-CB 3.7Å; V284-A385 CarbonylContact O-C 3.59Å; V284-A385 VanDerWaalsContact O-CA 3.23Å; V284-A385 WeakPolarHBondContact O-CA 3.48Å; I286-A385 HydrophobicContact CD1-CB 4.28Å; A385-V413 HydrophobicContact CB-CG1 3.68Å; A385-V418 HydrophobicContact CB-CG1 4.25Å; A385-Q420 PolarHBondContact N-O 3.09Å; A385-L421 HydrophobicContact CB-CD1 3.67Å; A385-L421 WeakPolarHBondContact O-CA 3.42Å; A385-A422 PolarHBondContact O-N 3.19Å
386	V	95.2	Very high	91.2	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	110.4	166.2	178.8	0	0	0	0	107.7	L283 V284 V285 I286 V388 A422 A424 L490	L283-V386 HydrophobicContact CD1-CG2 3.94Å; L283-V386 HydrophobicContact CD2-CG2 3.78Å; L283-V386 HydrophobicContact CG-CG2 4.13Å; V284-V386 PolarHBondContact O-N 2.97Å; V285-V386 WeakPolarHBondContact CA-O 3.15Å; V285-V386 HydrophobicContact CG2-CB 4.33Å; I286-V386 PolarHBondContact N-O 3.08Å; V386-V388 HydrophobicContact CG1-CG2 4.18Å; V386-A422 CarbonylContact C-O 3.53Å; V386-A422 WeakPolarHBondContact CA-O 3.23Å; V386-A422 HydrophobicContact CG1-CB 4.5Å; V386-A422 HydrophobicContact CG2-CB 4.15Å; V386-A424 HydrophobicContact CG1-CB 4.12Å; V386-L490 HydrophobicContact CG1-CD1 4.37Å
387	L	94.9	Very high	91.1	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.01	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	105.1	171.6	-179.3	67.6	0	0	0	109.2	I286 V389 T406 A410 L421 A422 V423 A424	I286-L387 HydrophobicContact CD1-CB 4.34Å; I286-L387 HydrophobicContact CD1-CD1 3.93Å; I286-L387 HydrophobicContact CG1-CB 4.13Å; I286-L387 HydrophobicContact CG1-CD1 3.73Å; I286-L387 CarbonylContact O-C 3.51Å; I286-L387 WeakPolarHBondContact O-CA 3.23Å; L387-V389 HydrophobicContact CD2-CG2 4.04Å; L387-V389 HydrophobicContact CG-CG2 3.74Å; L387-T406 HydrophobicContact CD1-CG2 3.78Å; L387-T406 HydrophobicContact CD2-CG2 4.31Å; L387-T406 HydrophobicContact CG-CG2 4.27Å; L387-A410 HydrophobicContact CD2-CB 4.27Å; L387-L421 HydrophobicContact CB-CD1 4.05Å; L387-L421 HydrophobicContact CB-CD2 4.45Å; L387-L421 HydrophobicContact CB-CG 4.37Å; L387-L421 HydrophobicContact CD2-CD2 4.42Å; L387-A422 PolarHBondContact N-O 3.44Å; L387-V423 HydrophobicContact CB-CG2 4.5Å; L387-V423 HydrophobicContact CD2-CG2 4.42Å; L387-V423 CarbonylContact O-C 3.54Å; L387-V423 VanDerWaalsContact O-CA 3.31Å; L387-V423 WeakPolarHBondContact O-CA 3.43Å; L387-A424 PolarHBondContact O-N 3.23Å
388	V	94.8	Very high	91	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	126.8	172.2	-164.3	0	0	0	0	108.9	V285 I286 G287 A291 K293 L296 V386 A424 N426	V285-V388 HydrophobicContact CG1-CG2 3.61Å; I286-V388 PolarHBondContact O-N 3.04Å; G287-V388 VanDerWaalsContact CA-O 3.3Å; G287-V388 WeakPolarHBondContact CA-O 3.31Å; A291-V388 HydrophobicContact CB-CG1 4.24Å; A291-V388 WeakPolarHBondContact O-CG1 3.42Å; K293-V388 HydrophobicContact CG-CB 4.19Å; K293-V388 HydrophobicContact CG-CG2 4.23Å; L296-V388 HydrophobicContact CD2-CG1 3.93Å; L296-V388 HydrophobicContact CD2-CG2 3.78Å; V386-V388 HydrophobicContact CG1-CG2 4.18Å; V388-A424 WeakPolarHBondContact CA-O 3.19Å; V388-N426 HydrophobicContact CG1-CB 3.78Å
389	V	93.9	Very high	90.8	Very high	3 Å²	3	22.4 Å²	22.4	2%	0.018	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	139.1	-177.3	-171.7	0	0	0	0	108.4	L387 F396 T406 V423 A424 I425 N426 L445	L387-V389 HydrophobicContact CD2-CG2 4.04Å; L387-V389 HydrophobicContact CG-CG2 3.74Å; V389-F396 HydrophobicContact CG1-CD2 3.59Å; V389-F396 HydrophobicContact CG1-CE2 3.87Å; V389-T406 HydrophobicContact CG1-CG2 4.4Å; V389-T406 HydrophobicContact CG2-CG2 3.82Å; V389-V423 HydrophobicContact CG2-CG1 3.98Å; V389-A424 PolarHBondContact N-O 2.99Å; V389-I425 CarbonylContact O-C 3.53Å; V389-I425 WeakPolarHBondContact O-CA 3.37Å; V389-N426 PolarHBondContact O-N 2.93Å; V389-L445 HydrophobicContact CB-CD1 4.39Å; V389-L445 HydrophobicContact CG1-CD1 4.21Å; V389-L445 HydrophobicContact CG2-CD1 3.99Å
390	D	93.4	Very high	90.7	Very high	4 Å²	4	23.9 Å²	23.9	2%	0.021	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	147.7	178.1	-145.5	-81.4	0	0	0	112.7	S392 E395 F396 K427	D390-S392 WeakPolarHBondContact OD1-CB 3.47Å; D390-S392 PolarHBondContact OD1-N 3.48Å; D390-E395 HydrophobicContact CB-CB 3.95Å; D390-F396 WeakPolarHBondContact O-CB 3.26Å; D390-K427 IonicContact OD1-NZ 3.97Å; D390-K427 WeakPolarHBondContact OD2-CD 3.35Å; D390-K427 WeakPolarHBondContact OD2-CE 3.46Å; D390-K427 VanDerWaalsContact OD2-CG 3.31Å; D390-K427 WeakPolarHBondContact OD2-CG 3.23Å; D390-K427 IonicContact OD2-NZ 2.84Å; D390-K427 PolarHBondContact OD2-NZ 3.46Å
391	A	93.3	Very high	90.6	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.155	C	C	.	.			trans	-89.1	-23.8	172.9	0	0	0	0	0	113.3	I425 N426 M428 V431 R437 I441	A391-I425 HydrophobicContact CB-CG2 3.92Å; A391-N426 WeakPolarHBondContact CB-O 3.33Å; A391-N426 PolarHBondContact N-O 2.97Å; A391-M428 HydrophobicContact CB-CG 4.12Å; A391-M428 HydrophobicContact CB-SD 3.61Å; A391-V431 HydrophobicContact CB-CG2 3.9Å; A391-R437 PolarHBondContact O-NE 3.29Å; A391-I441 HydrophobicContact CB-CD1 4.36Å
392	S	91.9	Very high	89.8	Confident	22 Å²	22	33.2 Å²	33.2	15%	0.154	19%	0.188	C	C	.	.	S	Bend	trans	-64.7	161.4	-171.1	-155.8	0	0	0	0	112.6	D390 F396 Q430 R437	D390-S392 WeakPolarHBondContact OD1-CB 3.47Å; D390-S392 PolarHBondContact OD1-N 3.48Å; S392-F396 WeakPolarHBondContact O-CB 3.42Å; S392-F396 PolarHBondContact O-N 2.89Å; S392-Q430 VanDerWaalsContact CB-OE1 3.26Å; S392-Q430 PolarHBondContact OG-OE1 3.48Å; S392-R437 PolarHBondContact O-NH2 2.83Å
393	R	88.5	Confident	89.2	Confident	179 Å²	179	34.7 Å²	34.7	68%	0.675	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.7	122	-176.4	-63.5	-176.2	-174.8	-169.7	2.5	109.4
394	G	87.3	Confident	88.9	Confident	43 Å²	43	33.8 Å²	33.8	44%	0.443	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	107.4	-62.3	-170.3	0	0	0	0	0	111.2	F396 E397 A398	G394-F396 PolarHBondContact O-N 3.4Å; G394-E397 PolarHBondContact N-OE2 2.97Å; G394-E397 PolarHBondContact O-N 3.16Å; G394-A398 WeakPolarHBondContact O-CB 3.49Å; G394-A398 PolarHBondContact O-N 3.48Å
395	E	87.9	Confident	88.6	Confident	51 Å²	51	34.4 Å²	34.4	24%	0.238	20%	0.203	C	C	.	.	H	α-helix	trans	-59.1	-45.3	179.6	-68.7	-165.9	-133	0	0	113.3	D290 D390 E397 A398 G399 K427	D290-E395 VanDerWaalsContact CB-OE2 3.3Å; D290-E395 WeakPolarHBondContact CB-OE2 3.41Å; D390-E395 HydrophobicContact CB-CB 3.95Å; E395-E397 VanDerWaalsContact C-N 3.34Å; E395-E397 PolarHBondContact O-N 2.88Å; E395-A398 PolarHBondContact O-N 2.86Å; E395-G399 PolarHBondContact O-N 2.86Å; E395-K427 IonicContact OE1-NZ 3.81Å; E395-K427 PolarHBondContact OE1-NZ 3.34Å; E395-K427 IonicContact OE2-NZ 3.17Å; E395-K427 PolarHBondContact OE2-NZ 2.68Å
396	F	90.4	Very high	88.4	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.018	21%	0.205	C	C	.	.	H	α-helix	trans	-61.6	-44.6	176.1	171.7	-114.2	0	0	0	111.6	V389 D390 S392 G394 F400 I441 K444 L445	V389-F396 HydrophobicContact CG1-CD2 3.59Å; V389-F396 HydrophobicContact CG1-CE2 3.87Å; D390-F396 WeakPolarHBondContact O-CB 3.26Å; S392-F396 WeakPolarHBondContact O-CB 3.42Å; S392-F396 PolarHBondContact O-N 2.89Å; G394-F396 PolarHBondContact O-N 3.4Å; F396-F400 HydrophobicContact CE2-CB 4.29Å; F396-F400 HydrophobicContact CZ-CB 4.36Å; F396-F400 HydrophobicContact CZ-CD1 4.44Å; F396-F400 HydrophobicContact CZ-CG 4.3Å; F396-F400 WeakPolarHBondContact O-CB 3.23Å; F396-F400 PolarHBondContact O-N 3.3Å; F396-I441 HydrophobicContact CD1-CG1 3.89Å; F396-I441 HydrophobicContact CD2-CD1 4.48Å; F396-I441 HydrophobicContact CD2-CG1 4.13Å; F396-I441 HydrophobicContact CD2-CG2 4.19Å; F396-I441 HydrophobicContact CE1-CG1 3.81Å; F396-I441 HydrophobicContact CE2-CB 4.31Å; F396-I441 HydrophobicContact CE2-CG1 4.08Å; F396-I441 HydrophobicContact CE2-CG2 3.71Å; F396-I441 HydrophobicContact CG-CD1 4.34Å; F396-I441 HydrophobicContact CG-CG1 4.06Å; F396-I441 HydrophobicContact CZ-CB 4.18Å; F396-I441 HydrophobicContact CZ-CG1 3.91Å; F396-I441 HydrophobicContact CZ-CG2 4.03Å; F396-K444 HydrophobicContact CE1-CD 3.59Å; F396-K444 HydrophobicContact CZ-CB 4.11Å; F396-K444 HydrophobicContact CZ-CD 3.96Å; F396-L445 HydrophobicContact CE2-CD2 4.27Å; F396-L445 HydrophobicContact CE2-CG 4.26Å
397	E	90.2	Very high	88	Confident	57 Å²	57	37.8 Å²	37.8	27%	0.266	22%	0.217	S	C	.	.	H	α-helix	trans	-61.4	-49.1	178.8	-76.9	68.5	-150.9	0	0	111.4	G394 E395 F400 E401 R437 K444	G394-E397 PolarHBondContact N-OE2 2.97Å; G394-E397 PolarHBondContact O-N 3.16Å; E395-E397 VanDerWaalsContact C-N 3.34Å; E395-E397 PolarHBondContact O-N 2.88Å; E397-F400 CarbonylContact O-C 3.26Å; E397-F400 VanDerWaalsContact O-C 3.26Å; E397-F400 WeakPolarHBondContact O-CA 3.4Å; E397-F400 PolarHBondContact O-N 3.44Å; E397-E401 PolarHBondContact O-N 3.15Å; E397-R437 IonicContact OE1-CZ 2.91Å; E397-R437 IonicContact OE1-NH1 3.81Å; E397-R437 PolarHBondContact OE1-NH1 2.91Å; E397-R437 IonicContact OE1-NH2 3.84Å; E397-R437 PolarHBondContact OE1-NH2 2.88Å; E397-R437 VanDerWaalsContact OE1-NH2 3.08Å; E397-R437 IonicContact OE2-CZ 2.67Å; E397-R437 IonicContact OE2-NH1 3.84Å; E397-R437 IonicContact OE2-NH2 2.69Å; E397-R437 PolarHBondContact OE2-NH2 2.7Å; E397-K444 IonicContact OE1-NZ 3.74Å
398	A	87.9	Confident	87.8	Confident	45 Å²	45	39.5 Å²	39.5	37%	0.372	23%	0.225	S	C	.	.	H	α-helix	trans	-61.8	-45.2	177	0	0	0	0	0	112.6	G394 E395 F400 E401 G404	G394-A398 WeakPolarHBondContact O-CB 3.49Å; G394-A398 PolarHBondContact O-N 3.48Å; E395-A398 PolarHBondContact O-N 2.86Å; A398-F400 PolarHBondContact O-N 2.98Å; A398-E401 PolarHBondContact O-N 3.04Å; A398-G404 WeakPolarHBondContact O-CA 3.27Å
399	G	85.1	Confident	87.5	Confident	2 Å²	2	39.5 Å²	39.5	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-61.5	-27	173.1	0	0	0	0	0	113.2	E395 G404 T406	E395-G399 PolarHBondContact O-N 2.86Å; G399-G404 CarbonylContact O-C 3.47Å; G399-G404 WeakPolarHBondContact O-CA 3.48Å; G399-T406 VanDerWaalsContact O-CB 3.26Å; G399-T406 WeakPolarHBondContact O-CB 3.38Å; G399-T406 PolarHBondContact O-OG1 3.28Å
400	F	88.1	Confident	87.4	Confident	33 Å²	33	39.4 Å²	39.4	15%	0.145	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	15.1	-179.7	-166	-113.2	0	0	0	114	F396 E397 A398 R407 K444 L445 F448	F396-F400 HydrophobicContact CE2-CB 4.29Å; F396-F400 HydrophobicContact CZ-CB 4.36Å; F396-F400 HydrophobicContact CZ-CD1 4.44Å; F396-F400 HydrophobicContact CZ-CG 4.3Å; F396-F400 WeakPolarHBondContact O-CB 3.23Å; F396-F400 PolarHBondContact O-N 3.3Å; E397-F400 CarbonylContact O-C 3.26Å; E397-F400 VanDerWaalsContact O-C 3.26Å; E397-F400 WeakPolarHBondContact O-CA 3.4Å; E397-F400 PolarHBondContact O-N 3.44Å; A398-F400 PolarHBondContact O-N 2.98Å; F400-R407 HydrophobicContact CD2-CG 4.05Å; F400-R407 HydrophobicContact CE2-CG 4.42Å; F400-R407 VanDerWaalsContact CZ-NH2 3.31Å; F400-R407 PolarHBondContact O-NE 2.89Å; F400-R407 VanDerWaalsContact O-NE 3.09Å; F400-R407 PolarHBondContact O-NH1 2.97Å; F400-R407 VanDerWaalsContact O-NH1 3.07Å; F400-R407 PolarHBondContact O-NH2 3.37Å; F400-K444 HydrophobicContact CE1-CB 3.98Å; F400-K444 HydrophobicContact CE1-CG 4.4Å; F400-K444 HydrophobicContact CZ-CB 4.1Å; F400-K444 WeakPolarHBondContact CZ-O 3.5Å; F400-L445 HydrophobicContact CD2-CD2 4.01Å; F400-L445 HydrophobicContact CE2-CD2 4.06Å; F400-F448 HydrophobicContact CE2-CB 3.7Å; F400-F448 HydrophobicContact CE2-CD1 4.42Å; F400-F448 AromaticContact CE2-CG 3.97Å; F400-F448 HydrophobicContact CE2-CG 3.97Å; F400-F448 HydrophobicContact CZ-CB 3.99Å
401	E	85.6	Confident	87.2	Confident	128 Å²	128	41.2 Å²	41.2	60%	0.598	23%	0.233	S	C	*	.	S	Bend	trans	-81.2	179	179	-101.3	-178.8	-157	0	0	114.1	E397 A398 G403 G404 R407	E397-E401 PolarHBondContact O-N 3.15Å; A398-E401 PolarHBondContact O-N 3.04Å; E401-G403 PolarHBondContact O-N 3Å; E401-G404 PolarHBondContact O-N 3.34Å; E401-R407 VanDerWaalsContact C-NH1 3.26Å; E401-R407 WeakPolarHBondContact O-CD 3.4Å; E401-R407 PolarHBondContact O-NH1 3.45Å
402	A	70.8	Confident	87.1	Confident	89 Å²	89	41.2 Å²	41.2	74%	0.736	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	61.2	-179.8	0	0	0	0	0	111.8
403	G	76.3	Confident	87.1	Confident	42 Å²	42	40.2 Å²	40.2	43%	0.433	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	144.9	1.8	-167.6	0	0	0	0	0	113.2	R369 E401	R369-G403 PolarHBondContact NH2-O 2.85Å; E401-G403 PolarHBondContact O-N 3Å
404	G	84.3	Confident	87.2	Confident	5 Å²	5	35 Å²	35	5%	0.052	21%	0.206	C	C	.	.			trans	-68.8	137	175.6	0	0	0	0	0	112.5	A398 G399 E401 T406 R407 E408	A398-G404 WeakPolarHBondContact O-CA 3.27Å; G399-G404 CarbonylContact O-C 3.47Å; G399-G404 WeakPolarHBondContact O-CA 3.48Å; E401-G404 PolarHBondContact O-N 3.34Å; G404-T406 VanDerWaalsContact C-N 3.31Å; G404-T406 PolarHBondContact O-N 3.5Å; G404-R407 PolarHBondContact O-N 2.95Å; G404-E408 PolarHBondContact O-N 3.08Å
405	Q	87.3	Confident	87.3	Confident	13 Å²	13	34.3 Å²	34.3	6%	0.061	20%	0.195	C	C	.	.	H	α-helix	trans	-53.2	-44.4	-176.1	-72.5	163.7	-3.3	0	0	112.4	H288 V289 G367 R369 R407 E408 H409	H288-Q405 PolarHBondContact ND1-OE1 2.9Å; V289-Q405 VanDerWaalsContact N-OE1 3.14Å; G367-Q405 PolarHBondContact O-NE2 2.92Å; G367-Q405 PolarHBondContact O-OE1 3.24Å; R369-Q405 HydrophobicContact CG-CG 4.11Å; Q405-R407 PolarHBondContact O-N 3.47Å; Q405-R407 VanDerWaalsContact O-N 3.13Å; Q405-E408 PolarHBondContact O-N 3.15Å; Q405-H409 WeakPolarHBondContact O-CB 3.38Å; Q405-H409 PolarHBondContact O-CD2 2.89Å; Q405-H409 PolarHBondContact O-N 3.38Å
406	T	89.1	Confident	87.3	Confident	7 Å²	7	32.6 Å²	32.6	4%	0.043	19%	0.188	C	C	.	.	H	α-helix	trans	-54.9	-35.1	179.8	-45.9	0	0	0	0	112.6	L387 V389 G399 G404 A410	L387-T406 HydrophobicContact CD1-CG2 3.78Å; L387-T406 HydrophobicContact CD2-CG2 4.31Å; L387-T406 HydrophobicContact CG-CG2 4.27Å; V389-T406 HydrophobicContact CG1-CG2 4.4Å; V389-T406 HydrophobicContact CG2-CG2 3.82Å; G399-T406 VanDerWaalsContact O-CB 3.26Å; G399-T406 WeakPolarHBondContact O-CB 3.38Å; G399-T406 PolarHBondContact O-OG1 3.28Å; G404-T406 VanDerWaalsContact C-N 3.31Å; G404-T406 PolarHBondContact O-N 3.5Å; T406-A410 WeakPolarHBondContact O-CB 3.5Å; T406-A410 PolarHBondContact O-N 2.86Å
407	R	88.2	Confident	87.1	Confident	65 Å²	65	33.3 Å²	33.3	25%	0.245	20%	0.196	C	C	.	.	H	α-helix	trans	-75.5	-42.3	174.4	-73.5	-168.7	175.7	159.6	-5.1	112.9	F400 E401 G404 Q405 L411 F448	F400-R407 HydrophobicContact CD2-CG 4.05Å; F400-R407 HydrophobicContact CE2-CG 4.42Å; F400-R407 VanDerWaalsContact CZ-NH2 3.31Å; F400-R407 PolarHBondContact O-NE 2.89Å; F400-R407 VanDerWaalsContact O-NE 3.09Å; F400-R407 PolarHBondContact O-NH1 2.97Å; F400-R407 VanDerWaalsContact O-NH1 3.07Å; F400-R407 PolarHBondContact O-NH2 3.37Å; E401-R407 VanDerWaalsContact C-NH1 3.26Å; E401-R407 WeakPolarHBondContact O-CD 3.4Å; E401-R407 PolarHBondContact O-NH1 3.45Å; G404-R407 PolarHBondContact O-N 2.95Å; Q405-R407 PolarHBondContact O-N 3.47Å; Q405-R407 VanDerWaalsContact O-N 3.13Å; R407-L411 VanDerWaalsContact O-CB 3.27Å; R407-L411 WeakPolarHBondContact O-CB 3.34Å; R407-L411 PolarHBondContact O-N 2.73Å; R407-L411 VanDerWaalsContact O-N 3.15Å; R407-F448 HydrophobicContact CB-CE1 4.05Å; R407-F448 HydrophobicContact CB-CE2 4.03Å; R407-F448 HydrophobicContact CB-CZ 3.54Å; R407-F448 HydrophobicContact CG-CD1 4.32Å; R407-F448 HydrophobicContact CG-CD2 4.22Å; R407-F448 HydrophobicContact CG-CE1 3.88Å; R407-F448 HydrophobicContact CG-CE2 3.77Å; R407-F448 HydrophobicContact CG-CG 4.48Å; R407-F448 HydrophobicContact CG-CZ 3.6Å
408	E	88.9	Confident	87.1	Confident	38 Å²	38	30.9 Å²	30.9	18%	0.178	19%	0.185	C	C	.	.	H	α-helix	trans	-63.5	-45.3	177.3	-175.6	166.8	-158.7	0	0	110.9	G404 Q405 L411 L412 T693	G404-E408 PolarHBondContact O-N 3.08Å; Q405-E408 PolarHBondContact O-N 3.15Å; E408-L411 PolarHBondContact O-N 2.91Å; E408-L412 HydrophobicContact CG-CD1 3.85Å; E408-L412 HydrophobicContact CG-CG 4.29Å; E408-L412 WeakPolarHBondContact O-CB 3.45Å; E408-L412 WeakPolarHBondContact O-CG 3.11Å; E408-L412 PolarHBondContact O-N 2.86Å; E408-T693 WeakPolarHBondContact OE1-CB 3.25Å; E408-T693 PolarHBondContact OE1-N 3.32Å; E408-T693 PolarHBondContact OE1-OG1 2.83Å
409	H	90.4	Very high	87.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.3	-49	-179.7	-62.5	-177.6	0	0	0	111.8	I286 G287 I372 M375 Q405 L411 L412 V413	I286-H409 HydrophobicContact CB-CB 4.16Å; I286-H409 HydrophobicContact CD1-CB 4.26Å; G287-H409 PolarHBondContact N-ND1 3.03Å; G287-H409 PolarHBondContact O-CE1 3.33Å; G287-H409 PolarHBondContact O-ND1 3.31Å; I372-H409 VanDerWaalsContact CD1-CD2 3.5Å; I372-H409 WeakPolarHBondContact CD1-CD2 3.07Å; I372-H409 WeakPolarHBondContact CD1-NE2 3.45Å; M375-H409 HydrophobicContact SD-CB 3.9Å; M375-H409 VanDerWaalsContact SD-CD2 3.51Å; M375-H409 VanDerWaalsContact SD-CG 3.53Å; Q405-H409 WeakPolarHBondContact O-CB 3.38Å; Q405-H409 PolarHBondContact O-CD2 2.89Å; Q405-H409 PolarHBondContact O-N 3.38Å; H409-L411 VanDerWaalsContact C-N 3.27Å; H409-L411 PolarHBondContact O-N 3.17Å; H409-L412 PolarHBondContact O-N 2.88Å; H409-V413 WeakPolarHBondContact O-CB 3.46Å; H409-V413 WeakPolarHBondContact O-CG2 3.34Å; H409-V413 PolarHBondContact O-N 3.11Å
410	A	90.7	Very high	87.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63	-33.7	177.6	0	0	0	0	0	112.6	L387 T406 R414 F448 L449	L387-A410 HydrophobicContact CD2-CB 4.27Å; T406-A410 WeakPolarHBondContact O-CB 3.5Å; T406-A410 PolarHBondContact O-N 2.86Å; A410-R414 VanDerWaalsContact O-CB 3.32Å; A410-R414 WeakPolarHBondContact O-CB 3.36Å; A410-R414 PolarHBondContact O-N 2.83Å; A410-F448 HydrophobicContact CB-CE1 4.08Å; A410-L449 HydrophobicContact CB-CD2 4.11Å
411	L	89.3	Confident	87.8	Confident	42 Å²	42	31.6 Å²	31.6	22%	0.22	19%	0.185	C	C	.	.	H	α-helix	trans	-75.5	-37.5	177.6	-173.6	59	0	0	0	112.5	R407 E408 H409 S415 A452 F608	R407-L411 VanDerWaalsContact O-CB 3.27Å; R407-L411 WeakPolarHBondContact O-CB 3.34Å; R407-L411 PolarHBondContact O-N 2.73Å; R407-L411 VanDerWaalsContact O-N 3.15Å; E408-L411 PolarHBondContact O-N 2.91Å; H409-L411 VanDerWaalsContact C-N 3.27Å; H409-L411 PolarHBondContact O-N 3.17Å; L411-S415 WeakPolarHBondContact O-CB 3.41Å; L411-S415 PolarHBondContact O-N 2.8Å; L411-S415 VanDerWaalsContact O-N 3.17Å; L411-S415 PolarHBondContact O-OG 3.14Å; L411-A452 HydrophobicContact CD1-CB 4.29Å; L411-F608 HydrophobicContact CD1-CD1 4.22Å; L411-F608 HydrophobicContact CD1-CE1 3.77Å; L411-F608 HydrophobicContact CD1-CZ 4.37Å; L411-F608 HydrophobicContact CD2-CB 4.27Å; L411-F608 HydrophobicContact CD2-CD1 3.51Å; L411-F608 HydrophobicContact CD2-CD2 4.23Å; L411-F608 HydrophobicContact CD2-CE1 3.73Å; L411-F608 HydrophobicContact CD2-CE2 4.43Å; L411-F608 HydrophobicContact CD2-CG 3.76Å; L411-F608 HydrophobicContact CD2-CZ 4.18Å; L411-F608 HydrophobicContact CG-CD1 3.92Å; L411-F608 HydrophobicContact CG-CE1 3.56Å; L411-F608 HydrophobicContact CG-CE2 4.37Å; L411-F608 HydrophobicContact CG-CG 4.44Å; L411-F608 HydrophobicContact CG-CZ 3.8Å
412	L	90.7	Very high	88.2	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-62.5	-54.7	170.8	-79.6	170.4	0	0	0	110.7	I372 M375 I376 E408 H409 R414 S415 L416 M686 T693	I372-L412 HydrophobicContact CG2-CD1 3.81Å; M375-L412 HydrophobicContact CE-CB 3.99Å; M375-L412 HydrophobicContact CE-CD1 3.62Å; M375-L412 HydrophobicContact CE-CG 4.44Å; I376-L412 HydrophobicContact CD1-CD1 4.21Å; I376-L412 HydrophobicContact CD1-CD2 3.91Å; I376-L412 HydrophobicContact CG1-CD1 4.07Å; I376-L412 HydrophobicContact CG1-CD2 4.06Å; E408-L412 HydrophobicContact CG-CD1 3.85Å; E408-L412 HydrophobicContact CG-CG 4.29Å; E408-L412 WeakPolarHBondContact O-CB 3.45Å; E408-L412 WeakPolarHBondContact O-CG 3.11Å; E408-L412 PolarHBondContact O-N 2.86Å; H409-L412 PolarHBondContact O-N 2.88Å; L412-R414 VanDerWaalsContact C-N 3.29Å; L412-R414 PolarHBondContact O-N 3.33Å; L412-S415 CarbonylContact O-C 3.57Å; L412-S415 WeakPolarHBondContact O-CA 3.34Å; L412-S415 WeakPolarHBondContact O-CB 3.45Å; L412-S415 PolarHBondContact O-N 2.6Å; L412-L416 WeakPolarHBondContact O-CG 3.43Å; L412-L416 PolarHBondContact O-N 2.9Å; L412-M686 HydrophobicContact CD2-CE 3.9Å; L412-M686 HydrophobicContact CD2-CG 3.77Å; L412-M686 HydrophobicContact CD2-SD 3.83Å; L412-M686 WeakPolarHBondContact O-CE 3.43Å; L412-T693 HydrophobicContact CD2-CG2 3.77Å
413	V	92.5	Very high	89.3	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-58.9	-38.8	178.6	165.5	0	0	0	0	112.1	I286 A379 A385 H409 S415 G417 V418	I286-V413 HydrophobicContact CD1-CB 4.04Å; I286-V413 HydrophobicContact CD1-CG1 4.33Å; I286-V413 HydrophobicContact CD1-CG2 3.6Å; I286-V413 HydrophobicContact CG2-CG2 4.04Å; A379-V413 HydrophobicContact CB-CG2 3.91Å; A385-V413 HydrophobicContact CB-CG1 3.68Å; H409-V413 WeakPolarHBondContact O-CB 3.46Å; H409-V413 WeakPolarHBondContact O-CG2 3.34Å; H409-V413 PolarHBondContact O-N 3.11Å; V413-S415 PolarHBondContact O-N 2.96Å; V413-G417 PolarHBondContact O-N 3.38Å; V413-G417 VanDerWaalsContact O-N 3.12Å; V413-V418 HydrophobicContact CG1-CB 3.63Å; V413-V418 HydrophobicContact CG1-CG1 3.96Å; V413-V418 HydrophobicContact CG1-CG2 3.87Å; V413-V418 PolarHBondContact O-N 3.35Å
414	R	90.9	Very high	90.1	Very high	69 Å²	69	19.2 Å²	19.2	26%	0.26	10%	0.101	S	C	.	.	H	α-helix	trans	-63.1	-33.2	173.5	-171.2	58.2	-169.9	129.6	-2.8	113.2	A410 L412 G417 V418 G453 F454	A410-R414 VanDerWaalsContact O-CB 3.32Å; A410-R414 WeakPolarHBondContact O-CB 3.36Å; A410-R414 PolarHBondContact O-N 2.83Å; L412-R414 VanDerWaalsContact C-N 3.29Å; L412-R414 PolarHBondContact O-N 3.33Å; R414-G417 WeakPolarHBondContact O-CA 3.36Å; R414-G417 PolarHBondContact O-N 3.34Å; R414-V418 PolarHBondContact NH1-O 3.47Å; R414-G453 VanDerWaalsContact CZ-O 3.29Å; R414-G453 VanDerWaalsContact NE-C 3.34Å; R414-G453 PolarHBondContact NE-O 2.97Å; R414-G453 PolarHBondContact NH2-O 3.05Å; R414-F454 HydrophobicContact CB-CD2 4.38Å; R414-F454 HydrophobicContact CB-CE1 4.44Å; R414-F454 HydrophobicContact CB-CE2 3.62Å; R414-F454 HydrophobicContact CB-CZ 3.65Å; R414-F454 HydrophobicContact CG-CD2 4.26Å; R414-F454 HydrophobicContact CG-CE2 3.99Å; R414-F454 HydrophobicContact CG-CZ 4.14Å
415	S	89.3	Confident	90.6	Very high	29 Å²	29	19 Å²	19	20%	0.203	10%	0.098	C	C	.	.	H	α-helix	trans	-83.8	-31.9	-176.8	-61.5	0	0	0	0	113.1	L411 L412 V413 G417 R684 M686 A696	L411-S415 WeakPolarHBondContact O-CB 3.41Å; L411-S415 PolarHBondContact O-N 2.8Å; L411-S415 VanDerWaalsContact O-N 3.17Å; L411-S415 PolarHBondContact O-OG 3.14Å; L412-S415 CarbonylContact O-C 3.57Å; L412-S415 WeakPolarHBondContact O-CA 3.34Å; L412-S415 WeakPolarHBondContact O-CB 3.45Å; L412-S415 PolarHBondContact O-N 2.6Å; V413-S415 PolarHBondContact O-N 2.96Å; S415-G417 PolarHBondContact O-N 2.89Å; S415-R684 WeakPolarHBondContact O-CD 3.35Å; S415-M686 VanDerWaalsContact CB-CE 3.43Å; S415-A696 VanDerWaalsContact CB-CB 3.43Å; S415-A696 WeakPolarHBondContact OG-CB 3.46Å
416	L	88.3	Confident	90.9	Very high	16 Å²	16	18.6 Å²	18.6	8%	0.084	10%	0.097	C	C	.	.	H	α-helix	trans	-64.4	-18.6	163	-64.7	169.3	0	0	0	111.3	A379 A380 L412 R684 M686	A379-L416 HydrophobicContact CB-CD1 3.44Å; A379-L416 VanDerWaalsContact CB-CD1 3.44Å; A380-L416 HydrophobicContact CB-CD2 4.08Å; L412-L416 WeakPolarHBondContact O-CG 3.43Å; L412-L416 PolarHBondContact O-N 2.9Å; L416-R684 WeakPolarHBondContact O-CD 3.43Å; L416-R684 PolarHBondContact O-NE 3.09Å; L416-R684 PolarHBondContact O-NH1 3.16Å; L416-M686 HydrophobicContact CB-CE 4.46Å; L416-M686 HydrophobicContact CD1-CE 4.41Å; L416-M686 HydrophobicContact CD2-CE 3.62Å; L416-M686 HydrophobicContact CG-CE 3.5Å; L416-M686 VanDerWaalsContact CG-CE 3.5Å
417	G	86.3	Confident	91	Very high	18 Å²	18	19.9 Å²	19.9	19%	0.186	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.7	10.5	160.7	0	0	0	0	0	114.9	V413 R414 S415 T419	V413-G417 PolarHBondContact O-N 3.38Å; V413-G417 VanDerWaalsContact O-N 3.12Å; R414-G417 WeakPolarHBondContact O-CA 3.36Å; R414-G417 PolarHBondContact O-N 3.34Å; S415-G417 PolarHBondContact O-N 2.89Å; G417-T419 PolarHBondContact O-N 3.37Å
418	V	90.4	Very high	91.1	Very high	6 Å²	6	16.8 Å²	16.8	4%	0.036	9%	0.09	C	C	.	.			trans	-52.8	136.5	166.9	174	0	0	0	0	109.3	A385 V413 R414 Q420	A385-V418 HydrophobicContact CB-CG1 4.25Å; V413-V418 HydrophobicContact CG1-CB 3.63Å; V413-V418 HydrophobicContact CG1-CG1 3.96Å; V413-V418 HydrophobicContact CG1-CG2 3.87Å; V413-V418 PolarHBondContact O-N 3.35Å; R414-V418 PolarHBondContact NH1-O 3.47Å; V418-Q420 WeakPolarHBondContact CG1-O 3.38Å
419	T	89.2	Confident	91.1	Very high	67 Å²	67	17.6 Å²	17.6	41%	0.411	10%	0.095	S	C	.	.			trans	-110.1	-29.1	-177	50.4	0	0	0	0	113.4	G417 D458	G417-T419 PolarHBondContact O-N 3.37Å; T419-D458 WeakPolarHBondContact O-CB 3.26Å
420	Q	91.7	Very high	91	Very high	28 Å²	28	22.5 Å²	22.5	13%	0.131	12%	0.118	C	C	.	.			trans	-108	131.8	-177.2	-67.1	171.2	115.5	0	0	109.6	V384 A385 V418 D458 F497 K498	V384-Q420 HydrophobicContact CG2-CB 4.28Å; A385-Q420 PolarHBondContact N-O 3.09Å; V418-Q420 WeakPolarHBondContact CG1-O 3.38Å; Q420-D458 WeakPolarHBondContact CA-O 3.26Å; Q420-F497 HydrophobicContact CB-CD1 3.67Å; Q420-F497 HydrophobicContact CB-CE1 3.77Å; Q420-F497 HydrophobicContact CG-CD1 4.14Å; Q420-K498 PolarHBondContact NE2-O 2.89Å
421	L	93.4	Very high	90.9	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	121.1	-174.7	-172.3	70.3	0	0	0	110.5	A385 L387 V423 L449 F454 D458 V459 F460	A385-L421 HydrophobicContact CB-CD1 3.67Å; A385-L421 WeakPolarHBondContact O-CA 3.42Å; L387-L421 HydrophobicContact CB-CD1 4.05Å; L387-L421 HydrophobicContact CB-CD2 4.45Å; L387-L421 HydrophobicContact CB-CG 4.37Å; L387-L421 HydrophobicContact CD2-CD2 4.42Å; L421-V423 HydrophobicContact CD2-CG2 4.29Å; L421-V423 HydrophobicContact CG-CG2 4.41Å; L421-L449 HydrophobicContact CD2-CD1 4.07Å; L421-L449 HydrophobicContact CD2-CD2 3.72Å; L421-F454 HydrophobicContact CB-CD1 4.4Å; L421-F454 HydrophobicContact CB-CE1 4.15Å; L421-F454 HydrophobicContact CD2-CD2 4.5Å; L421-F454 HydrophobicContact CD2-CE1 4.3Å; L421-F454 HydrophobicContact CD2-CE2 4.13Å; L421-F454 HydrophobicContact CD2-CZ 4.03Å; L421-D458 PolarHBondContact N-O 3.45Å; L421-V459 HydrophobicContact CB-CG2 4.34Å; L421-V459 VanDerWaalsContact O-CA 3.32Å; L421-V459 WeakPolarHBondContact O-CA 3.42Å; L421-F460 PolarHBondContact O-N 2.98Å
422	A	93.9	Very high	90.8	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	141.1	161.4	0	0	0	0	0	108.6	A385 V386 L387 L490 F497	A385-A422 PolarHBondContact O-N 3.19Å; V386-A422 CarbonylContact C-O 3.53Å; V386-A422 WeakPolarHBondContact CA-O 3.23Å; V386-A422 HydrophobicContact CG1-CB 4.5Å; V386-A422 HydrophobicContact CG2-CB 4.15Å; L387-A422 PolarHBondContact N-O 3.44Å; A422-L490 HydrophobicContact CB-CD1 4.45Å; A422-F497 HydrophobicContact CB-CE2 4.12Å; A422-F497 HydrophobicContact CB-CZ 3.8Å
423	V	94	Very high	90.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	105.7	171.5	-176.2	0	0	0	0	107.1	L387 V389 L421 I425 L445 L449 V459 F460 F461 V462	L387-V423 HydrophobicContact CB-CG2 4.5Å; L387-V423 HydrophobicContact CD2-CG2 4.42Å; L387-V423 CarbonylContact O-C 3.54Å; L387-V423 VanDerWaalsContact O-CA 3.31Å; L387-V423 WeakPolarHBondContact O-CA 3.43Å; V389-V423 HydrophobicContact CG2-CG1 3.98Å; L421-V423 HydrophobicContact CD2-CG2 4.29Å; L421-V423 HydrophobicContact CG-CG2 4.41Å; V423-I425 HydrophobicContact CG1-CG1 4.22Å; V423-L445 HydrophobicContact CG1-CD1 3.74Å; V423-L449 HydrophobicContact CG2-CD1 4.1Å; V423-V459 HydrophobicContact CG2-CG1 3.97Å; V423-F460 WeakPolarHBondContact CB-O 3.46Å; V423-F460 PolarHBondContact N-O 2.99Å; V423-F461 HydrophobicContact CB-CD1 3.67Å; V423-F461 HydrophobicContact CB-CE1 3.95Å; V423-F461 HydrophobicContact CB-CG 4.41Å; V423-F461 HydrophobicContact CG1-CD1 3.79Å; V423-F461 HydrophobicContact CG1-CE1 3.95Å; V423-F461 HydrophobicContact CG2-CD1 4.13Å; V423-F461 HydrophobicContact CG2-CE1 3.92Å; V423-F461 HydrophobicContact CG2-CZ 4.5Å; V423-V462 PolarHBondContact O-N 3.4Å
424	A	94.3	Very high	90.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	107.6	175.9	0	0	0	0	0	108.4	L296 V386 L387 V388 V389 N426 T464 L490	L296-A424 HydrophobicContact CD2-CB 4Å; V386-A424 HydrophobicContact CG1-CB 4.12Å; L387-A424 PolarHBondContact O-N 3.23Å; V388-A424 WeakPolarHBondContact CA-O 3.19Å; V389-A424 PolarHBondContact N-O 2.99Å; A424-N426 PolarHBondContact O-N 2.86Å; A424-T464 HydrophobicContact CB-CG2 4.44Å; A424-L490 HydrophobicContact CB-CD1 4.45Å
425	I	94	Very high	90.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	98.9	176.3	-63.8	170.7	0	0	0	106.6	V389 A391 V423 M428 F438 I441 F461 V462 T464	V389-I425 CarbonylContact O-C 3.53Å; V389-I425 WeakPolarHBondContact O-CA 3.37Å; A391-I425 HydrophobicContact CB-CG2 3.92Å; V423-I425 HydrophobicContact CG1-CG1 4.22Å; I425-M428 HydrophobicContact CG2-CG 4.18Å; I425-M428 HydrophobicContact CG2-SD 3.75Å; I425-M428 VanDerWaalsContact O-CG 3.3Å; I425-M428 WeakPolarHBondContact O-CG 3.48Å; I425-F438 HydrophobicContact CB-CD2 4.36Å; I425-F438 HydrophobicContact CB-CE2 4.43Å; I425-F438 HydrophobicContact CD1-CD2 3.72Å; I425-F438 HydrophobicContact CD1-CE2 3.65Å; I425-F438 HydrophobicContact CG1-CE2 4.49Å; I425-F438 HydrophobicContact CG2-CD2 4.44Å; I425-I441 HydrophobicContact CD1-CB 4.21Å; I425-I441 HydrophobicContact CD1-CG2 3.54Å; I425-I441 HydrophobicContact CG1-CG2 3.97Å; I425-I441 HydrophobicContact CG2-CD1 4.13Å; I425-I441 HydrophobicContact CG2-CG2 4.45Å; I425-F461 HydrophobicContact CD1-CD1 4.27Å; I425-V462 PolarHBondContact N-O 3.15Å; I425-T464 PolarHBondContact O-N 2.82Å; I425-T464 PolarHBondContact O-OG1 3.22Å
426	N	93.5	Very high	90.6	Very high	5 Å²	5	38.6 Å²	38.6	3%	0.027	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	171.7	-171.3	-162.7	14	0	0	0	111.9	A291 V388 V389 A391 A424 M428 T464 S465 G466	A291-N426 PolarHBondContact O-ND2 3.32Å; V388-N426 HydrophobicContact CG1-CB 3.78Å; V389-N426 PolarHBondContact O-N 2.93Å; A391-N426 WeakPolarHBondContact CB-O 3.33Å; A391-N426 PolarHBondContact N-O 2.97Å; A424-N426 PolarHBondContact O-N 2.86Å; N426-M428 PolarHBondContact O-N 3.1Å; N426-T464 WeakPolarHBondContact CA-O 3.29Å; N426-S465 WeakPolarHBondContact OD1-CA 3.41Å; N426-G466 PolarHBondContact OD1-N 2.61Å
427	K	91.3	Very high	90.7	Very high	34 Å²	34	38.3 Å²	38.3	15%	0.148	19%	0.192	C	C	.	.			trans	54.7	28.4	-175.3	-56	-164.7	-164.8	130.1	0	114.3	D290 D390 E395 D429 Q430	D290-K427 VanDerWaalsContact O-CE 3.27Å; D290-K427 WeakPolarHBondContact O-CE 3.36Å; D290-K427 PolarHBondContact O-NZ 2.99Å; D390-K427 IonicContact OD1-NZ 3.97Å; D390-K427 WeakPolarHBondContact OD2-CD 3.35Å; D390-K427 WeakPolarHBondContact OD2-CE 3.46Å; D390-K427 VanDerWaalsContact OD2-CG 3.31Å; D390-K427 WeakPolarHBondContact OD2-CG 3.23Å; D390-K427 IonicContact OD2-NZ 2.84Å; D390-K427 PolarHBondContact OD2-NZ 3.46Å; E395-K427 IonicContact OE1-NZ 3.81Å; E395-K427 PolarHBondContact OE1-NZ 3.34Å; E395-K427 IonicContact OE2-NZ 3.17Å; E395-K427 PolarHBondContact OE2-NZ 2.68Å; K427-D429 WeakPolarHBondContact CA-OD1 3.43Å; K427-D429 PolarHBondContact O-N 3.38Å; K427-D429 VanDerWaalsContact O-N 3.1Å; K427-Q430 HydrophobicContact CB-CG 4.25Å; K427-Q430 PolarHBondContact O-N 3.36Å
428	M	90.1	Very high	91	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-18.2	177.9	-77.6	-69.6	-50.3	0	0	113.5	A391 I425 N426 V431 N432 W433 F438 P463 T464 W484	A391-M428 HydrophobicContact CB-CG 4.12Å; A391-M428 HydrophobicContact CB-SD 3.61Å; I425-M428 HydrophobicContact CG2-CG 4.18Å; I425-M428 HydrophobicContact CG2-SD 3.75Å; I425-M428 VanDerWaalsContact O-CG 3.3Å; I425-M428 WeakPolarHBondContact O-CG 3.48Å; N426-M428 PolarHBondContact O-N 3.1Å; M428-V431 HydrophobicContact CE-CG2 4.08Å; M428-V431 WeakPolarHBondContact O-CG2 3.36Å; M428-V431 PolarHBondContact O-N 3Å; M428-V431 HydrophobicContact SD-CG2 4.07Å; M428-N432 PolarHBondContact O-N 3.32Å; M428-W433 HydrophobicContact CB-CD2 4.18Å; M428-W433 HydrophobicContact CB-CE3 3.41Å; M428-W433 VanDerWaalsContact CB-CE3 3.41Å; M428-W433 HydrophobicContact CB-CH2 4.01Å; M428-W433 HydrophobicContact CB-CZ3 3.32Å; M428-W433 HydrophobicContact CE-CE3 4.47Å; M428-W433 HydrophobicContact CG-CE3 4.38Å; M428-W433 HydrophobicContact CG-CZ3 4.24Å; M428-W433 PolarHBondContact O-N 3.39Å; M428-F438 HydrophobicContact CE-CB 4.15Å; M428-F438 HydrophobicContact SD-CB 4.46Å; M428-F438 HydrophobicContact SD-CD2 4.45Å; M428-P463 HydrophobicContact CE-CB 4.48Å; M428-P463 HydrophobicContact CG-CB 3.93Å; M428-P463 HydrophobicContact SD-CB 4.45Å; M428-T464 PolarHBondContact N-O 2.96Å; M428-W484 HydrophobicContact CE-CH2 4.41Å; M428-W484 HydrophobicContact CE-CZ2 4.2Å
429	D	88.1	Confident	91.1	Very high	54 Å²	54	43.1 Å²	43.1	29%	0.289	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-44.3	167.6	49.1	-79.5	0	0	0	113.2	K427 V431 N432 W433 S465	K427-D429 WeakPolarHBondContact CA-OD1 3.43Å; K427-D429 PolarHBondContact O-N 3.38Å; K427-D429 VanDerWaalsContact O-N 3.1Å; D429-V431 PolarHBondContact O-N 2.82Å; D429-V431 VanDerWaalsContact O-N 3.17Å; D429-N432 PolarHBondContact O-N 3.47Å; D429-W433 HydrophobicContact CB-CZ2 4.42Å; D429-S465 WeakPolarHBondContact OD1-CB 3.35Å; D429-S465 PolarHBondContact OD1-OG 2.84Å
430	Q	89.3	Confident	91.3	Very high	104 Å²	104	43.4 Å²	43.4	49%	0.486	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-24.9	179.2	-66	-167.6	-6.2	0	0	113.4	S392 K427	S392-Q430 VanDerWaalsContact CB-OE1 3.26Å; S392-Q430 PolarHBondContact OG-OE1 3.48Å; K427-Q430 HydrophobicContact CB-CG 4.25Å; K427-Q430 PolarHBondContact O-N 3.36Å
431	V	88.1	Confident	91.3	Very high	10 Å²	10	42 Å²	42	6%	0.061	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	20.1	177.5	-60.8	0	0	0	0	112.6	A391 M428 D429 W433 Q434 R437	A391-V431 HydrophobicContact CB-CG2 3.9Å; M428-V431 HydrophobicContact CE-CG2 4.08Å; M428-V431 WeakPolarHBondContact O-CG2 3.36Å; M428-V431 PolarHBondContact O-N 3Å; M428-V431 HydrophobicContact SD-CG2 4.07Å; D429-V431 PolarHBondContact O-N 2.82Å; D429-V431 VanDerWaalsContact O-N 3.17Å; V431-W433 PolarHBondContact O-N 3.09Å; V431-Q434 WeakPolarHBondContact O-CB 3.23Å; V431-Q434 WeakPolarHBondContact O-CG 2.8Å; V431-Q434 PolarHBondContact O-N 3.14Å; V431-Q434 VanDerWaalsContact O-N 3.12Å; V431-R437 HydrophobicContact CG1-CG 4.47Å
432	N	87.9	Confident	91.3	Very high	116 Å²	116	43 Å²	43	62%	0.62	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.8	45.8	178.6	-60.6	-24	0	0	0	112.6	M428 D429 Q434	M428-N432 PolarHBondContact O-N 3.32Å; D429-N432 PolarHBondContact O-N 3.47Å; N432-Q434 PolarHBondContact O-N 2.91Å
433	W	86.9	Confident	91.2	Very high	23 Å²	23	46.2 Å²	46.2	9%	0.087	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	29.2	178.1	-55.9	101	0	0	0	115.2	M428 D429 V431 K435 E470 L481 W484	M428-W433 HydrophobicContact CB-CD2 4.18Å; M428-W433 HydrophobicContact CB-CE3 3.41Å; M428-W433 VanDerWaalsContact CB-CE3 3.41Å; M428-W433 HydrophobicContact CB-CH2 4.01Å; M428-W433 HydrophobicContact CB-CZ3 3.32Å; M428-W433 HydrophobicContact CE-CE3 4.47Å; M428-W433 HydrophobicContact CG-CE3 4.38Å; M428-W433 HydrophobicContact CG-CZ3 4.24Å; M428-W433 PolarHBondContact O-N 3.39Å; D429-W433 HydrophobicContact CB-CZ2 4.42Å; V431-W433 PolarHBondContact O-N 3.09Å; W433-K435 PolarHBondContact O-N 3.06Å; W433-K435 VanDerWaalsContact O-N 3.16Å; W433-E470 HydrophobicContact CH2-CB 3.64Å; W433-E470 HydrophobicContact CH2-CG 4.26Å; W433-E470 HydrophobicContact CZ2-CB 4Å; W433-E470 HydrophobicContact CZ2-CG 4.1Å; W433-L481 HydrophobicContact CD2-CB 4.34Å; W433-L481 HydrophobicContact CD2-CD2 4.36Å; W433-L481 HydrophobicContact CE3-CB 4.2Å; W433-L481 HydrophobicContact CE3-CD1 3.88Å; W433-L481 HydrophobicContact CE3-CD2 3.54Å; W433-L481 HydrophobicContact CE3-CG 4.07Å; W433-L481 HydrophobicContact CG-CB 4.48Å; W433-L481 HydrophobicContact CH2-CD2 4.28Å; W433-L481 HydrophobicContact CZ3-CD2 3.49Å; W433-L481 VanDerWaalsContact CZ3-CD2 3.49Å; W433-L481 HydrophobicContact CZ3-CG 4.48Å; W433-W484 WeakPolarHBondContact O-CZ2 3.3Å; W433-W484 PolarHBondContact O-NE1 3.25Å
434	Q	89.3	Confident	91.1	Very high	79 Å²	79	49.5 Å²	49.5	37%	0.369	24%	0.243	S	C	.	.			trans	-62	113.1	-177.2	-80.2	169.4	22.2	0	0	113.5	V431 N432 E436 R437 F438	V431-Q434 WeakPolarHBondContact O-CB 3.23Å; V431-Q434 WeakPolarHBondContact O-CG 2.8Å; V431-Q434 PolarHBondContact O-N 3.14Å; V431-Q434 VanDerWaalsContact O-N 3.12Å; N432-Q434 PolarHBondContact O-N 2.91Å; Q434-E436 VanDerWaalsContact C-N 3.27Å; Q434-E436 PolarHBondContact O-N 3.45Å; Q434-R437 HydrophobicContact CB-CB 4.33Å; Q434-R437 PolarHBondContact O-N 2.83Å; Q434-F438 PolarHBondContact O-N 3.16Å
435	K	89.8	Confident	91	Very high	90 Å²	90	49.6 Å²	49.6	39%	0.391	24%	0.243	S	C	.	.	H	α-helix	trans	-52.3	-41.5	173.9	-173.3	-179.3	-166.6	169	0	113.5	W433 F438 Q439 W484	W433-K435 PolarHBondContact O-N 3.06Å; W433-K435 VanDerWaalsContact O-N 3.16Å; K435-F438 PolarHBondContact O-N 2.73Å; K435-Q439 HydrophobicContact CG-CG 4.45Å; K435-Q439 WeakPolarHBondContact O-CG 3.36Å; K435-Q439 PolarHBondContact O-N 3.31Å; K435-W484 HydrophobicContact CB-CD2 3.72Å; K435-W484 HydrophobicContact CB-CE3 4.21Å; K435-W484 HydrophobicContact CB-CG 3.88Å; K435-W484 HydrophobicContact CB-CZ2 4.34Å; K435-W484 HydrophobicContact CD-CB 3.69Å; K435-W484 HydrophobicContact CD-CD2 4.19Å; K435-W484 HydrophobicContact CD-CE3 4.41Å; K435-W484 HydrophobicContact CD-CG 3.92Å; K435-W484 HydrophobicContact CG-CB 4.25Å; K435-W484 HydrophobicContact CG-CD2 3.72Å; K435-W484 HydrophobicContact CG-CE3 3.79Å; K435-W484 HydrophobicContact CG-CG 3.95Å; K435-W484 HydrophobicContact CG-CZ3 4.41Å
436	E	91.7	Very high	90.9	Very high	160 Å²	160	50.1 Å²	50.1	75%	0.748	25%	0.249	S	C	*	.	H	α-helix	trans	-64.1	-45.4	-175.8	-62.5	-177.1	171.3	0	0	111.6	Q434 Q439 E440	Q434-E436 VanDerWaalsContact C-N 3.27Å; Q434-E436 PolarHBondContact O-N 3.45Å; E436-Q439 PolarHBondContact O-N 2.81Å; E436-E440 WeakPolarHBondContact O-CB 3.37Å; E436-E440 PolarHBondContact O-N 2.85Å
437	R	91.5	Very high	90.8	Very high	11 Å²	11	55.7 Å²	55.7	4%	0.042	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-41.2	175.7	-177.2	55.8	167.5	-177.9	-1.4	111.6	A391 S392 E397 V431 Q434 Q439 E440 I441	A391-R437 PolarHBondContact O-NE 3.29Å; S392-R437 PolarHBondContact O-NH2 2.83Å; E397-R437 IonicContact OE1-CZ 2.91Å; E397-R437 IonicContact OE1-NH1 3.81Å; E397-R437 PolarHBondContact OE1-NH1 2.91Å; E397-R437 IonicContact OE1-NH2 3.84Å; E397-R437 PolarHBondContact OE1-NH2 2.88Å; E397-R437 VanDerWaalsContact OE1-NH2 3.08Å; E397-R437 IonicContact OE2-CZ 2.67Å; E397-R437 IonicContact OE2-NH1 3.84Å; E397-R437 IonicContact OE2-NH2 2.69Å; E397-R437 PolarHBondContact OE2-NH2 2.7Å; V431-R437 HydrophobicContact CG1-CG 4.47Å; Q434-R437 HydrophobicContact CB-CB 4.33Å; Q434-R437 PolarHBondContact O-N 2.83Å; R437-Q439 PolarHBondContact O-N 3.48Å; R437-E440 WeakPolarHBondContact CD-OE2 3.13Å; R437-E440 IonicContact CZ-OE2 3.83Å; R437-E440 IonicContact NE-OE2 2.62Å; R437-E440 IonicContact NH1-OE1 2.96Å; R437-E440 PolarHBondContact NH1-OE1 3.21Å; R437-E440 IonicContact NH1-OE2 3.69Å; R437-E440 PolarHBondContact NH1-OE2 2.79Å; R437-E440 WeakPolarHBondContact O-CB 3.42Å; R437-E440 PolarHBondContact O-N 2.99Å; R437-I441 HydrophobicContact CG-CD1 3.9Å; R437-I441 WeakPolarHBondContact O-CB 3.45Å; R437-I441 VanDerWaalsContact O-CG1 3.28Å; R437-I441 WeakPolarHBondContact O-CG1 3.43Å; R437-I441 PolarHBondContact O-N 3.08Å
438	F	92.3	Very high	90.7	Very high	21 Å²	21	55.5 Å²	55.5	9%	0.092	27%	0.273	C	S	.	.	H	α-helix	trans	-60.6	-42.5	174	176.9	-93.7	0	0	0	112.5	I425 M428 Q434 K435 S442 F461 P463 W484 Y485	I425-F438 HydrophobicContact CB-CD2 4.36Å; I425-F438 HydrophobicContact CB-CE2 4.43Å; I425-F438 HydrophobicContact CD1-CD2 3.72Å; I425-F438 HydrophobicContact CD1-CE2 3.65Å; I425-F438 HydrophobicContact CG1-CE2 4.49Å; I425-F438 HydrophobicContact CG2-CD2 4.44Å; M428-F438 HydrophobicContact CE-CB 4.15Å; M428-F438 HydrophobicContact SD-CB 4.46Å; M428-F438 HydrophobicContact SD-CD2 4.45Å; Q434-F438 PolarHBondContact O-N 3.16Å; K435-F438 PolarHBondContact O-N 2.73Å; F438-S442 VanDerWaalsContact O-CB 3.26Å; F438-S442 WeakPolarHBondContact O-CB 3.33Å; F438-S442 PolarHBondContact O-N 3.37Å; F438-S442 PolarHBondContact O-OG 2.74Å; F438-F461 HydrophobicContact CZ-CB 4.03Å; F438-P463 HydrophobicContact CD2-CB 3.76Å; F438-P463 HydrophobicContact CD2-CG 4.26Å; F438-P463 HydrophobicContact CE2-CB 3.71Å; F438-P463 HydrophobicContact CE2-CG 3.87Å; F438-P463 HydrophobicContact CZ-CG 4.35Å; F438-W484 HydrophobicContact CB-CH2 3.64Å; F438-W484 HydrophobicContact CB-CZ2 4.42Å; F438-W484 HydrophobicContact CB-CZ3 4.22Å; F438-W484 AromaticContact CD1-CH2 3.75Å; F438-W484 HydrophobicContact CD1-CH2 3.75Å; F438-W484 AromaticContact CD1-CZ3 3.52Å; F438-W484 HydrophobicContact CD1-CZ3 3.52Å; F438-W484 HydrophobicContact CD2-CH2 4.11Å; F438-W484 HydrophobicContact CE1-CH2 4.45Å; F438-W484 AromaticContact CE1-CZ3 3.98Å; F438-W484 HydrophobicContact CE1-CZ3 3.98Å; F438-W484 AromaticContact CG-CH2 3.56Å; F438-W484 HydrophobicContact CG-CH2 3.56Å; F438-W484 AromaticContact CG-CZ3 3.86Å; F438-W484 HydrophobicContact CG-CZ3 3.86Å; F438-Y485 HydrophobicContact CZ-CE2 4.35Å
439	Q	92.8	Very high	90.8	Very high	103 Å²	103	55.7 Å²	55.7	48%	0.481	27%	0.274	S	S	.	.	H	α-helix	trans	-69.7	-37	177.4	-72.5	-175.6	-33.4	0	0	112.6	K435 E436 R437 S443	K435-Q439 HydrophobicContact CG-CG 4.45Å; K435-Q439 WeakPolarHBondContact O-CG 3.36Å; K435-Q439 PolarHBondContact O-N 3.31Å; E436-Q439 PolarHBondContact O-N 2.81Å; R437-Q439 PolarHBondContact O-N 3.48Å; Q439-S443 VanDerWaalsContact O-CB 3.31Å; Q439-S443 WeakPolarHBondContact O-CB 3.41Å; Q439-S443 PolarHBondContact O-N 3.02Å; Q439-S443 PolarHBondContact O-OG 3.22Å
440	E	93.3	Very high	90.8	Very high	73 Å²	73	57.5 Å²	57.5	34%	0.341	28%	0.28	S	S	.	.	H	α-helix	trans	-59.4	-53	173.3	-170.4	-151.7	167.3	0	0	111.3	E436 R437 S443 K444	E436-E440 WeakPolarHBondContact O-CB 3.37Å; E436-E440 PolarHBondContact O-N 2.85Å; R437-E440 WeakPolarHBondContact CD-OE2 3.13Å; R437-E440 IonicContact CZ-OE2 3.83Å; R437-E440 IonicContact NE-OE2 2.62Å; R437-E440 IonicContact NH1-OE1 2.96Å; R437-E440 PolarHBondContact NH1-OE1 3.21Å; R437-E440 IonicContact NH1-OE2 3.69Å; R437-E440 PolarHBondContact NH1-OE2 2.79Å; R437-E440 WeakPolarHBondContact O-CB 3.42Å; R437-E440 PolarHBondContact O-N 2.99Å; E440-S443 PolarHBondContact O-N 2.98Å; E440-K444 HydrophobicContact CG-CD 4.34Å; E440-K444 PolarHBondContact O-N 3.34Å; E440-K444 VanDerWaalsContact OE1-CE 3.29Å; E440-K444 WeakPolarHBondContact OE1-CE 3.29Å; E440-K444 IonicContact OE1-NZ 3.47Å; E440-K444 PolarHBondContact OE1-NZ 3.41Å
441	I	92.9	Very high	90.7	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.3	-50.6	178.5	-68.9	168.1	0	0	0	110.4	A391 F396 I425 R437 S443 K444 L445	A391-I441 HydrophobicContact CB-CD1 4.36Å; F396-I441 HydrophobicContact CD1-CG1 3.89Å; F396-I441 HydrophobicContact CD2-CD1 4.48Å; F396-I441 HydrophobicContact CD2-CG1 4.13Å; F396-I441 HydrophobicContact CD2-CG2 4.19Å; F396-I441 HydrophobicContact CE1-CG1 3.81Å; F396-I441 HydrophobicContact CE2-CB 4.31Å; F396-I441 HydrophobicContact CE2-CG1 4.08Å; F396-I441 HydrophobicContact CE2-CG2 3.71Å; F396-I441 HydrophobicContact CG-CD1 4.34Å; F396-I441 HydrophobicContact CG-CG1 4.06Å; F396-I441 HydrophobicContact CZ-CB 4.18Å; F396-I441 HydrophobicContact CZ-CG1 3.91Å; F396-I441 HydrophobicContact CZ-CG2 4.03Å; I425-I441 HydrophobicContact CD1-CB 4.21Å; I425-I441 HydrophobicContact CD1-CG2 3.54Å; I425-I441 HydrophobicContact CG1-CG2 3.97Å; I425-I441 HydrophobicContact CG2-CD1 4.13Å; I425-I441 HydrophobicContact CG2-CG2 4.45Å; R437-I441 HydrophobicContact CG-CD1 3.9Å; R437-I441 WeakPolarHBondContact O-CB 3.45Å; R437-I441 VanDerWaalsContact O-CG1 3.28Å; R437-I441 WeakPolarHBondContact O-CG1 3.43Å; R437-I441 PolarHBondContact O-N 3.08Å; I441-S443 VanDerWaalsContact C-N 3.26Å; I441-S443 PolarHBondContact O-N 2.94Å; I441-K444 PolarHBondContact O-N 2.85Å; I441-L445 HydrophobicContact CG2-CD1 3.62Å; I441-L445 HydrophobicContact CG2-CG 4.2Å; I441-L445 WeakPolarHBondContact O-CB 3.44Å; I441-L445 WeakPolarHBondContact O-CG 3.13Å; I441-L445 PolarHBondContact O-N 3.48Å
442	S	92.4	Very high	90.5	Very high	20 Å²	20	59.8 Å²	59.8	14%	0.14	29%	0.294	C	S	.	.	H	α-helix	trans	-58.2	-38.4	179.6	-59.9	0	0	0	0	112.1	F438 G446	F438-S442 VanDerWaalsContact O-CB 3.26Å; F438-S442 WeakPolarHBondContact O-CB 3.33Å; F438-S442 PolarHBondContact O-N 3.37Å; F438-S442 PolarHBondContact O-OG 2.74Å; S442-G446 PolarHBondContact O-N 3.25Å
443	S	92.8	Very high	90.4	Very high	68 Å²	68	55.8 Å²	55.8	48%	0.476	28%	0.28	S	S	.	.	H	α-helix	trans	-69	-50.3	177.1	-57.8	0	0	0	0	111.9	Q439 E440 I441 L445 G446 H447	Q439-S443 VanDerWaalsContact O-CB 3.31Å; Q439-S443 WeakPolarHBondContact O-CB 3.41Å; Q439-S443 PolarHBondContact O-N 3.02Å; Q439-S443 PolarHBondContact O-OG 3.22Å; E440-S443 PolarHBondContact O-N 2.98Å; I441-S443 VanDerWaalsContact C-N 3.26Å; I441-S443 PolarHBondContact O-N 2.94Å; S443-L445 PolarHBondContact O-N 2.93Å; S443-G446 PolarHBondContact O-N 2.77Å; S443-H447 PolarHBondContact O-CD2 2.59Å; S443-H447 PolarHBondContact O-N 3.38Å
444	K	92	Very high	90.5	Very high	69 Å²	69	55.2 Å²	55.2	30%	0.3	28%	0.278	S	S	.	.	H	α-helix	trans	-56.8	-47	177.1	-79.4	173.7	168.5	177.3	0	111.5	F396 E397 F400 E440 I441 F448	F396-K444 HydrophobicContact CE1-CD 3.59Å; F396-K444 HydrophobicContact CZ-CB 4.11Å; F396-K444 HydrophobicContact CZ-CD 3.96Å; E397-K444 IonicContact OE1-NZ 3.74Å; F400-K444 HydrophobicContact CE1-CB 3.98Å; F400-K444 HydrophobicContact CE1-CG 4.4Å; F400-K444 HydrophobicContact CZ-CB 4.1Å; F400-K444 WeakPolarHBondContact CZ-O 3.5Å; E440-K444 HydrophobicContact CG-CD 4.34Å; E440-K444 PolarHBondContact O-N 3.34Å; E440-K444 VanDerWaalsContact OE1-CE 3.29Å; E440-K444 WeakPolarHBondContact OE1-CE 3.29Å; E440-K444 IonicContact OE1-NZ 3.47Å; E440-K444 PolarHBondContact OE1-NZ 3.41Å; I441-K444 PolarHBondContact O-N 2.85Å; K444-F448 PolarHBondContact O-N 3.39Å
445	L	91.4	Very high	90.4	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-67.4	-42.9	176.9	-68	176.9	0	0	0	112.2	V389 F396 F400 V423 I441 S443 H447 F448 L449 F461	V389-L445 HydrophobicContact CB-CD1 4.39Å; V389-L445 HydrophobicContact CG1-CD1 4.21Å; V389-L445 HydrophobicContact CG2-CD1 3.99Å; F396-L445 HydrophobicContact CE2-CD2 4.27Å; F396-L445 HydrophobicContact CE2-CG 4.26Å; F400-L445 HydrophobicContact CD2-CD2 4.01Å; F400-L445 HydrophobicContact CE2-CD2 4.06Å; V423-L445 HydrophobicContact CG1-CD1 3.74Å; I441-L445 HydrophobicContact CG2-CD1 3.62Å; I441-L445 HydrophobicContact CG2-CG 4.2Å; I441-L445 WeakPolarHBondContact O-CB 3.44Å; I441-L445 WeakPolarHBondContact O-CG 3.13Å; I441-L445 PolarHBondContact O-N 3.48Å; S443-L445 PolarHBondContact O-N 2.93Å; L445-H447 VanDerWaalsContact C-N 3.32Å; L445-H447 PolarHBondContact O-N 2.81Å; L445-F448 PolarHBondContact O-N 3.22Å; L445-L449 WeakPolarHBondContact O-CB 3.49Å; L445-L449 WeakPolarHBondContact O-CG 3.23Å; L445-L449 PolarHBondContact O-N 3.41Å; L445-F461 HydrophobicContact CB-CE1 3.93Å; L445-F461 HydrophobicContact CB-CZ 4.4Å; L445-F461 HydrophobicContact CD1-CE1 4.24Å
446	G	90.9	Very high	90.1	Very high	11 Å²	11	59 Å²	59	11%	0.113	30%	0.295	C	S	.	.	H	α-helix	trans	-59	-39.3	177.9	0	0	0	0	0	113.2	S442 S443 K450	S442-G446 PolarHBondContact O-N 3.25Å; S443-G446 PolarHBondContact O-N 2.77Å; G446-K450 WeakPolarHBondContact O-CB 3.35Å; G446-K450 VanDerWaalsContact O-CE 3.31Å; G446-K450 WeakPolarHBondContact O-CE 3.41Å; G446-K450 PolarHBondContact O-N 3.49Å
447	H	91.4	Very high	89.8	Confident	122 Å²	122	55.1 Å²	55.1	57%	0.565	29%	0.285	S	S	*	.	H	α-helix	trans	-63.9	-43.6	171.5	-73.4	-64.8	0	0	0	112.5	S443 L445 Q451	S443-H447 PolarHBondContact O-CD2 2.59Å; S443-H447 PolarHBondContact O-N 3.38Å; L445-H447 VanDerWaalsContact C-N 3.32Å; L445-H447 PolarHBondContact O-N 2.81Å; H447-Q451 WeakPolarHBondContact O-CG 3.35Å; H447-Q451 PolarHBondContact O-N 3.15Å
448	F	90.3	Very high	89.6	Confident	29 Å²	29	56.2 Å²	56.2	13%	0.127	29%	0.292	C	S	.	.	H	α-helix	trans	-68.6	-44.7	179.8	174.4	-102.8	0	0	0	113	F400 R407 A410 K444 L445 K450 Q451 A452	F400-F448 HydrophobicContact CE2-CB 3.7Å; F400-F448 HydrophobicContact CE2-CD1 4.42Å; F400-F448 AromaticContact CE2-CG 3.97Å; F400-F448 HydrophobicContact CE2-CG 3.97Å; F400-F448 HydrophobicContact CZ-CB 3.99Å; R407-F448 HydrophobicContact CB-CE1 4.05Å; R407-F448 HydrophobicContact CB-CE2 4.03Å; R407-F448 HydrophobicContact CB-CZ 3.54Å; R407-F448 HydrophobicContact CG-CD1 4.32Å; R407-F448 HydrophobicContact CG-CD2 4.22Å; R407-F448 HydrophobicContact CG-CE1 3.88Å; R407-F448 HydrophobicContact CG-CE2 3.77Å; R407-F448 HydrophobicContact CG-CG 4.48Å; R407-F448 HydrophobicContact CG-CZ 3.6Å; A410-F448 HydrophobicContact CB-CE1 4.08Å; K444-F448 PolarHBondContact O-N 3.39Å; L445-F448 PolarHBondContact O-N 3.22Å; F448-K450 VanDerWaalsContact C-N 3.29Å; F448-K450 PolarHBondContact O-N 2.78Å; F448-Q451 WeakPolarHBondContact O-CA 3.47Å; F448-Q451 WeakPolarHBondContact O-CB 3.43Å; F448-Q451 PolarHBondContact O-N 3.2Å; F448-A452 PolarHBondContact O-N 3.32Å
449	L	91.1	Very high	89.6	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-64.7	-33.1	179.2	-66.8	171.6	0	0	0	111.8	A410 L421 V423 L445 G453 F454 V459 F461	A410-L449 HydrophobicContact CB-CD2 4.11Å; L421-L449 HydrophobicContact CD2-CD1 4.07Å; L421-L449 HydrophobicContact CD2-CD2 3.72Å; V423-L449 HydrophobicContact CG2-CD1 4.1Å; L445-L449 WeakPolarHBondContact O-CB 3.49Å; L445-L449 WeakPolarHBondContact O-CG 3.23Å; L445-L449 PolarHBondContact O-N 3.41Å; L449-G453 PolarHBondContact O-N 3Å; L449-F454 HydrophobicContact CB-CB 4.41Å; L449-F454 HydrophobicContact CB-CD2 4.19Å; L449-F454 HydrophobicContact CD2-CD2 3.7Å; L449-F454 HydrophobicContact CD2-CE2 3.84Å; L449-F454 PolarHBondContact O-N 2.82Å; L449-V459 HydrophobicContact CD1-CG1 3.74Å; L449-V459 HydrophobicContact CD1-CG2 4.42Å; L449-F461 HydrophobicContact CD1-CZ 4.38Å
450	K	89.7	Confident	89.5	Confident	92 Å²	92	54.2 Å²	54.2	40%	0.4	28%	0.283	S	S	.	.	H	α-helix	trans	-62	-39.7	167	-87.2	-175.2	-87.2	-154.8	0	113.3	G446 F448 G453 E456	G446-K450 WeakPolarHBondContact O-CB 3.35Å; G446-K450 VanDerWaalsContact O-CE 3.31Å; G446-K450 WeakPolarHBondContact O-CE 3.41Å; G446-K450 PolarHBondContact O-N 3.49Å; F448-K450 VanDerWaalsContact C-N 3.29Å; F448-K450 PolarHBondContact O-N 2.78Å; K450-G453 PolarHBondContact O-N 3.34Å; K450-E456 HydrophobicContact CD-CG 3.9Å; K450-E456 VanDerWaalsContact CD-OE2 3.29Å; K450-E456 WeakPolarHBondContact CD-OE2 3.32Å; K450-E456 WeakPolarHBondContact CE-OE1 3.23Å; K450-E456 WeakPolarHBondContact CE-OE2 3.39Å; K450-E456 HydrophobicContact CG-CG 3.89Å; K450-E456 IonicContact NZ-OE1 2.8Å; K450-E456 PolarHBondContact NZ-OE1 3.11Å; K450-E456 IonicContact NZ-OE2 3.96Å; K450-E456 PolarHBondContact NZ-OE2 3.31Å
451	Q	86.6	Confident	89.5	Confident	141 Å²	141	53.4 Å²	53.4	66%	0.659	28%	0.278	S	S	*	.	H	α-helix	trans	-70.3	-38.7	177.4	-68.7	174.6	14.5	0	0	112.6	H447 F448 G453	H447-Q451 WeakPolarHBondContact O-CG 3.35Å; H447-Q451 PolarHBondContact O-N 3.15Å; F448-Q451 WeakPolarHBondContact O-CA 3.47Å; F448-Q451 WeakPolarHBondContact O-CB 3.43Å; F448-Q451 PolarHBondContact O-N 3.2Å; Q451-G453 VanDerWaalsContact C-N 3.26Å; Q451-G453 PolarHBondContact O-N 3.32Å
452	A	84.8	Confident	89.4	Confident	22 Å²	22	53.4 Å²	53.4	18%	0.182	28%	0.278	C	S	.	.	H	α-helix	trans	-63.7	-32.7	171	0	0	0	0	0	111.9	L411 F448 F454	L411-A452 HydrophobicContact CD1-CB 4.29Å; F448-A452 PolarHBondContact O-N 3.32Å; A452-F454 HydrophobicContact CB-CD2 4.35Å
453	G	84.8	Confident	89.4	Confident	32 Å²	32	52.4 Å²	52.4	33%	0.33	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.8	27.1	171.7	0	0	0	0	0	114.7	R414 L449 K450 Q451	R414-G453 VanDerWaalsContact CZ-O 3.29Å; R414-G453 VanDerWaalsContact NE-C 3.34Å; R414-G453 PolarHBondContact NE-O 2.97Å; R414-G453 PolarHBondContact NH2-O 3.05Å; L449-G453 PolarHBondContact O-N 3Å; K450-G453 PolarHBondContact O-N 3.34Å; Q451-G453 VanDerWaalsContact C-N 3.26Å; Q451-G453 PolarHBondContact O-N 3.32Å
454	F	88.3	Confident	89.3	Confident	11 Å²	11	49.2 Å²	49.2	5%	0.048	25%	0.249	C	C	.	.			trans	-72.8	161.2	160.3	-68.4	-83.5	0	0	0	110.4	R414 L421 L449 A452 V459	R414-F454 HydrophobicContact CB-CD2 4.38Å; R414-F454 HydrophobicContact CB-CE1 4.44Å; R414-F454 HydrophobicContact CB-CE2 3.62Å; R414-F454 HydrophobicContact CB-CZ 3.65Å; R414-F454 HydrophobicContact CG-CD2 4.26Å; R414-F454 HydrophobicContact CG-CE2 3.99Å; R414-F454 HydrophobicContact CG-CZ 4.14Å; L421-F454 HydrophobicContact CB-CD1 4.4Å; L421-F454 HydrophobicContact CB-CE1 4.15Å; L421-F454 HydrophobicContact CD2-CD2 4.5Å; L421-F454 HydrophobicContact CD2-CE1 4.3Å; L421-F454 HydrophobicContact CD2-CE2 4.13Å; L421-F454 HydrophobicContact CD2-CZ 4.03Å; L449-F454 HydrophobicContact CB-CB 4.41Å; L449-F454 HydrophobicContact CB-CD2 4.19Å; L449-F454 HydrophobicContact CD2-CD2 3.7Å; L449-F454 HydrophobicContact CD2-CE2 3.84Å; L449-F454 PolarHBondContact O-N 2.82Å; A452-F454 HydrophobicContact CB-CD2 4.35Å; F454-V459 HydrophobicContact CB-CG2 3.76Å; F454-V459 HydrophobicContact CD1-CG2 4.49Å; F454-V459 HydrophobicContact CG-CG2 4.25Å
455	K	87.5	Confident	89.3	Confident	127 Å²	127	46 Å²	46	55%	0.552	24%	0.235	S	C	*	.			trans	-95.5	141.6	167.9	-51.9	-163.5	-142.9	102	0	109.5	S457 D458 V459	K455-S457 PolarHBondContact O-N 3.18Å; K455-D458 HydrophobicContact CB-CB 4.29Å; K455-D458 IonicContact NZ-OD1 2.65Å; K455-D458 IonicContact NZ-OD2 4Å; K455-D458 PolarHBondContact NZ-OD2 3.41Å; K455-D458 PolarHBondContact O-N 3.2Å; K455-V459 WeakPolarHBondContact O-CG2 3.2Å; K455-V459 PolarHBondContact O-N 3Å
456	E	84.4	Confident	89	Confident	122 Å²	122	45.9 Å²	45.9	57%	0.57	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-63.5	-23.3	176	-59.6	-174.7	98.2	0	0	113.3	K450 D458	K450-E456 HydrophobicContact CD-CG 3.9Å; K450-E456 VanDerWaalsContact CD-OE2 3.29Å; K450-E456 WeakPolarHBondContact CD-OE2 3.32Å; K450-E456 WeakPolarHBondContact CE-OE1 3.23Å; K450-E456 WeakPolarHBondContact CE-OE2 3.39Å; K450-E456 HydrophobicContact CG-CG 3.89Å; K450-E456 IonicContact NZ-OE1 2.8Å; K450-E456 PolarHBondContact NZ-OE1 3.11Å; K450-E456 IonicContact NZ-OE2 3.96Å; K450-E456 PolarHBondContact NZ-OE2 3.31Å; E456-D458 VanDerWaalsContact C-N 3.27Å; E456-D458 PolarHBondContact O-N 2.89Å
457	S	85.6	Confident	88.8	Confident	78 Å²	78	50.6 Å²	50.6	55%	0.545	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-72.5	-17.9	173.1	57.3	0	0	0	0	114.5	K455	K455-S457 PolarHBondContact O-N 3.18Å
458	D	87.4	Confident	88.5	Confident	34 Å²	34	48 Å²	48	18%	0.182	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-113	6.6	-171.6	-50.3	-2.5	0	0	0	110.4	T419 Q420 L421 K455 E456	T419-D458 WeakPolarHBondContact O-CB 3.26Å; Q420-D458 WeakPolarHBondContact CA-O 3.26Å; L421-D458 PolarHBondContact N-O 3.45Å; K455-D458 HydrophobicContact CB-CB 4.29Å; K455-D458 IonicContact NZ-OD1 2.65Å; K455-D458 IonicContact NZ-OD2 4Å; K455-D458 PolarHBondContact NZ-OD2 3.41Å; K455-D458 PolarHBondContact O-N 3.2Å; E456-D458 VanDerWaalsContact C-N 3.27Å; E456-D458 PolarHBondContact O-N 2.89Å
459	V	90.4	Very high	88.1	Confident	14 Å²	14	47.2 Å²	47.2	9%	0.085	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128.3	179.2	175.1	0	0	0	0	108.9	L421 V423 L449 F454 K455 F461	L421-V459 HydrophobicContact CB-CG2 4.34Å; L421-V459 VanDerWaalsContact O-CA 3.32Å; L421-V459 WeakPolarHBondContact O-CA 3.42Å; V423-V459 HydrophobicContact CG2-CG1 3.97Å; L449-V459 HydrophobicContact CD1-CG1 3.74Å; L449-V459 HydrophobicContact CD1-CG2 4.42Å; F454-V459 HydrophobicContact CB-CG2 3.76Å; F454-V459 HydrophobicContact CD1-CG2 4.49Å; F454-V459 HydrophobicContact CG-CG2 4.25Å; K455-V459 WeakPolarHBondContact O-CG2 3.2Å; K455-V459 PolarHBondContact O-N 3Å; V459-F461 HydrophobicContact CG1-CD2 4.44Å; V459-F461 HydrophobicContact CG1-CE2 3.77Å; V459-F461 HydrophobicContact CG1-CZ 3.85Å
460	F	91	Very high	87.9	Confident	68 Å²	68	48.8 Å²	48.8	30%	0.298	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	143.2	-178.6	-57.4	-84.1	0	0	0	110.8	L421 V423 Q493 F497	L421-F460 PolarHBondContact O-N 2.98Å; V423-F460 WeakPolarHBondContact CB-O 3.46Å; V423-F460 PolarHBondContact N-O 2.99Å; F460-Q493 VanDerWaalsContact CG-OE1 3.29Å; F460-F497 AromaticContact CD2-CE1 3.71Å; F460-F497 HydrophobicContact CD2-CE1 3.71Å; F460-F497 HydrophobicContact CD2-CZ 4.22Å; F460-F497 HydrophobicContact CE2-CD1 4.37Å; F460-F497 AromaticContact CE2-CE1 3.81Å; F460-F497 HydrophobicContact CE2-CE1 3.81Å
461	F	92.8	Very high	87.7	Confident	55 Å²	55	44.6 Å²	44.6	24%	0.241	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	122.7	-179.7	-63.9	-89.4	0	0	0	110.5	V423 I425 F438 L445 L449 V459 Y485	V423-F461 HydrophobicContact CB-CD1 3.67Å; V423-F461 HydrophobicContact CB-CE1 3.95Å; V423-F461 HydrophobicContact CB-CG 4.41Å; V423-F461 HydrophobicContact CG1-CD1 3.79Å; V423-F461 HydrophobicContact CG1-CE1 3.95Å; V423-F461 HydrophobicContact CG2-CD1 4.13Å; V423-F461 HydrophobicContact CG2-CE1 3.92Å; V423-F461 HydrophobicContact CG2-CZ 4.5Å; I425-F461 HydrophobicContact CD1-CD1 4.27Å; F438-F461 HydrophobicContact CZ-CB 4.03Å; L445-F461 HydrophobicContact CB-CE1 3.93Å; L445-F461 HydrophobicContact CB-CZ 4.4Å; L445-F461 HydrophobicContact CD1-CE1 4.24Å; L449-F461 HydrophobicContact CD1-CZ 4.38Å; V459-F461 HydrophobicContact CG1-CD2 4.44Å; V459-F461 HydrophobicContact CG1-CE2 3.77Å; V459-F461 HydrophobicContact CG1-CZ 3.85Å; F461-Y485 PolarHBondContact O-OH 3.26Å
462	V	91.7	Very high	87.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	122.5	-178.9	-171.3	0	0	0	0	109.1	V423 I425 T464 N471 Q493	V423-V462 PolarHBondContact O-N 3.4Å; I425-V462 PolarHBondContact N-O 3.15Å; V462-T464 HydrophobicContact CB-CG2 4.34Å; V462-T464 HydrophobicContact CG1-CG2 3.77Å; V462-N471 HydrophobicContact CG1-CB 4.4Å; V462-Q493 HydrophobicContact CG2-CG 3.9Å
463	P	92.2	Very high	87.4	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	125.2	168.4	29	-26	0	0	0	108.9	M428 F438 N471 L481 W484 Y485	M428-P463 HydrophobicContact CE-CB 4.48Å; M428-P463 HydrophobicContact CG-CB 3.93Å; M428-P463 HydrophobicContact SD-CB 4.45Å; F438-P463 HydrophobicContact CD2-CB 3.76Å; F438-P463 HydrophobicContact CD2-CG 4.26Å; F438-P463 HydrophobicContact CE2-CB 3.71Å; F438-P463 HydrophobicContact CE2-CG 3.87Å; F438-P463 HydrophobicContact CZ-CG 4.35Å; P463-N471 VanDerWaalsContact O-CB 3.26Å; P463-N471 WeakPolarHBondContact O-CB 3.41Å; P463-N471 PolarHBondContact O-ND2 2.56Å; P463-L481 HydrophobicContact CB-CD1 4.36Å; P463-L481 HydrophobicContact CG-CD1 4Å; P463-W484 HydrophobicContact CB-CH2 4.37Å; P463-W484 HydrophobicContact CG-CH2 4.2Å; P463-Y485 HydrophobicContact CG-CD1 3.99Å; P463-Y485 HydrophobicContact CG-CD2 3.64Å; P463-Y485 HydrophobicContact CG-CE1 4.12Å; P463-Y485 HydrophobicContact CG-CE2 3.8Å; P463-Y485 HydrophobicContact CG-CG 3.74Å
464	T	90.9	Very high	87.1	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.225	C	C	.	.			trans	-133.5	164.9	-176.5	58.2	0	0	0	0	111.4	A424 I425 N426 M428 V462 N471 L490	A424-T464 HydrophobicContact CB-CG2 4.44Å; I425-T464 PolarHBondContact O-N 2.82Å; I425-T464 PolarHBondContact O-OG1 3.22Å; N426-T464 WeakPolarHBondContact CA-O 3.29Å; M428-T464 PolarHBondContact N-O 2.96Å; V462-T464 HydrophobicContact CB-CG2 4.34Å; V462-T464 HydrophobicContact CG1-CG2 3.77Å; T464-N471 HydrophobicContact CG2-CB 4.36Å; T464-L490 HydrophobicContact CG2-CB 4.43Å
465	S	91.2	Very high	86.5	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.007	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-140.3	107.4	164.8	171.7	0	0	0	0	109.4	N426 D429 L467 S468 G469 E470	N426-S465 WeakPolarHBondContact OD1-CA 3.41Å; D429-S465 WeakPolarHBondContact OD1-CB 3.35Å; D429-S465 PolarHBondContact OD1-OG 2.84Å; S465-L467 VanDerWaalsContact C-N 3.25Å; S465-L467 PolarHBondContact O-N 3.03Å; S465-S468 WeakPolarHBondContact CB-OG 3.39Å; S465-S468 PolarHBondContact O-N 2.87Å; S465-S468 PolarHBondContact OG-OG 3.33Å; S465-G469 WeakPolarHBondContact O-CA 3.47Å; S465-G469 PolarHBondContact O-N 3.19Å; S465-E470 PolarHBondContact N-O 3.24Å; S465-E470 PolarHBondContact O-N 2.96Å
466	G	86.1	Confident	85.6	Confident	1 Å²	1	41 Å²	41	1%	0.01	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-20.9	-176.2	0	0	0	0	0	114.6	H299 N426	H299-G466 PolarHBondContact ND1-O 3.22Å; N426-G466 PolarHBondContact OD1-N 2.61Å
467	L	86.1	Confident	84.6	Confident	110 Å²	110	41.3 Å²	41.3	58%	0.576	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-41.3	176.8	-172.1	61.1	0	0	0	112.1	Y329 S465	Y329-L467 HydrophobicContact CE2-CD1 4.45Å; S465-L467 VanDerWaalsContact C-N 3.25Å; S465-L467 PolarHBondContact O-N 3.03Å
468	S	85	Confident	83.6	Confident	66 Å²	66	39.4 Å²	39.4	46%	0.462	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-22.9	178.9	62.6	0	0	0	0	113.9	S465 E470	S465-S468 WeakPolarHBondContact CB-OG 3.39Å; S465-S468 PolarHBondContact O-N 2.87Å; S465-S468 PolarHBondContact OG-OG 3.33Å; S468-E470 WeakPolarHBondContact OG-CG 3.44Å
469	G	83.4	Confident	82.4	Confident	14 Å²	14	42.4 Å²	42.4	14%	0.144	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.2	1.1	-179.2	0	0	0	0	0	114.5	H299 S465 L472	H299-G469 WeakPolarHBondContact CE1-CA 3.49Å; H299-G469 PolarHBondContact CE1-N 3.43Å; S465-G469 WeakPolarHBondContact O-CA 3.47Å; S465-G469 PolarHBondContact O-N 3.19Å; G469-L472 WeakPolarHBondContact O-CB 3.49Å; G469-L472 PolarHBondContact O-N 3.22Å
470	E	86.1	Confident	81.2	Confident	37 Å²	37	47.3 Å²	47.3	17%	0.173	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-64.8	136.1	-175.2	-72.4	-66.7	164.7	0	0	112.9	W433 S465 S468 L472 S476 V478	W433-E470 HydrophobicContact CH2-CB 3.64Å; W433-E470 HydrophobicContact CH2-CG 4.26Å; W433-E470 HydrophobicContact CZ2-CB 4Å; W433-E470 HydrophobicContact CZ2-CG 4.1Å; S465-E470 PolarHBondContact N-O 3.24Å; S465-E470 PolarHBondContact O-N 2.96Å; S468-E470 WeakPolarHBondContact OG-CG 3.44Å; E470-L472 PolarHBondContact O-N 3.05Å; E470-S476 WeakPolarHBondContact OE2-CA 3.32Å; E470-S476 WeakPolarHBondContact OE2-CB 3.4Å; E470-S476 PolarHBondContact OE2-OG 3.32Å; E470-V478 HydrophobicContact CG-CG2 4.25Å; E470-V478 WeakPolarHBondContact OE1-CG2 3.46Å
471	N	84.3	Confident	80.3	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.021	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	16.6	-173.8	-85.1	-20.1	0	0	0	116.5	V462 P463 T464 A474 S476 L481 S489 L490	V462-N471 HydrophobicContact CG1-CB 4.4Å; P463-N471 VanDerWaalsContact O-CB 3.26Å; P463-N471 WeakPolarHBondContact O-CB 3.41Å; P463-N471 PolarHBondContact O-ND2 2.56Å; T464-N471 HydrophobicContact CG2-CB 4.36Å; N471-A474 WeakPolarHBondContact CA-O 3.43Å; N471-S476 VanDerWaalsContact CG-OG 3.3Å; N471-S476 PolarHBondContact N-OG 3.28Å; N471-S476 PolarHBondContact OD1-N 2.95Å; N471-S476 PolarHBondContact OD1-OG 3.47Å; N471-L481 WeakPolarHBondContact ND2-CD2 3.38Å; N471-S489 WeakPolarHBondContact O-CA 3.43Å; N471-S489 WeakPolarHBondContact O-CB 3.2Å; N471-L490 PolarHBondContact O-N 3.18Å
472	L	84.3	Confident	79.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.26	C	S	.	.	S	Bend	trans	-73.5	-74.7	175.5	-73.8	-176.5	0	0	0	112.8	L296 H299 L300 L303 G469 E470 L490 L491	L296-L472 HydrophobicContact CD1-CD2 3.61Å; L296-L472 HydrophobicContact CG-CD2 4.05Å; H299-L472 HydrophobicContact CB-CD1 3.98Å; L300-L472 HydrophobicContact CD1-CB 4.18Å; L303-L472 HydrophobicContact CD1-CB 3.86Å; L303-L472 HydrophobicContact CD1-CD1 3.8Å; L303-L472 HydrophobicContact CD1-CG 4.45Å; G469-L472 WeakPolarHBondContact O-CB 3.49Å; G469-L472 PolarHBondContact O-N 3.22Å; E470-L472 PolarHBondContact O-N 3.05Å; L472-L490 HydrophobicContact CD2-CD2 3.91Å; L472-L490 PolarHBondContact O-N 2.68Å; L472-L491 WeakPolarHBondContact O-CB 3.4Å; L472-L491 PolarHBondContact O-N 2.77Å
473	T	82.2	Confident	78.3	Confident	40 Å²	40	49.2 Å²	49.2	25%	0.245	29%	0.291	C	S	.	.	S	Bend	trans	-96.2	-63.9	-178	54.4	0	0	0	0	110.5	L300 L303 L304 S489 L491	L300-T473 HydrophobicContact CD1-CG2 3.72Å; L303-T473 HydrophobicContact CB-CG2 3.63Å; L303-T473 HydrophobicContact CD1-CG2 4.32Å; L304-T473 HydrophobicContact CD2-CG2 4.31Å; L304-T473 HydrophobicContact CG-CG2 4.31Å; T473-S489 WeakPolarHBondContact O-CB 3.34Å; T473-S489 PolarHBondContact O-OG 2.67Å; T473-L491 HydrophobicContact CG2-CD2 4.18Å
474	A	78.1	Confident	77.8	Confident	67 Å²	67	51.3 Å²	51.3	55%	0.554	30%	0.299	S	S	*	.	S	Bend	trans	-75.4	161.4	169.1	0	0	0	0	0	111.6	N471 S489	N471-A474 WeakPolarHBondContact CA-O 3.43Å; A474-S489 WeakPolarHBondContact O-CB 3.39Å
475	R	76.6	Confident	77.4	Confident	138 Å²	138	52.7 Å²	52.7	52%	0.521	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-75.1	143.5	164.9	-59	178.3	-173.4	-162.1	-6.8	108.9	E492	R475-E492 IonicContact CZ-OE1 2.85Å; R475-E492 IonicContact CZ-OE2 3.87Å; R475-E492 IonicContact NE-OE1 3.08Å; R475-E492 PolarHBondContact NE-OE1 3.19Å; R475-E492 IonicContact NE-OE2 3.41Å; R475-E492 PolarHBondContact NE-OE2 2.93Å; R475-E492 IonicContact NH2-OE1 2.67Å; R475-E492 PolarHBondContact NH2-OE1 3.14Å; R475-E492 IonicContact NH2-OE2 3.55Å; R475-E492 PolarHBondContact NH2-OE2 3.44Å
476	S	67.7	Low	76.6	Confident	11 Å²	11	58.1 Å²	58.1	8%	0.077	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-54.2	139.4	-175.2	-79.6	0	0	0	0	114.8	E470 N471 L481 T482	E470-S476 WeakPolarHBondContact OE2-CA 3.32Å; E470-S476 WeakPolarHBondContact OE2-CB 3.4Å; E470-S476 PolarHBondContact OE2-OG 3.32Å; N471-S476 VanDerWaalsContact CG-OG 3.3Å; N471-S476 PolarHBondContact N-OG 3.28Å; N471-S476 PolarHBondContact OD1-N 2.95Å; N471-S476 PolarHBondContact OD1-OG 3.47Å; S476-L481 WeakPolarHBondContact OG-CD2 3.25Å; S476-T482 WeakPolarHBondContact O-CG2 3.22Å
477	T	62.7	Low	76.3	Confident	130 Å²	130	58.9 Å²	58.9	80%	0.798	35%	0.35	S	S	*	.			trans	-90.8	-8.5	173	41.2	0	0	0	0	113.3	S479	T477-S479 PolarHBondContact O-N 3.42Å
478	V	65.5	Low	76.2	Confident	38 Å²	38	55.2 Å²	55.2	23%	0.23	33%	0.333	C	S	.	.			trans	-67.4	120.5	179.7	179.4	0	0	0	0	110.9	E470 E480 L481 T482	E470-V478 HydrophobicContact CG-CG2 4.25Å; E470-V478 WeakPolarHBondContact OE1-CG2 3.46Å; V478-E480 VanDerWaalsContact C-N 3.28Å; V478-E480 HydrophobicContact CG1-CB 4.06Å; V478-E480 PolarHBondContact O-N 2.98Å; V478-L481 HydrophobicContact CB-CB 4.44Å; V478-L481 PolarHBondContact O-N 2.84Å; V478-T482 WeakPolarHBondContact O-CG2 3.28Å; V478-T482 PolarHBondContact O-N 3.1Å; V478-T482 PolarHBondContact O-OG1 3.33Å
479	S	61.9	Low	76.4	Confident	96 Å²	96	52 Å²	52	67%	0.671	31%	0.311	S	S	*	.	H	α-helix	trans	-56	-39.8	179.2	-170.8	0	0	0	0	112.8	T477 T482 S483	T477-S479 PolarHBondContact O-N 3.42Å; S479-T482 WeakPolarHBondContact CA-OG1 3.23Å; S479-T482 PolarHBondContact O-OG1 2.94Å; S479-S483 WeakPolarHBondContact O-CB 3.32Å; S479-S483 PolarHBondContact O-N 2.92Å
480	E	66.1	Low	76.7	Confident	118 Å²	118	51.4 Å²	51.4	55%	0.551	30%	0.304	S	S	*	.	H	α-helix	trans	-64.1	-44.4	-179.2	-59.1	-178.6	160.8	0	0	112.3	V478 S483 W484	V478-E480 VanDerWaalsContact C-N 3.28Å; V478-E480 HydrophobicContact CG1-CB 4.06Å; V478-E480 PolarHBondContact O-N 2.98Å; E480-S483 PolarHBondContact O-OG 2.81Å; E480-W484 VanDerWaalsContact O-CD1 3.23Å
481	L	70.5	Confident	76.9	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-73.4	-45.7	178.6	-175.2	56.9	0	0	0	111.8	W433 P463 N471 S476 V478 S483 W484 Y485	W433-L481 HydrophobicContact CD2-CB 4.34Å; W433-L481 HydrophobicContact CD2-CD2 4.36Å; W433-L481 HydrophobicContact CE3-CB 4.2Å; W433-L481 HydrophobicContact CE3-CD1 3.88Å; W433-L481 HydrophobicContact CE3-CD2 3.54Å; W433-L481 HydrophobicContact CE3-CG 4.07Å; W433-L481 HydrophobicContact CG-CB 4.48Å; W433-L481 HydrophobicContact CH2-CD2 4.28Å; W433-L481 HydrophobicContact CZ3-CD2 3.49Å; W433-L481 VanDerWaalsContact CZ3-CD2 3.49Å; W433-L481 HydrophobicContact CZ3-CG 4.48Å; P463-L481 HydrophobicContact CB-CD1 4.36Å; P463-L481 HydrophobicContact CG-CD1 4Å; N471-L481 WeakPolarHBondContact ND2-CD2 3.38Å; S476-L481 WeakPolarHBondContact OG-CD2 3.25Å; V478-L481 HydrophobicContact CB-CB 4.44Å; V478-L481 PolarHBondContact O-N 2.84Å; L481-S483 PolarHBondContact O-N 3Å; L481-W484 HydrophobicContact CD1-CD2 4.42Å; L481-W484 HydrophobicContact CD1-CH2 3.79Å; L481-W484 HydrophobicContact CD1-CZ2 3.35Å; L481-W484 HydrophobicContact CD1-CZ3 4.48Å; L481-W484 PolarHBondContact O-N 3.4Å; L481-W484 VanDerWaalsContact O-N 3.14Å; L481-Y485 HydrophobicContact CD1-CG 4.44Å; L481-Y485 WeakPolarHBondContact O-CB 3.42Å; L481-Y485 PolarHBondContact O-N 2.86Å
482	T	67.9	Low	77.2	Confident	68 Å²	68	54 Å²	54	42%	0.417	32%	0.317	S	S	.	.	H	α-helix	trans	-62.7	-23.8	179.1	52.4	0	0	0	0	113.2	S476 V478 S479 W484	S476-T482 WeakPolarHBondContact O-CG2 3.22Å; V478-T482 WeakPolarHBondContact O-CG2 3.28Å; V478-T482 PolarHBondContact O-N 3.1Å; V478-T482 PolarHBondContact O-OG1 3.33Å; S479-T482 WeakPolarHBondContact CA-OG1 3.23Å; S479-T482 PolarHBondContact O-OG1 2.94Å; T482-W484 PolarHBondContact O-N 3.2Å
483	S	75.4	Confident	77.5	Confident	93 Å²	93	55 Å²	55	65%	0.65	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.3	174.3	79	0	0	0	0	114.4	S479 E480 L481	S479-S483 WeakPolarHBondContact O-CB 3.32Å; S479-S483 PolarHBondContact O-N 2.92Å; E480-S483 PolarHBondContact O-OG 2.81Å; L481-S483 PolarHBondContact O-N 3Å
484	W	82.1	Confident	77.8	Confident	44 Å²	44	53.2 Å²	53.2	17%	0.167	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.5	-20.3	-177.3	66.7	-99.1	0	0	0	115.6	M428 W433 K435 F438 P463 E480 L481 T482	M428-W484 HydrophobicContact CE-CH2 4.41Å; M428-W484 HydrophobicContact CE-CZ2 4.2Å; W433-W484 WeakPolarHBondContact O-CZ2 3.3Å; W433-W484 PolarHBondContact O-NE1 3.25Å; K435-W484 HydrophobicContact CB-CD2 3.72Å; K435-W484 HydrophobicContact CB-CE3 4.21Å; K435-W484 HydrophobicContact CB-CG 3.88Å; K435-W484 HydrophobicContact CB-CZ2 4.34Å; K435-W484 HydrophobicContact CD-CB 3.69Å; K435-W484 HydrophobicContact CD-CD2 4.19Å; K435-W484 HydrophobicContact CD-CE3 4.41Å; K435-W484 HydrophobicContact CD-CG 3.92Å; K435-W484 HydrophobicContact CG-CB 4.25Å; K435-W484 HydrophobicContact CG-CD2 3.72Å; K435-W484 HydrophobicContact CG-CE3 3.79Å; K435-W484 HydrophobicContact CG-CG 3.95Å; K435-W484 HydrophobicContact CG-CZ3 4.41Å; F438-W484 HydrophobicContact CB-CH2 3.64Å; F438-W484 HydrophobicContact CB-CZ2 4.42Å; F438-W484 HydrophobicContact CB-CZ3 4.22Å; F438-W484 AromaticContact CD1-CH2 3.75Å; F438-W484 HydrophobicContact CD1-CH2 3.75Å; F438-W484 AromaticContact CD1-CZ3 3.52Å; F438-W484 HydrophobicContact CD1-CZ3 3.52Å; F438-W484 HydrophobicContact CD2-CH2 4.11Å; F438-W484 HydrophobicContact CE1-CH2 4.45Å; F438-W484 AromaticContact CE1-CZ3 3.98Å; F438-W484 HydrophobicContact CE1-CZ3 3.98Å; F438-W484 AromaticContact CG-CH2 3.56Å; F438-W484 HydrophobicContact CG-CH2 3.56Å; F438-W484 AromaticContact CG-CZ3 3.86Å; F438-W484 HydrophobicContact CG-CZ3 3.86Å; P463-W484 HydrophobicContact CB-CH2 4.37Å; P463-W484 HydrophobicContact CG-CH2 4.2Å; E480-W484 VanDerWaalsContact O-CD1 3.23Å; L481-W484 HydrophobicContact CD1-CD2 4.42Å; L481-W484 HydrophobicContact CD1-CH2 3.79Å; L481-W484 HydrophobicContact CD1-CZ2 3.35Å; L481-W484 HydrophobicContact CD1-CZ3 4.48Å; L481-W484 PolarHBondContact O-N 3.4Å; L481-W484 VanDerWaalsContact O-N 3.14Å; T482-W484 PolarHBondContact O-N 3.2Å
485	Y	81.8	Confident	78.4	Confident	30 Å²	30	51.6 Å²	51.6	12%	0.118	29%	0.293	C	S	.	.			trans	-106.5	105	175.1	-169.6	-99.8	0	0	0	110.5	F438 F461 P463 L481 G487 P488	F438-Y485 HydrophobicContact CZ-CE2 4.35Å; F461-Y485 PolarHBondContact O-OH 3.26Å; P463-Y485 HydrophobicContact CG-CD1 3.99Å; P463-Y485 HydrophobicContact CG-CD2 3.64Å; P463-Y485 HydrophobicContact CG-CE1 4.12Å; P463-Y485 HydrophobicContact CG-CE2 3.8Å; P463-Y485 HydrophobicContact CG-CG 3.74Å; L481-Y485 HydrophobicContact CD1-CG 4.44Å; L481-Y485 WeakPolarHBondContact O-CB 3.42Å; L481-Y485 PolarHBondContact O-N 2.86Å; Y485-G487 VanDerWaalsContact CE1-CA 3.44Å; Y485-P488 PolarHBondContact OH-O 3.47Å
486	S	75.2	Confident	79	Confident	114 Å²	114	48 Å²	48	80%	0.797	29%	0.292	S	S	*	.			trans	-104.5	25.7	172.3	-45	0	0	0	0	112
487	G	78.8	Confident	80	Confident	17 Å²	17	47.6 Å²	47.6	18%	0.175	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-83.8	173.4	-177.2	0	0	0	0	0	114.2	Y485	Y485-G487 VanDerWaalsContact CE1-CA 3.44Å
488	P	85.4	Confident	81.1	Confident	33 Å²	33	49.2 Å²	49.2	21%	0.214	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-72.4	157.1	175	30	-34.4	0	0	0	112.6	Y485 E492 Q493	Y485-P488 PolarHBondContact OH-O 3.47Å; P488-E492 WeakPolarHBondContact CA-OE2 3.26Å; P488-E492 HydrophobicContact CB-CB 3.76Å; P488-E492 WeakPolarHBondContact CB-OE2 3.12Å; P488-Q493 HydrophobicContact CB-CG 4.14Å; P488-Q493 HydrophobicContact CG-CG 3.67Å
489	S	88.6	Confident	81.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-71.8	167	171	69	0	0	0	0	112.2	N471 T473 A474 L491 E492 Q493	N471-S489 WeakPolarHBondContact O-CA 3.43Å; N471-S489 WeakPolarHBondContact O-CB 3.2Å; T473-S489 WeakPolarHBondContact O-CB 3.34Å; T473-S489 PolarHBondContact O-OG 2.67Å; A474-S489 WeakPolarHBondContact O-CB 3.39Å; S489-L491 VanDerWaalsContact C-N 3.3Å; S489-L491 PolarHBondContact O-N 2.67Å; S489-E492 WeakPolarHBondContact O-CB 3.3Å; S489-E492 PolarHBondContact O-N 2.54Å; S489-E492 WeakPolarHBondContact OG-CG 3.42Å; S489-E492 PolarHBondContact OG-N 3.21Å; S489-Q493 WeakPolarHBondContact O-CG 3.06Å; S489-Q493 PolarHBondContact O-N 2.89Å
490	L	89.8	Confident	82.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.3	-41.9	176.9	-176.7	60.2	0	0	0	111.4	L296 M297 V386 A422 A424 T464 N471 L472 Q493 I494	L296-L490 HydrophobicContact CD2-CD2 4.21Å; M297-L490 HydrophobicContact CE-CD2 3.99Å; V386-L490 HydrophobicContact CG1-CD1 4.37Å; A422-L490 HydrophobicContact CB-CD1 4.45Å; A424-L490 HydrophobicContact CB-CD1 4.45Å; T464-L490 HydrophobicContact CG2-CB 4.43Å; N471-L490 PolarHBondContact O-N 3.18Å; L472-L490 HydrophobicContact CD2-CD2 3.91Å; L472-L490 PolarHBondContact O-N 2.68Å; L490-Q493 PolarHBondContact O-N 3.39Å; L490-I494 HydrophobicContact CG-CD1 4.22Å; L490-I494 WeakPolarHBondContact O-CG1 3.45Å; L490-I494 PolarHBondContact O-N 3.18Å
491	L	90.8	Very high	83.6	Confident	26 Å²	26	51 Å²	51	14%	0.136	29%	0.291	C	S	.	.	H	α-helix	trans	-64.2	-42	175	-172.5	69.7	0	0	0	112.2	L304 F353 T355 L472 T473 S489 Q493 I494 D495	L304-L491 HydrophobicContact CD1-CD1 4.46Å; L304-L491 HydrophobicContact CD2-CD1 4.14Å; L304-L491 HydrophobicContact CD2-CD2 3.82Å; F353-L491 HydrophobicContact CE2-CD1 4.05Å; T355-L491 HydrophobicContact CG2-CD1 3.96Å; L472-L491 WeakPolarHBondContact O-CB 3.4Å; L472-L491 PolarHBondContact O-N 2.77Å; T473-L491 HydrophobicContact CG2-CD2 4.18Å; S489-L491 VanDerWaalsContact C-N 3.3Å; S489-L491 PolarHBondContact O-N 2.67Å; L491-Q493 PolarHBondContact O-N 2.92Å; L491-I494 PolarHBondContact O-N 3.24Å; L491-D495 PolarHBondContact O-N 2.96Å
492	E	89.8	Confident	84.1	Confident	69 Å²	69	53.5 Å²	53.5	32%	0.322	30%	0.301	S	S	.	.	H	α-helix	trans	-60.9	-32.4	173.5	-76.9	179.5	-151.2	0	0	112	R475 P488 S489 A496	R475-E492 IonicContact CZ-OE1 2.85Å; R475-E492 IonicContact CZ-OE2 3.87Å; R475-E492 IonicContact NE-OE1 3.08Å; R475-E492 PolarHBondContact NE-OE1 3.19Å; R475-E492 IonicContact NE-OE2 3.41Å; R475-E492 PolarHBondContact NE-OE2 2.93Å; R475-E492 IonicContact NH2-OE1 2.67Å; R475-E492 PolarHBondContact NH2-OE1 3.14Å; R475-E492 IonicContact NH2-OE2 3.55Å; R475-E492 PolarHBondContact NH2-OE2 3.44Å; P488-E492 WeakPolarHBondContact CA-OE2 3.26Å; P488-E492 HydrophobicContact CB-CB 3.76Å; P488-E492 WeakPolarHBondContact CB-OE2 3.12Å; S489-E492 WeakPolarHBondContact O-CB 3.3Å; S489-E492 PolarHBondContact O-N 2.54Å; S489-E492 WeakPolarHBondContact OG-CG 3.42Å; S489-E492 PolarHBondContact OG-N 3.21Å; E492-A496 VanDerWaalsContact O-CB 3.29Å; E492-A496 WeakPolarHBondContact O-CB 3.38Å; E492-A496 PolarHBondContact O-N 3.46Å
493	Q	89.8	Confident	84.7	Confident	23 Å²	23	51.6 Å²	51.6	11%	0.107	29%	0.29	C	S	.	.	H	α-helix	trans	-77.2	-37.2	174.7	-66.1	-62.5	-104.9	0	0	113.6	F460 V462 P488 S489 L490 L491 D495 A496 F497	F460-Q493 VanDerWaalsContact CG-OE1 3.29Å; V462-Q493 HydrophobicContact CG2-CG 3.9Å; P488-Q493 HydrophobicContact CB-CG 4.14Å; P488-Q493 HydrophobicContact CG-CG 3.67Å; S489-Q493 WeakPolarHBondContact O-CG 3.06Å; S489-Q493 PolarHBondContact O-N 2.89Å; L490-Q493 PolarHBondContact O-N 3.39Å; L491-Q493 PolarHBondContact O-N 2.92Å; Q493-D495 VanDerWaalsContact C-N 3.28Å; Q493-D495 PolarHBondContact O-N 3.32Å; Q493-A496 PolarHBondContact O-N 3.46Å; Q493-F497 VanDerWaalsContact O-CD2 3.23Å; Q493-F497 WeakPolarHBondContact O-CD2 3.27Å; Q493-F497 WeakPolarHBondContact O-CE2 3.36Å; Q493-F497 PolarHBondContact O-N 2.85Å
494	I	90.3	Very high	85.1	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-60.7	-42	171.5	-67	170.1	0	0	0	110.1	L283 L300 F353 V360 L490 L491 F497	L283-I494 HydrophobicContact CD1-CB 4.42Å; L283-I494 HydrophobicContact CD1-CD1 3.98Å; L283-I494 HydrophobicContact CD1-CG1 3.79Å; L283-I494 HydrophobicContact CD1-CG2 3.84Å; L300-I494 HydrophobicContact CD2-CD1 4.3Å; F353-I494 HydrophobicContact CZ-CD1 4.37Å; F353-I494 HydrophobicContact CZ-CG2 4.27Å; V360-I494 HydrophobicContact CG1-CG2 4.44Å; V360-I494 HydrophobicContact CG2-CG2 4.04Å; L490-I494 HydrophobicContact CG-CD1 4.22Å; L490-I494 WeakPolarHBondContact O-CG1 3.45Å; L490-I494 PolarHBondContact O-N 3.18Å; L491-I494 PolarHBondContact O-N 3.24Å; I494-F497 PolarHBondContact O-N 2.86Å
495	D	89.5	Confident	85.2	Confident	34 Å²	34	52.5 Å²	52.5	18%	0.182	29%	0.291	C	S	.	.	H	α-helix	trans	-73.7	-24.4	177.1	-149.8	30.2	0	0	0	113.1	T355 S357 K358 L491 Q493 F497	T355-D495 WeakPolarHBondContact CB-OD1 3.11Å; T355-D495 HydrophobicContact CG2-CB 4.48Å; T355-D495 PolarHBondContact OG1-OD1 3.33Å; S357-D495 WeakPolarHBondContact CB-OD1 3.24Å; S357-D495 PolarHBondContact N-OD1 2.95Å; S357-D495 PolarHBondContact N-OD2 3.23Å; S357-D495 VanDerWaalsContact OG-CG 3.27Å; S357-D495 PolarHBondContact OG-OD1 2.85Å; S357-D495 PolarHBondContact OG-OD2 3.15Å; K358-D495 PolarHBondContact NZ-O 3.36Å; K358-D495 IonicContact NZ-OD1 2.74Å; L491-D495 PolarHBondContact O-N 2.96Å; Q493-D495 VanDerWaalsContact C-N 3.28Å; Q493-D495 PolarHBondContact O-N 3.32Å; D495-F497 VanDerWaalsContact C-N 3.34Å; D495-F497 PolarHBondContact O-N 3.45Å
496	A	89.9	Confident	85.5	Confident	61 Å²	61	54.1 Å²	54.1	50%	0.504	30%	0.299	S	S	.	.	H	α-helix	trans	-73.5	-18.8	174.9	0	0	0	0	0	114.4	E492 Q493	E492-A496 VanDerWaalsContact O-CB 3.29Å; E492-A496 WeakPolarHBondContact O-CB 3.38Å; E492-A496 PolarHBondContact O-N 3.46Å; Q493-A496 PolarHBondContact O-N 3.46Å
497	F	89.1	Confident	86.2	Confident	4 Å²	4	50.3 Å²	50.3	2%	0.018	27%	0.271	C	S	.	.	S	Bend	trans	-64.9	145.7	-179.9	-70.9	-54.5	0	0	0	113.1	L281 K358 V384 Q420 A422 F460 Q493 I494 D495	L281-F497 HydrophobicContact CD2-CB 4.17Å; K358-F497 WeakPolarHBondContact CE-O 3.37Å; K358-F497 PolarHBondContact NZ-O 2.93Å; V384-F497 HydrophobicContact CG1-CD1 4.34Å; V384-F497 HydrophobicContact CG1-CD2 3.49Å; V384-F497 VanDerWaalsContact CG1-CD2 3.49Å; V384-F497 HydrophobicContact CG1-CE1 4.36Å; V384-F497 HydrophobicContact CG1-CE2 3.53Å; V384-F497 HydrophobicContact CG1-CG 3.93Å; V384-F497 HydrophobicContact CG1-CZ 3.98Å; V384-F497 HydrophobicContact CG2-CB 4.34Å; V384-F497 HydrophobicContact CG2-CG 4.38Å; Q420-F497 HydrophobicContact CB-CD1 3.67Å; Q420-F497 HydrophobicContact CB-CE1 3.77Å; Q420-F497 HydrophobicContact CG-CD1 4.14Å; A422-F497 HydrophobicContact CB-CE2 4.12Å; A422-F497 HydrophobicContact CB-CZ 3.8Å; F460-F497 AromaticContact CD2-CE1 3.71Å; F460-F497 HydrophobicContact CD2-CE1 3.71Å; F460-F497 HydrophobicContact CD2-CZ 4.22Å; F460-F497 HydrophobicContact CE2-CD1 4.37Å; F460-F497 AromaticContact CE2-CE1 3.81Å; F460-F497 HydrophobicContact CE2-CE1 3.81Å; Q493-F497 VanDerWaalsContact O-CD2 3.23Å; Q493-F497 WeakPolarHBondContact O-CD2 3.27Å; Q493-F497 WeakPolarHBondContact O-CE2 3.36Å; Q493-F497 PolarHBondContact O-N 2.85Å; I494-F497 PolarHBondContact O-N 2.86Å; D495-F497 VanDerWaalsContact C-N 3.34Å; D495-F497 PolarHBondContact O-N 3.45Å
498	K	85.5	Confident	86.9	Confident	163 Å²	163	50 Å²	50	71%	0.709	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-86.4	124.5	177.3	-65.9	163.9	-174.1	165.5	0	108.9	Q420	Q420-K498 PolarHBondContact NE2-O 2.89Å
499	A	81.9	Confident	87.2	Confident	42 Å²	42	48.4 Å²	48.4	35%	0.347	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-62	137.4	171.8	0	0	0	0	0	110.1	P279	P279-A499 HydrophobicContact CB-CB 4.06Å; P279-A499 HydrophobicContact CG-CB 4.16Å
500	P	82.1	Confident	87.4	Confident	51 Å²	51	48.4 Å²	48.4	33%	0.331	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-71.8	154.8	177.8	32	-36.9	0	0	0	111.2	D383 R502	D383-P500 HydrophobicContact CB-CG 3.85Å; D383-P500 WeakPolarHBondContact OD1-CG 3.48Å; P500-R502 PolarHBondContact O-N 2.81Å
501	Q	80.5	Confident	87.5	Confident	196 Å²	196	48.6 Å²	48.6	92%	0.916	26%	0.256	S	S	*	.			trans	-68.9	103.4	174.9	-174.4	-179	3.6	0	0	110.5
502	R	81.8	Confident	87.6	Confident	55 Å²	55	47.4 Å²	47.4	21%	0.208	25%	0.25	C	C	.	.			trans	-62.4	139.3	176.6	-59.1	-54.4	-173	-168.3	-6.2	111.6	L280 D383 P500 I504 A566	L280-R502 PolarHBondContact O-NH2 3.5Å; D383-R502 VanDerWaalsContact CG-NH1 3.25Å; D383-R502 IonicContact OD1-CZ 3.33Å; D383-R502 IonicContact OD1-NH1 2.71Å; D383-R502 PolarHBondContact OD1-NH1 3.07Å; D383-R502 IonicContact OD1-NH2 3.7Å; D383-R502 IonicContact OD2-CZ 3.87Å; D383-R502 VanDerWaalsContact OD2-CZ 3.32Å; D383-R502 IonicContact OD2-NH1 3.94Å; D383-R502 PolarHBondContact OD2-NH1 2.92Å; D383-R502 VanDerWaalsContact OD2-NH1 3.08Å; D383-R502 IonicContact OD2-NH2 3.32Å; D383-R502 PolarHBondContact OD2-NH2 2.88Å; P500-R502 PolarHBondContact O-N 2.81Å; R502-I504 VanDerWaalsContact C-N 3.3Å; R502-I504 HydrophobicContact CB-CD1 4.41Å; R502-I504 HydrophobicContact CB-CG1 4.04Å; R502-I504 PolarHBondContact O-N 3.32Å; R502-I504 VanDerWaalsContact O-N 3.11Å; R502-A566 HydrophobicContact CB-CB 4.45Å; R502-A566 WeakPolarHBondContact CB-O 3.49Å; R502-A566 VanDerWaalsContact CD-O 3.22Å; R502-A566 WeakPolarHBondContact CD-O 3.45Å; R502-A566 VanDerWaalsContact CG-O 3.23Å; R502-A566 WeakPolarHBondContact CG-O 3.32Å
503	S	80.8	Confident	87.5	Confident	27 Å²	27	45.3 Å²	45.3	19%	0.189	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-90.6	51.7	-173	78.1	0	0	0	0	113.8	D505 K506 E530 A531 G532	S503-D505 VanDerWaalsContact C-N 3.29Å; S503-D505 PolarHBondContact O-N 2.86Å; S503-K506 WeakPolarHBondContact O-CB 3.39Å; S503-K506 PolarHBondContact O-N 3.34Å; S503-E530 PolarHBondContact OG-O 3.48Å; S503-E530 VanDerWaalsContact OG-O 3.06Å; S503-A531 WeakPolarHBondContact OG-CA 3.33Å; S503-A531 WeakPolarHBondContact OG-CB 3.42Å; S503-G532 PolarHBondContact O-N 2.83Å
504	I	82.9	Confident	87.4	Confident	21 Å²	21	47.9 Å²	47.9	11%	0.108	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-32.2	-173.5	-51.5	172.7	0	0	0	112.5	I267 L271 R502 K506 G532 F533 V565	I267-I504 HydrophobicContact CG2-CG2 4.28Å; L271-I504 HydrophobicContact CD2-CD1 3.84Å; R502-I504 VanDerWaalsContact C-N 3.3Å; R502-I504 HydrophobicContact CB-CD1 4.41Å; R502-I504 HydrophobicContact CB-CG1 4.04Å; R502-I504 PolarHBondContact O-N 3.32Å; R502-I504 VanDerWaalsContact O-N 3.11Å; I504-K506 VanDerWaalsContact C-N 3.25Å; I504-K506 PolarHBondContact O-N 2.81Å; I504-G532 WeakPolarHBondContact O-CA 3.3Å; I504-F533 HydrophobicContact CG2-CD1 4.34Å; I504-V565 HydrophobicContact CG1-CB 4.48Å; I504-V565 HydrophobicContact CG2-CG1 4.3Å
505	D	85	Confident	87.4	Confident	135 Å²	135	49.2 Å²	49.2	72%	0.722	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	1.8	-179	-60.1	-66.3	0	0	0	114.1	K268 S503	K268-D505 IonicContact NZ-OD1 2.7Å; K268-D505 PolarHBondContact NZ-OD1 2.81Å; K268-D505 IonicContact NZ-OD2 3.43Å; K268-D505 PolarHBondContact NZ-OD2 3.03Å; S503-D505 VanDerWaalsContact C-N 3.29Å; S503-D505 PolarHBondContact O-N 2.86Å
506	K	87.9	Confident	87.4	Confident	65 Å²	65	51.9 Å²	51.9	28%	0.283	28%	0.276	S	S	.	.	S	Bend	trans	-90.9	162.1	175.8	-72.1	-168.5	-177.7	-179.8	0	112.2	S503 I504 A531 G532 D678 Y679	S503-K506 WeakPolarHBondContact O-CB 3.39Å; S503-K506 PolarHBondContact O-N 3.34Å; I504-K506 VanDerWaalsContact C-N 3.25Å; I504-K506 PolarHBondContact O-N 2.81Å; K506-A531 HydrophobicContact CB-CB 4Å; K506-A531 HydrophobicContact CD-CB 4.29Å; K506-G532 WeakPolarHBondContact O-CA 3.39Å; K506-G532 PolarHBondContact O-N 2.89Å; K506-D678 WeakPolarHBondContact CE-O 3.37Å; K506-D678 PolarHBondContact NZ-O 3.48Å; K506-Y679 HydrophobicContact CB-CE1 4.28Å; K506-Y679 HydrophobicContact CD-CD1 3.88Å; K506-Y679 HydrophobicContact CD-CE1 3.54Å
507	P	90.6	Very high	87.3	Confident	33 Å²	33	56.9 Å²	56.9	21%	0.214	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-49.7	147.1	164.8	-25.4	31.8	0	0	0	113.3	R509 A531 E593 Y679	P507-R509 PolarHBondContact O-N 2.93Å; P507-A531 CarbonylContact O-C 3.51Å; P507-A531 WeakPolarHBondContact O-CB 3.38Å; P507-E593 HydrophobicContact CB-CB 4.39Å; P507-E593 HydrophobicContact CG-CB 4.4Å; P507-E593 VanDerWaalsContact CG-CD 3.5Å; P507-E593 HydrophobicContact CG-CG 4.43Å; P507-E593 VanDerWaalsContact CG-OE2 3.24Å; P507-E593 WeakPolarHBondContact CG-OE2 3.12Å; P507-Y679 WeakPolarHBondContact CD-OH 3.29Å; P507-Y679 WeakPolarHBondContact CG-OH 3.42Å
508	F	92.5	Very high	86.9	Confident	11 Å²	11	60 Å²	60	5%	0.048	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-62.3	132.9	179.4	179	-108.6	0	0	0	111.9	L510 I529 A531 F533 I534 I540 F588 C589 D590	F508-L510 HydrophobicContact CE1-CB 4.03Å; F508-L510 HydrophobicContact CE2-CB 4.14Å; F508-L510 HydrophobicContact CZ-CB 3.5Å; F508-L510 HydrophobicContact CZ-CD1 3.85Å; F508-L510 HydrophobicContact CZ-CG 4.34Å; F508-I529 HydrophobicContact CD2-CG2 4.08Å; F508-I529 HydrophobicContact CE2-CD1 4.17Å; F508-I529 HydrophobicContact CE2-CG1 4.11Å; F508-I529 HydrophobicContact CE2-CG2 3.76Å; F508-A531 WeakPolarHBondContact CA-O 3.47Å; F508-F533 WeakPolarHBondContact CD2-O 3.42Å; F508-I534 HydrophobicContact CD1-CD1 4.5Å; F508-I534 HydrophobicContact CD2-CB 4.09Å; F508-I534 HydrophobicContact CE1-CD1 3.83Å; F508-I534 HydrophobicContact CE2-CB 3.7Å; F508-I534 HydrophobicContact CE2-CD1 4.1Å; F508-I534 HydrophobicContact CE2-CG2 3.87Å; F508-I534 HydrophobicContact CZ-CB 4.1Å; F508-I534 HydrophobicContact CZ-CD1 3.59Å; F508-I534 HydrophobicContact CZ-CG1 4.45Å; F508-I534 HydrophobicContact CZ-CG2 4.27Å; F508-I540 HydrophobicContact CD1-CG2 4.08Å; F508-I540 HydrophobicContact CE1-CG2 3.93Å; F508-F588 HydrophobicContact CE1-CB 3.92Å; F508-C589 WeakPolarHBondContact O-CA 3.41Å; F508-D590 HydrophobicContact CB-CB 4.34Å; F508-D590 PolarHBondContact O-N 2.92Å
509	R	92.5	Very high	86.5	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	124	171.8	-60.8	-68.4	-177.1	-103.2	12	109.8	P507 E530 A531 F588 E593 E674 Y679 L682	P507-R509 PolarHBondContact O-N 2.93Å; R509-E530 PolarHBondContact O-N 2.82Å; R509-A531 HydrophobicContact CB-CB 4.02Å; R509-A531 HydrophobicContact CG-CB 4.13Å; R509-A531 PolarHBondContact N-O 3.31Å; R509-A531 PolarHBondContact O-N 3.35Å; R509-F588 WeakPolarHBondContact CA-O 3.4Å; R509-E593 PolarHBondContact NH1-O 2.86Å; R509-E593 PolarHBondContact NH2-O 2.91Å; R509-E674 IonicContact CZ-OE1 2.88Å; R509-E674 IonicContact CZ-OE2 2.68Å; R509-E674 IonicContact NE-OE1 2.71Å; R509-E674 PolarHBondContact NE-OE1 2.8Å; R509-E674 VanDerWaalsContact NE-OE1 3.11Å; R509-E674 IonicContact NE-OE2 2.66Å; R509-E674 PolarHBondContact NE-OE2 3.26Å; R509-E674 IonicContact NH2-OE1 2.68Å; R509-E674 PolarHBondContact NH2-OE1 3.44Å; R509-E674 IonicContact NH2-OE2 2.66Å; R509-Y679 HydrophobicContact CG-CD1 4.34Å; R509-Y679 HydrophobicContact CG-CE1 3.79Å; R509-L682 HydrophobicContact CB-CD1 3.97Å; R509-L682 HydrophobicContact CG-CD1 3.79Å
510	L	92.9	Very high	86.1	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	126.1	173.7	-177.9	175.4	0	0	0	109.2	F508 V512 K528 I529 V570 L572 V587 F588	F508-L510 HydrophobicContact CE1-CB 4.03Å; F508-L510 HydrophobicContact CE2-CB 4.14Å; F508-L510 HydrophobicContact CZ-CB 3.5Å; F508-L510 HydrophobicContact CZ-CD1 3.85Å; F508-L510 HydrophobicContact CZ-CG 4.34Å; L510-V512 HydrophobicContact CD2-CG2 4.38Å; L510-K528 WeakPolarHBondContact CA-O 3.46Å; L510-I529 HydrophobicContact CB-CG1 4.45Å; L510-I529 HydrophobicContact CD1-CG1 4.06Å; L510-I529 HydrophobicContact CG-CG1 4.22Å; L510-V570 HydrophobicContact CD1-CG2 3.78Å; L510-L572 HydrophobicContact CD1-CD1 3.45Å; L510-L572 VanDerWaalsContact CD1-CD1 3.45Å; L510-L572 HydrophobicContact CD1-CG 4.01Å; L510-V587 WeakPolarHBondContact O-CA 3.45Å; L510-F588 HydrophobicContact CB-CB 4.41Å; L510-F588 HydrophobicContact CD2-CD2 4.21Å; L510-F588 PolarHBondContact N-O 3Å; L510-F588 PolarHBondContact O-N 3.5Å
511	C	91.6	Very high	85.5	Confident	4 Å²	4	63.9 Å²	63.9	3%	0.027	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	120.2	176.5	-69.7	0	0	0	0	110.5	S513 G527 K528 Q625 L682	C511-S513 PolarHBondContact O-N 3.31Å; C511-G527 VanDerWaalsContact O-CA 3.27Å; C511-G527 WeakPolarHBondContact O-CA 2.91Å; C511-K528 PolarHBondContact N-O 3.33Å; C511-Q625 HydrophobicContact CB-CB 4.37Å; C511-L682 WeakPolarHBondContact SG-CD2 3.34Å
512	V	91.9	Very high	85.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	119.9	-177.9	174.2	0	0	0	0	110.3	L510 V515 V525 I582 G585 C586 F588 T626	L510-V512 HydrophobicContact CD2-CG2 4.38Å; V512-V515 HydrophobicContact CG1-CG2 3.62Å; V512-V525 HydrophobicContact CB-CG1 4.05Å; V512-V525 HydrophobicContact CG1-CG1 3.45Å; V512-V525 VanDerWaalsContact CG1-CG1 3.45Å; V512-V525 HydrophobicContact CG2-CG1 3.56Å; V512-I582 HydrophobicContact CG1-CD1 4.5Å; V512-I582 HydrophobicContact CG2-CD1 4.32Å; V512-G585 PolarHBondContact O-N 3.17Å; V512-G585 VanDerWaalsContact O-N 3.14Å; V512-C586 HydrophobicContact CB-CB 4.44Å; V512-C586 VanDerWaalsContact CB-O 3.32Å; V512-C586 WeakPolarHBondContact CB-O 3.36Å; V512-C586 HydrophobicContact CG2-CB 4.21Å; V512-C586 WeakPolarHBondContact CG2-O 3.33Å; V512-C586 PolarHBondContact N-O 3.13Å; V512-F588 HydrophobicContact CG2-CD2 3.93Å; V512-F588 HydrophobicContact CG2-CE2 3.88Å; V512-T626 WeakPolarHBondContact O-CB 3.4Å; V512-T626 PolarHBondContact O-OG1 2.85Å
513	S	88.5	Confident	85.9	Confident	26 Å²	26	53.3 Å²	53.3	18%	0.182	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-47.9	176.9	-61.1	0	0	0	0	111.3	Q381 C511 T526 V584	Q381-S513 PolarHBondContact OE1-OG 3.07Å; C511-S513 PolarHBondContact O-N 3.31Å; S513-T526 PolarHBondContact N-O 3.19Å; S513-V584 VanDerWaalsContact O-CG1 3.3Å; S513-V584 WeakPolarHBondContact O-CG1 3.28Å; S513-V584 WeakPolarHBondContact O-CG2 3.41Å
514	D	88.6	Confident	86.3	Confident	76 Å²	76	52.4 Å²	52.4	41%	0.406	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	160.1	177.5	-176.5	38.1	0	0	0	112.1	F516 T526	D514-F516 WeakPolarHBondContact OD2-CD1 3.21Å; D514-T526 WeakPolarHBondContact CB-OG1 3.36Å; D514-T526 PolarHBondContact N-OG1 3.13Å; D514-T526 PolarHBondContact O-N 3.47Å
515	V	90.1	Very high	86.7	Confident	29 Å²	29	51.4 Å²	51.4	18%	0.176	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	110.9	-179.4	-176.3	0	0	0	0	110.1	V512 F523 V525 I579 I582	V512-V515 HydrophobicContact CG1-CG2 3.62Å; V515-F523 HydrophobicContact CG1-CD2 3.82Å; V515-F523 HydrophobicContact CG1-CE2 4.22Å; V515-V525 HydrophobicContact CG1-CG2 4.35Å; V515-V525 HydrophobicContact CG2-CG1 4.17Å; V515-V525 HydrophobicContact CG2-CG2 4.42Å; V515-I579 HydrophobicContact CG1-CD1 4.21Å; V515-I579 HydrophobicContact CG1-CG1 3.84Å; V515-I582 HydrophobicContact CG1-CG2 3.82Å; V515-I582 HydrophobicContact CG2-CD1 3.87Å; V515-I582 HydrophobicContact CG2-CG1 3.98Å; V515-I582 HydrophobicContact CG2-CG2 4.29Å
516	F	89	Confident	87	Confident	91 Å²	91	46.4 Å²	46.4	40%	0.399	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	154.1	177	59.6	-99.8	0	0	0	113	D514 D518 C524 T526	D514-F516 WeakPolarHBondContact OD2-CD1 3.21Å; F516-D518 PolarHBondContact O-N 3.28Å; F516-C524 HydrophobicContact CD2-CB 3.72Å; F516-C524 HydrophobicContact CE1-CB 4.39Å; F516-C524 HydrophobicContact CE2-CB 3.4Å; F516-C524 HydrophobicContact CG-CB 4.34Å; F516-C524 HydrophobicContact CZ-CB 3.78Å; F516-C524 PolarHBondContact N-O 3.03Å; F516-C524 VanDerWaalsContact N-O 3.09Å; F516-C524 PolarHBondContact O-N 2.82Å; F516-C524 VanDerWaalsContact O-O 3.09Å; F516-T526 HydrophobicContact CD1-CG2 4.3Å; F516-T526 HydrophobicContact CE1-CG2 3.54Å; F516-T526 HydrophobicContact CZ-CG2 4.37Å
517	K	87.9	Confident	87.1	Confident	166 Å²	166	43.5 Å²	43.5	72%	0.722	24%	0.242	S	C	*	.			trans	-89.5	108.2	177.6	-173	-174.9	172.4	-168.1	0	110.2	I579	K517-I579 HydrophobicContact CB-CD1 3.97Å
518	D	80.8	Confident	87.1	Confident	70 Å²	70	42.4 Å²	42.4	37%	0.374	23%	0.234	S	C	.	.			trans	-69.4	163.5	168.6	174.7	45.7	0	0	0	112	F516 G520 C524	F516-D518 PolarHBondContact O-N 3.28Å; D518-G520 PolarHBondContact O-N 3.05Å; D518-G520 PolarHBondContact OD2-N 3.42Å; D518-C524 HydrophobicContact CB-CB 4.5Å
519	Q	76.3	Confident	87.1	Confident	202 Å²	202	41.9 Å²	41.9	94%	0.944	23%	0.231	S	C	*	.	S	Bend	trans	-65.8	-21.2	175.2	-57.8	-173.6	10.2	0	0	112.8
520	G	73.6	Confident	86.9	Confident	36 Å²	36	42.5 Å²	42.5	37%	0.371	24%	0.235	S	C	.	.	S	Bend	trans	-68.8	173	177.8	0	0	0	0	0	115.1	D518 G522	D518-G520 PolarHBondContact O-N 3.05Å; D518-G520 PolarHBondContact OD2-N 3.42Å; G520-G522 PolarHBondContact O-N 2.94Å
521	S	70	Confident	86.8	Confident	98 Å²	98	42.5 Å²	42.5	69%	0.685	24%	0.235	S	C	*	.	S	Bend	trans	-77.5	68.3	174.4	50.9	0	0	0	0	111.8	K552 T575	S521-K552 PolarHBondContact O-NZ 3.21Å; S521-K552 PolarHBondContact OG-NZ 2.72Å; S521-T575 WeakPolarHBondContact O-CG2 3.26Å
522	G	80	Confident	86.7	Confident	21 Å²	21	42.3 Å²	42.3	22%	0.216	23%	0.233	C	C	.	.	S	Bend	trans	177.4	-156.6	179.3	0	0	0	0	0	111.6	G520	G520-G522 PolarHBondContact O-N 2.94Å
523	F	89.6	Confident	86.6	Confident	9 Å²	9	46.4 Å²	46.4	4%	0.039	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	158.2	164.2	59.1	-82.4	0	0	0	109.2	V515 V525 V574 M577 I579 I582	V515-F523 HydrophobicContact CG1-CD2 3.82Å; V515-F523 HydrophobicContact CG1-CE2 4.22Å; F523-V525 HydrophobicContact CD2-CG2 3.59Å; F523-V525 HydrophobicContact CE2-CG2 3.44Å; F523-V525 VanDerWaalsContact CE2-CG2 3.44Å; F523-V574 HydrophobicContact CD1-CG2 4.3Å; F523-V574 HydrophobicContact CD2-CG2 3.73Å; F523-V574 HydrophobicContact CE1-CG2 3.94Å; F523-V574 HydrophobicContact CE2-CG2 3.34Å; F523-V574 HydrophobicContact CG-CG2 4.2Å; F523-V574 HydrophobicContact CZ-CG2 3.46Å; F523-V574 VanDerWaalsContact CZ-CG2 3.46Å; F523-V574 PolarHBondContact N-O 3.35Å; F523-V574 PolarHBondContact O-N 3.34Å; F523-M577 HydrophobicContact CE1-CB 4.36Å; F523-M577 WeakPolarHBondContact CE1-O 3.44Å; F523-M577 HydrophobicContact CE2-CE 4.32Å; F523-M577 HydrophobicContact CZ-CB 4.24Å; F523-M577 HydrophobicContact CZ-CE 3.74Å; F523-M577 HydrophobicContact CZ-CG 4.38Å; F523-I579 HydrophobicContact CB-CD1 4Å; F523-I579 HydrophobicContact CB-CG1 4.37Å; F523-I579 HydrophobicContact CD1-CB 4.37Å; F523-I579 HydrophobicContact CD2-CG1 4.41Å; F523-I579 HydrophobicContact CG-CB 4.34Å; F523-I579 HydrophobicContact CG-CD1 4.47Å; F523-I579 HydrophobicContact CG-CG1 4.31Å; F523-I582 HydrophobicContact CE2-CD1 4.12Å; F523-I582 HydrophobicContact CE2-CG2 3.78Å; F523-I582 HydrophobicContact CZ-CG2 4.16Å
524	C	90.4	Very high	86.8	Confident	8 Å²	8	45.2 Å²	45.2	5%	0.054	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	143.2	177.3	-161.9	0	0	0	0	109.6	F516 D518 L572	F516-C524 HydrophobicContact CD2-CB 3.72Å; F516-C524 HydrophobicContact CE1-CB 4.39Å; F516-C524 HydrophobicContact CE2-CB 3.4Å; F516-C524 HydrophobicContact CG-CB 4.34Å; F516-C524 HydrophobicContact CZ-CB 3.78Å; F516-C524 PolarHBondContact N-O 3.03Å; F516-C524 VanDerWaalsContact N-O 3.09Å; F516-C524 PolarHBondContact O-N 2.82Å; F516-C524 VanDerWaalsContact O-O 3.09Å; D518-C524 HydrophobicContact CB-CB 4.5Å; C524-L572 CarbonylContact C-O 3.58Å; C524-L572 WeakPolarHBondContact CA-O 3.48Å
525	V	91.9	Very high	86.9	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	119.6	175.6	-174.1	0	0	0	0	108.6	V512 V515 F523 L572 V574 I582 F588	V512-V525 HydrophobicContact CB-CG1 4.05Å; V512-V525 HydrophobicContact CG1-CG1 3.45Å; V512-V525 VanDerWaalsContact CG1-CG1 3.45Å; V512-V525 HydrophobicContact CG2-CG1 3.56Å; V515-V525 HydrophobicContact CG1-CG2 4.35Å; V515-V525 HydrophobicContact CG2-CG1 4.17Å; V515-V525 HydrophobicContact CG2-CG2 4.42Å; F523-V525 HydrophobicContact CD2-CG2 3.59Å; F523-V525 HydrophobicContact CE2-CG2 3.44Å; F523-V525 VanDerWaalsContact CE2-CG2 3.44Å; V525-L572 PolarHBondContact N-O 2.87Å; V525-L572 PolarHBondContact O-N 3.46Å; V525-V574 HydrophobicContact CG2-CG2 3.79Å; V525-I582 HydrophobicContact CG1-CD1 4.05Å; V525-I582 HydrophobicContact CG2-CD1 3.76Å; V525-F588 HydrophobicContact CB-CE2 4.03Å; V525-F588 HydrophobicContact CG1-CE2 3.72Å; V525-F588 HydrophobicContact CG1-CZ 4.39Å; V525-F588 HydrophobicContact CG2-CE2 4.2Å; V525-F588 HydrophobicContact CG2-CZ 4.19Å
526	T	90.1	Very high	87	Confident	30 Å²	30	43.5 Å²	43.5	18%	0.184	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	147.5	176.1	74.8	0	0	0	0	110.1	S513 D514 F516 V570	S513-T526 PolarHBondContact N-O 3.19Å; D514-T526 WeakPolarHBondContact CB-OG1 3.36Å; D514-T526 PolarHBondContact N-OG1 3.13Å; D514-T526 PolarHBondContact O-N 3.47Å; F516-T526 HydrophobicContact CD1-CG2 4.3Å; F516-T526 HydrophobicContact CE1-CG2 3.54Å; F516-T526 HydrophobicContact CZ-CG2 4.37Å; T526-V570 CarbonylContact C-O 3.58Å; T526-V570 WeakPolarHBondContact CA-O 3.31Å
527	G	90.6	Very high	87	Confident	4 Å²	4	41.5 Å²	41.5	4%	0.041	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173	164.6	172	0	0	0	0	0	113.5	C511 V570	C511-G527 VanDerWaalsContact O-CA 3.27Å; C511-G527 WeakPolarHBondContact O-CA 2.91Å; G527-V570 PolarHBondContact N-O 3.25Å; G527-V570 PolarHBondContact O-N 3.16Å
528	K	90.5	Very high	87.2	Confident	9 Å²	9	35 Å²	35	4%	0.039	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	134.3	174.8	178.6	-177.1	159.2	-145	0	110.3	Q381 L510 C511 E530 D568	Q381-K528 HydrophobicContact CB-CD 3.84Å; Q381-K528 HydrophobicContact CG-CB 4.37Å; Q381-K528 HydrophobicContact CG-CD 4.23Å; Q381-K528 WeakPolarHBondContact O-CD 3.42Å; Q381-K528 WeakPolarHBondContact O-CE 3.37Å; Q381-K528 PolarHBondContact O-NZ 3.15Å; L510-K528 WeakPolarHBondContact CA-O 3.46Å; C511-K528 PolarHBondContact N-O 3.33Å; K528-E530 WeakPolarHBondContact CD-OE1 3.29Å; K528-E530 VanDerWaalsContact CE-OE1 3.3Å; K528-E530 WeakPolarHBondContact CE-OE1 3.35Å; K528-E530 VanDerWaalsContact CE-OE2 3.23Å; K528-E530 WeakPolarHBondContact CE-OE2 3.2Å; K528-E530 IonicContact NZ-OE1 3.64Å; K528-E530 PolarHBondContact NZ-OE1 3.01Å; K528-E530 IonicContact NZ-OE2 2.83Å; K528-E530 PolarHBondContact NZ-OE2 3.2Å; K528-E530 PolarHBondContact O-N 3.22Å; K528-D568 WeakPolarHBondContact CA-O 3.27Å
529	I	91.7	Very high	87.7	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	115.7	168	-52.7	174.7	0	0	0	107.9	F508 L510 A531 I534 A564 A566 G567 D568 V570	F508-I529 HydrophobicContact CD2-CG2 4.08Å; F508-I529 HydrophobicContact CE2-CD1 4.17Å; F508-I529 HydrophobicContact CE2-CG1 4.11Å; F508-I529 HydrophobicContact CE2-CG2 3.76Å; L510-I529 HydrophobicContact CB-CG1 4.45Å; L510-I529 HydrophobicContact CD1-CG1 4.06Å; L510-I529 HydrophobicContact CG-CG1 4.22Å; I529-A531 VanDerWaalsContact CG2-O 3.32Å; I529-A531 WeakPolarHBondContact CG2-O 3.5Å; I529-I534 HydrophobicContact CD1-CG2 3.92Å; I529-A564 HydrophobicContact CD1-CB 3.63Å; I529-A566 HydrophobicContact CG2-CB 4.4Å; I529-A566 CarbonylContact O-C 3.54Å; I529-A566 WeakPolarHBondContact O-CA 3.37Å; I529-G567 PolarHBondContact O-N 3.12Å; I529-D568 HydrophobicContact CD1-CB 4.48Å; I529-D568 PolarHBondContact N-O 2.88Å; I529-V570 HydrophobicContact CD1-CG1 4.24Å; I529-V570 HydrophobicContact CD1-CG2 4.01Å; I529-V570 HydrophobicContact CG1-CG2 3.89Å
530	E	89.3	Confident	88.6	Confident	14 Å²	14	29.5 Å²	29.5	7%	0.065	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-31.6	177.4	-64.9	-64	172	0	0	111.9	S503 R509 K528 Q625	S503-E530 PolarHBondContact OG-O 3.48Å; S503-E530 VanDerWaalsContact OG-O 3.06Å; R509-E530 PolarHBondContact O-N 2.82Å; K528-E530 WeakPolarHBondContact CD-OE1 3.29Å; K528-E530 VanDerWaalsContact CE-OE1 3.3Å; K528-E530 WeakPolarHBondContact CE-OE1 3.35Å; K528-E530 VanDerWaalsContact CE-OE2 3.23Å; K528-E530 WeakPolarHBondContact CE-OE2 3.2Å; K528-E530 IonicContact NZ-OE1 3.64Å; K528-E530 PolarHBondContact NZ-OE1 3.01Å; K528-E530 IonicContact NZ-OE2 2.83Å; K528-E530 PolarHBondContact NZ-OE2 3.2Å; K528-E530 PolarHBondContact O-N 3.22Å; E530-Q625 PolarHBondContact OE1-NE2 3.14Å; E530-Q625 VanDerWaalsContact OE1-NE2 3.16Å
531	A	90	Very high	89.5	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	151.7	-175.7	0	0	0	0	0	113.2	S503 K506 P507 F508 R509 I529 Y679	S503-A531 WeakPolarHBondContact OG-CA 3.33Å; S503-A531 WeakPolarHBondContact OG-CB 3.42Å; K506-A531 HydrophobicContact CB-CB 4Å; K506-A531 HydrophobicContact CD-CB 4.29Å; P507-A531 CarbonylContact O-C 3.51Å; P507-A531 WeakPolarHBondContact O-CB 3.38Å; F508-A531 WeakPolarHBondContact CA-O 3.47Å; R509-A531 HydrophobicContact CB-CB 4.02Å; R509-A531 HydrophobicContact CG-CB 4.13Å; R509-A531 PolarHBondContact N-O 3.31Å; R509-A531 PolarHBondContact O-N 3.35Å; I529-A531 VanDerWaalsContact CG2-O 3.32Å; I529-A531 WeakPolarHBondContact CG2-O 3.5Å; A531-Y679 HydrophobicContact CB-CD1 4.06Å; A531-Y679 HydrophobicContact CB-CE1 3.61Å
532	G	90.1	Very high	90.6	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	73.7	-148.3	177.9	0	0	0	0	0	114.7	S503 I504 K506 A566	S503-G532 PolarHBondContact O-N 2.83Å; I504-G532 WeakPolarHBondContact O-CA 3.3Å; K506-G532 WeakPolarHBondContact O-CA 3.39Å; K506-G532 PolarHBondContact O-N 2.89Å; G532-A566 PolarHBondContact O-N 2.85Å
533	F	90.4	Very high	91.1	Very high	85 Å²	85	23.7 Å²	23.7	37%	0.373	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	166.2	178.8	63.6	-92.7	0	0	0	109.6	I267 I504 F508 A564 V565	I267-F533 HydrophobicContact CD1-CD1 4.02Å; I267-F533 HydrophobicContact CD1-CD2 3.53Å; I267-F533 HydrophobicContact CD1-CE1 4.01Å; I267-F533 HydrophobicContact CD1-CE2 3.53Å; I267-F533 HydrophobicContact CD1-CG 3.79Å; I267-F533 HydrophobicContact CD1-CZ 3.78Å; I267-F533 HydrophobicContact CG1-CD2 4.39Å; I267-F533 HydrophobicContact CG2-CB 4.47Å; I504-F533 HydrophobicContact CG2-CD1 4.34Å; F508-F533 WeakPolarHBondContact CD2-O 3.42Å; F533-A564 CarbonylContact C-O 3.59Å; F533-A564 VanDerWaalsContact CA-O 3.27Å; F533-A564 WeakPolarHBondContact CA-O 3.08Å; F533-A564 WeakPolarHBondContact CB-O 3.35Å; F533-V565 HydrophobicContact CB-CG1 3.98Å
534	I	91.1	Very high	91	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	149.4	177.1	-169.7	160.9	0	0	0	111.3	F508 I529 D538 I540 V551 I554 W563 A564 L572	F508-I534 HydrophobicContact CD1-CD1 4.5Å; F508-I534 HydrophobicContact CD2-CB 4.09Å; F508-I534 HydrophobicContact CE1-CD1 3.83Å; F508-I534 HydrophobicContact CE2-CB 3.7Å; F508-I534 HydrophobicContact CE2-CD1 4.1Å; F508-I534 HydrophobicContact CE2-CG2 3.87Å; F508-I534 HydrophobicContact CZ-CB 4.1Å; F508-I534 HydrophobicContact CZ-CD1 3.59Å; F508-I534 HydrophobicContact CZ-CG1 4.45Å; F508-I534 HydrophobicContact CZ-CG2 4.27Å; I529-I534 HydrophobicContact CD1-CG2 3.92Å; I534-D538 HydrophobicContact CG1-CB 4.28Å; I534-I540 HydrophobicContact CD1-CD1 4.27Å; I534-I540 HydrophobicContact CD1-CG2 3.57Å; I534-V551 HydrophobicContact CD1-CG2 3.66Å; I534-V551 HydrophobicContact CG1-CG2 4.39Å; I534-I554 HydrophobicContact CG2-CD1 4.07Å; I534-W563 CarbonylContact O-C 3.57Å; I534-W563 WeakPolarHBondContact O-CA 3.43Å; I534-W563 WeakPolarHBondContact O-CB 3.45Å; I534-A564 HydrophobicContact CG2-CB 4.27Å; I534-A564 PolarHBondContact N-O 3.02Å; I534-A564 PolarHBondContact O-N 3.28Å; I534-L572 HydrophobicContact CD1-CD1 4.24Å
535	Q	91.2	Very high	91	Very high	23 Å²	23	27.1 Å²	27.1	11%	0.107	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	157.4	177.5	-53.4	-170	-26.6	0	0	111.9	G537 D538 D562 W563	Q535-G537 PolarHBondContact O-N 3.3Å; Q535-D538 WeakPolarHBondContact CB-OD2 3.49Å; Q535-D538 PolarHBondContact N-OD2 3.32Å; Q535-D538 WeakPolarHBondContact O-CB 3.49Å; Q535-D538 PolarHBondContact O-N 2.95Å; Q535-D538 VanDerWaalsContact O-N 3.11Å; Q535-D562 CarbonylContact C-O 3.59Å; Q535-D562 WeakPolarHBondContact CA-O 3.35Å; Q535-W563 HydrophobicContact CB-CB 4.48Å; Q535-W563 HydrophobicContact CG-CB 3.95Å
536	T	92.1	Very high	90.9	Very high	47 Å²	47	32 Å²	32	29%	0.288	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	133.8	173.1	50.1	0	0	0	0	110.6	I554 D562	T536-I554 HydrophobicContact CG2-CD1 4.2Å; T536-I554 HydrophobicContact CG2-CG1 4.13Å; T536-D562 PolarHBondContact N-O 3.5Å; T536-D562 PolarHBondContact OG1-O 3.49Å
537	G	90.1	Very high	90.9	Very high	48 Å²	48	33.3 Å²	33.3	50%	0.495	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	6.7	-173.2	0	0	0	0	0	115.9	Q535 V551	Q535-G537 PolarHBondContact O-N 3.3Å; G537-V551 WeakPolarHBondContact CA-O 3.45Å; G537-V551 PolarHBondContact N-O 2.73Å
538	D	91.4	Very high	91	Very high	31 Å²	31	37.1 Å²	37.1	17%	0.166	21%	0.205	C	C	.	.			trans	-71.4	155.1	168	-84.3	-36.5	0	0	0	112.8	R262 I534 Q535 T550 V551	R262-D538 IonicContact CZ-OD1 3.76Å; R262-D538 IonicContact NH1-OD1 2.74Å; R262-D538 PolarHBondContact NH1-OD1 3.09Å; R262-D538 IonicContact NH2-OD1 3.71Å; R262-D538 PolarHBondContact NH2-OD1 2.97Å; I534-D538 HydrophobicContact CG1-CB 4.28Å; Q535-D538 WeakPolarHBondContact CB-OD2 3.49Å; Q535-D538 PolarHBondContact N-OD2 3.32Å; Q535-D538 WeakPolarHBondContact O-CB 3.49Å; Q535-D538 PolarHBondContact O-N 2.95Å; Q535-D538 VanDerWaalsContact O-N 3.11Å; D538-T550 WeakPolarHBondContact O-CA 3.21Å; D538-V551 PolarHBondContact O-N 2.56Å; D538-V551 VanDerWaalsContact O-N 3.08Å
539	K	92.4	Very high	91.1	Very high	152 Å²	152	36.9 Å²	36.9	66%	0.661	20%	0.204	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	129.1	172	-68.9	-174	176.5	-168.6	0	109.4	C549 T550 P591	K539-C549 WeakPolarHBondContact CA-O 3.32Å; K539-T550 HydrophobicContact CG-CG2 3.91Å; K539-P591 VanDerWaalsContact O-CD 3.26Å; K539-P591 WeakPolarHBondContact O-CD 3.31Å; K539-P591 WeakPolarHBondContact O-CG 3.43Å
540	I	93.6	Very high	91.1	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	154.6	177.2	61.9	-174.7	0	0	0	110.4	F508 I534 T548 C549 V551 L572 V574 F588	F508-I540 HydrophobicContact CD1-CG2 4.08Å; F508-I540 HydrophobicContact CE1-CG2 3.93Å; I534-I540 HydrophobicContact CD1-CD1 4.27Å; I534-I540 HydrophobicContact CD1-CG2 3.57Å; I540-T548 CarbonylContact O-C 3.56Å; I540-T548 VanDerWaalsContact O-CA 3.31Å; I540-T548 WeakPolarHBondContact O-CA 3.35Å; I540-C549 WeakPolarHBondContact CG1-SG 3.32Å; I540-C549 PolarHBondContact N-O 2.97Å; I540-C549 PolarHBondContact O-N 3.28Å; I540-V551 HydrophobicContact CD1-CG2 3.88Å; I540-L572 HydrophobicContact CD1-CD1 4.24Å; I540-V574 HydrophobicContact CD1-CG1 4.36Å; I540-F588 HydrophobicContact CD1-CB 4.06Å; I540-F588 HydrophobicContact CD1-CD1 3.67Å; I540-F588 HydrophobicContact CD1-CD2 4.05Å; I540-F588 HydrophobicContact CD1-CE1 4Å; I540-F588 HydrophobicContact CD1-CE2 4.35Å; I540-F588 HydrophobicContact CD1-CG 3.7Å; I540-F588 HydrophobicContact CD1-CZ 4.34Å; I540-F588 HydrophobicContact CG1-CD1 3.94Å; I540-F588 HydrophobicContact CG1-CE1 4.34Å; I540-F588 HydrophobicContact CG1-CG 4.36Å
541	L	93.4	Very high	91.3	Very high	12 Å²	12	38.6 Å²	38.6	6%	0.063	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130.2	176.8	-178.7	76	0	0	0	109.3	M543 T548 F588 C589 P591 P594	L541-M543 HydrophobicContact CD2-CE 4.5Å; L541-M543 HydrophobicContact CD2-CG 4.01Å; L541-M543 HydrophobicContact CD2-SD 3.87Å; L541-M543 HydrophobicContact CG-CG 4.21Å; L541-M543 HydrophobicContact CG-SD 4.21Å; L541-T548 HydrophobicContact CD1-CG2 3.62Å; L541-F588 CarbonylContact O-C 3.53Å; L541-F588 WeakPolarHBondContact O-CA 3.45Å; L541-C589 PolarHBondContact N-O 2.85Å; L541-C589 PolarHBondContact O-N 2.83Å; L541-C589 PolarHBondContact O-SG 2.8Å; L541-C589 VanDerWaalsContact O-SG 3.36Å; L541-P591 HydrophobicContact CB-CG 4.29Å; L541-P594 HydrophobicContact CD2-CB 3.64Å
542	A	92.5	Very high	91.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	124.7	174.2	0	0	0	0	0	110.6	P545 N546 E547 M577 F588	A542-P545 HydrophobicContact CB-CG 3.94Å; A542-N546 VanDerWaalsContact O-CA 3.25Å; A542-N546 WeakPolarHBondContact O-CA 3.34Å; A542-N546 PolarHBondContact O-N 3.35Å; A542-E547 PolarHBondContact N-O 2.87Å; A542-E547 PolarHBondContact O-N 3.07Å; A542-M577 HydrophobicContact CB-CE 3.85Å; A542-M577 HydrophobicContact CB-SD 3.71Å; A542-F588 HydrophobicContact CB-CD1 3.89Å; A542-F588 HydrophobicContact CB-CE1 3.75Å
543	M	90.8	Very high	91.3	Very high	21 Å²	21	44.6 Å²	44.6	10%	0.103	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	129.7	176.9	-65.1	-65.2	-99.5	0	0	109.9	L541 P545 N546 V587 I595 V597 S672	L541-M543 HydrophobicContact CD2-CE 4.5Å; L541-M543 HydrophobicContact CD2-CG 4.01Å; L541-M543 HydrophobicContact CD2-SD 3.87Å; L541-M543 HydrophobicContact CG-CG 4.21Å; L541-M543 HydrophobicContact CG-SD 4.21Å; M543-P545 VanDerWaalsContact C-CD 3.45Å; M543-N546 HydrophobicContact SD-CB 3.74Å; M543-V587 PolarHBondContact N-O 2.92Å; M543-V587 PolarHBondContact O-N 3.08Å; M543-I595 HydrophobicContact CB-CG2 3.43Å; M543-I595 VanDerWaalsContact CB-CG2 3.43Å; M543-I595 WeakPolarHBondContact CE-O 3.1Å; M543-I595 HydrophobicContact CG-CG2 3.68Å; M543-V597 HydrophobicContact CB-CG2 4.06Å; M543-V597 HydrophobicContact CE-CG2 3.85Å; M543-V597 HydrophobicContact SD-CG2 4.45Å; M543-S672 WeakPolarHBondContact CB-OG 3.4Å; M543-S672 PolarHBondContact O-OG 3.05Å
544	P	87.6	Confident	91.4	Very high	42 Å²	42	40.7 Å²	40.7	27%	0.273	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	cis	-80.9	-15.5	21	-20	35.1	0	0	0	121.9	N546 V597 P670	P544-N546 PolarHBondContact O-N 3.28Å; P544-N546 VanDerWaalsContact O-N 3.13Å; P544-V597 HydrophobicContact CB-CG1 4.07Å; P544-V597 HydrophobicContact CB-CG2 4.06Å; P544-V597 HydrophobicContact CG-CG1 4.5Å; P544-V597 HydrophobicContact CG-CG2 4.42Å; P544-P670 WeakPolarHBondContact CG-O 3.3Å
545	P	89.9	Confident	91.3	Very high	46 Å²	46	42.5 Å²	42.5	30%	0.299	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-12.3	-169	26.2	-34.5	0	0	0	115.2	A542 M543 E547	A542-P545 HydrophobicContact CB-CG 3.94Å; M543-P545 VanDerWaalsContact C-CD 3.45Å; P545-E547 VanDerWaalsContact C-N 3.27Å; P545-E547 PolarHBondContact O-N 3.43Å
546	N	90.3	Very high	91	Very high	103 Å²	103	41.9 Å²	41.9	55%	0.551	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.6	34	-179.9	-167.3	71.2	0	0	0	113.8	A542 M543 P544	A542-N546 VanDerWaalsContact O-CA 3.25Å; A542-N546 WeakPolarHBondContact O-CA 3.34Å; A542-N546 PolarHBondContact O-N 3.35Å; M543-N546 HydrophobicContact SD-CB 3.74Å; P544-N546 PolarHBondContact O-N 3.28Å; P544-N546 VanDerWaalsContact O-N 3.13Å
547	E	90.4	Very high	90.2	Very high	58 Å²	58	42.6 Å²	42.6	27%	0.271	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	139	173.9	-63.4	-152	153.3	0	0	111.4	A542 P545 M577 K581	A542-E547 PolarHBondContact N-O 2.87Å; A542-E547 PolarHBondContact O-N 3.07Å; P545-E547 VanDerWaalsContact C-N 3.27Å; P545-E547 PolarHBondContact O-N 3.43Å; E547-M577 HydrophobicContact CB-CG 4.27Å; E547-M577 HydrophobicContact CB-SD 3.87Å; E547-K581 HydrophobicContact CG-CD 4.49Å; E547-K581 WeakPolarHBondContact OE1-CD 3.42Å; E547-K581 WeakPolarHBondContact OE1-CE 3.27Å; E547-K581 IonicContact OE1-NZ 3.84Å; E547-K581 PolarHBondContact OE1-NZ 3.26Å; E547-K581 WeakPolarHBondContact OE2-CD 3.4Å; E547-K581 IonicContact OE2-NZ 3.7Å; E547-K581 PolarHBondContact OE2-NZ 3.27Å
548	T	92.1	Very high	89.5	Confident	84 Å²	84	47.9 Å²	47.9	52%	0.515	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	126.8	178.2	56.7	0	0	0	0	111.4	I540 L541	I540-T548 CarbonylContact O-C 3.56Å; I540-T548 VanDerWaalsContact O-CA 3.31Å; I540-T548 WeakPolarHBondContact O-CA 3.35Å; L541-T548 HydrophobicContact CD1-CG2 3.62Å
549	C	91.6	Very high	89.1	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.02	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	172.6	173.2	65.2	0	0	0	0	111.9	K539 I540 V574 T575 M577 F588	K539-C549 WeakPolarHBondContact CA-O 3.32Å; I540-C549 WeakPolarHBondContact CG1-SG 3.32Å; I540-C549 PolarHBondContact N-O 2.97Å; I540-C549 PolarHBondContact O-N 3.28Å; C549-V574 HydrophobicContact CB-CB 4.49Å; C549-T575 CarbonylContact C-O 3.59Å; C549-T575 WeakPolarHBondContact CA-O 3.1Å; C549-T575 WeakPolarHBondContact CB-O 3.37Å; C549-M577 HydrophobicContact CB-CB 4.05Å; C549-F588 VanDerWaalsContact SG-CE1 3.59Å
550	T	92.6	Very high	88.8	Confident	48 Å²	48	48.4 Å²	48.4	29%	0.294	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	133	-179.1	44.2	0	0	0	0	109.6	D538 K539 V574 T575	D538-T550 WeakPolarHBondContact O-CA 3.21Å; K539-T550 HydrophobicContact CG-CG2 3.91Å; T550-V574 CarbonylContact O-C 3.45Å; T550-V574 WeakPolarHBondContact O-CA 2.99Å; T550-T575 PolarHBondContact N-O 3.17Å; T550-T575 PolarHBondContact O-N 2.96Å; T550-T575 PolarHBondContact OG1-O 3.02Å; T550-T575 PolarHBondContact OG1-OG1 3.48Å
551	V	92.9	Very high	88.4	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	118.8	174	178.7	0	0	0	0	109	I534 G537 D538 I540 G553 I554 L572 V574	I534-V551 HydrophobicContact CD1-CG2 3.66Å; I534-V551 HydrophobicContact CG1-CG2 4.39Å; G537-V551 WeakPolarHBondContact CA-O 3.45Å; G537-V551 PolarHBondContact N-O 2.73Å; D538-V551 PolarHBondContact O-N 2.56Å; D538-V551 VanDerWaalsContact O-N 3.08Å; I540-V551 HydrophobicContact CD1-CG2 3.88Å; V551-G553 WeakPolarHBondContact CG1-O 3.4Å; V551-I554 HydrophobicContact CG1-CG1 3.76Å; V551-L572 HydrophobicContact CG1-CD2 4.35Å; V551-L572 HydrophobicContact CG2-CD1 4.26Å; V551-V574 HydrophobicContact CG2-CG1 4.22Å
552	K	91.4	Very high	88.1	Confident	107 Å²	107	54.2 Å²	54.2	47%	0.465	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-42.7	170.1	-79.6	-175.4	171.9	175.3	0	111.7	S521 T573 T575	S521-K552 PolarHBondContact O-NZ 3.21Å; S521-K552 PolarHBondContact OG-NZ 2.72Å; K552-T573 PolarHBondContact N-O 3.1Å; K552-T575 HydrophobicContact CD-CG2 3.76Å; K552-T575 VanDerWaalsContact CE-CG2 3.42Å; K552-T575 WeakPolarHBondContact CE-OG1 3.44Å; K552-T575 HydrophobicContact CG-CG2 4.35Å
553	G	89.8	Confident	87.8	Confident	20 Å²	20	54.5 Å²	54.5	21%	0.206	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	153	-175	0	0	0	0	0	111.2	V551 T573	V551-G553 WeakPolarHBondContact CG1-O 3.4Å; G553-T573 PolarHBondContact N-O 3Å; G553-T573 PolarHBondContact O-N 2.92Å
554	I	91.4	Very high	87.7	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	126.8	172.2	-52.9	164.7	0	0	0	105.4	I534 T536 V551 L561 A564 V570 L572	I534-I554 HydrophobicContact CG2-CD1 4.07Å; T536-I554 HydrophobicContact CG2-CD1 4.2Å; T536-I554 HydrophobicContact CG2-CG1 4.13Å; V551-I554 HydrophobicContact CG1-CG1 3.76Å; I554-L561 WeakPolarHBondContact CB-O 3.09Å; I554-L561 PolarHBondContact O-N 2.95Å; I554-A564 HydrophobicContact CG2-CB 4.01Å; I554-V570 HydrophobicContact CG2-CB 4.11Å; I554-V570 HydrophobicContact CG2-CG1 3.97Å; I554-L572 HydrophobicContact CB-CD2 4.18Å; I554-L572 HydrophobicContact CG1-CD2 3.76Å; I554-L572 HydrophobicContact CG2-CD2 3.93Å
555	T	88.9	Confident	87.8	Confident	39 Å²	39	51.7 Å²	51.7	24%	0.239	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	146.1	167.9	47.3	0	0	0	0	110.2	E559 A560 V570 S571	T555-E559 CarbonylContact C-O 3.58Å; T555-E559 VanDerWaalsContact CA-O 3.28Å; T555-E559 WeakPolarHBondContact CA-O 3.47Å; T555-A560 HydrophobicContact CG2-CB 4.21Å; T555-V570 WeakPolarHBondContact O-CA 3.37Å; T555-S571 PolarHBondContact N-O 2.96Å; T555-S571 PolarHBondContact O-N 3.09Å; T555-S571 VanDerWaalsContact OG1-CB 3.23Å; T555-S571 WeakPolarHBondContact OG1-CB 3.02Å; T555-S571 PolarHBondContact OG1-O 2.95Å
556	L	84.6	Confident	87.7	Confident	10 Å²	10	49.5 Å²	49.5	5%	0.052	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	106.3	179	177.9	132.3	0	0	0	107.5	D558 E559 L561 D568 H569 V570	L556-D558 PolarHBondContact O-N 2.91Å; L556-E559 PolarHBondContact N-O 2.74Å; L556-E559 PolarHBondContact O-N 3.07Å; L556-L561 HydrophobicContact CB-CD1 3.58Å; L556-L561 HydrophobicContact CB-CG 4.46Å; L556-L561 HydrophobicContact CD1-CD1 4.47Å; L556-L561 HydrophobicContact CD2-CD1 4.26Å; L556-L561 HydrophobicContact CG-CD1 4.31Å; L556-D568 HydrophobicContact CD1-CB 3.81Å; L556-H569 WeakPolarHBondContact CD1-O 3.5Å; L556-V570 HydrophobicContact CD1-CG1 4.19Å
557	H	75.7	Confident	87.4	Confident	62 Å²	62	44.7 Å²	44.7	29%	0.287	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	56.3	-172.8	-50.6	-70.3	0	0	0	111.7	K352 T361 E559	K352-H557 HydrophobicContact CD-CB 3.97Å; T361-H557 PolarHBondContact OG1-NE2 2.96Å; H557-E559 PolarHBondContact O-N 2.79Å
558	D	76.5	Confident	87.3	Confident	160 Å²	160	42.4 Å²	42.4	86%	0.856	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	62	-6.5	-178.6	-52.6	-45	0	0	0	117.6	L556	L556-D558 PolarHBondContact O-N 2.91Å
559	E	82.6	Confident	87.1	Confident	107 Å²	107	39.2 Å²	39.2	50%	0.5	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	125.9	168.7	-65.7	172.8	-151.9	0	0	110.6	K352 T555 L556 H557	K352-E559 IonicContact NZ-OE1 3.74Å; K352-E559 PolarHBondContact NZ-OE1 2.65Å; T555-E559 CarbonylContact C-O 3.58Å; T555-E559 VanDerWaalsContact CA-O 3.28Å; T555-E559 WeakPolarHBondContact CA-O 3.47Å; L556-E559 PolarHBondContact N-O 2.74Å; L556-E559 PolarHBondContact O-N 3.07Å; H557-E559 PolarHBondContact O-N 2.79Å
560	A	85.2	Confident	87	Confident	87 Å²	87	39.3 Å²	39.3	72%	0.719	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	127.7	176.8	0	0	0	0	0	111.8	T555	T555-A560 HydrophobicContact CG2-CB 4.21Å
561	L	85.6	Confident	86.9	Confident	31 Å²	31	38.5 Å²	38.5	16%	0.162	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	142.7	-171.6	-62.5	-177.8	0	0	0	112.1	I554 L556 W563	I554-L561 WeakPolarHBondContact CB-O 3.09Å; I554-L561 PolarHBondContact O-N 2.95Å; L556-L561 HydrophobicContact CB-CD1 3.58Å; L556-L561 HydrophobicContact CB-CG 4.46Å; L556-L561 HydrophobicContact CD1-CD1 4.47Å; L556-L561 HydrophobicContact CD2-CD1 4.26Å; L556-L561 HydrophobicContact CG-CD1 4.31Å; L561-W563 VanDerWaalsContact C-N 3.3Å; L561-W563 PolarHBondContact O-N 3.2Å
562	D	87.1	Confident	86.9	Confident	107 Å²	107	38.4 Å²	38.4	57%	0.572	22%	0.215	S	C	*	.	S	Bend	trans	-77.7	-12	175.7	-71.7	-55.8	0	0	0	114.5	Q535 T536	Q535-D562 CarbonylContact C-O 3.59Å; Q535-D562 WeakPolarHBondContact CA-O 3.35Å; T536-D562 PolarHBondContact N-O 3.5Å; T536-D562 PolarHBondContact OG1-O 3.49Å
563	W	87.1	Confident	86.9	Confident	6 Å²	6	34.8 Å²	34.8	2%	0.023	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	160.2	-176.3	66.5	-98.5	0	0	0	111.7	I267 E270 L271 R274 I534 Q535 L561 V565	I267-W563 HydrophobicContact CG2-CE3 4.4Å; I267-W563 HydrophobicContact CG2-CZ3 4.33Å; E270-W563 HydrophobicContact CB-CZ2 3.96Å; E270-W563 HydrophobicContact CG-CZ2 3.64Å; L271-W563 HydrophobicContact CB-CH2 4.17Å; L271-W563 HydrophobicContact CD1-CH2 4.04Å; L271-W563 HydrophobicContact CD1-CZ3 4.35Å; R274-W563 HydrophobicContact CB-CZ2 4.39Å; R274-W563 VanDerWaalsContact CD-CZ2 3.41Å; R274-W563 HydrophobicContact CG-CH2 4.45Å; R274-W563 HydrophobicContact CG-CZ2 3.88Å; R274-W563 VanDerWaalsContact NH1-CD2 3.3Å; R274-W563 VanDerWaalsContact NH1-CE2 3.31Å; R274-W563 PolarHBondContact NH1-O 3.5Å; R274-W563 VanDerWaalsContact NH2-CD1 3.28Å; R274-W563 PolarHBondContact NH2-O 3.47Å; I534-W563 CarbonylContact O-C 3.57Å; I534-W563 WeakPolarHBondContact O-CA 3.43Å; I534-W563 WeakPolarHBondContact O-CB 3.45Å; Q535-W563 HydrophobicContact CB-CB 4.48Å; Q535-W563 HydrophobicContact CG-CB 3.95Å; L561-W563 VanDerWaalsContact C-N 3.3Å; L561-W563 PolarHBondContact O-N 3.2Å; W563-V565 HydrophobicContact CE3-CG1 3.98Å; W563-V565 HydrophobicContact CZ3-CB 4.42Å; W563-V565 HydrophobicContact CZ3-CG1 3.6Å; W563-V565 HydrophobicContact CZ3-CG2 4.18Å
564	A	88.1	Confident	87	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	165.1	171.5	0	0	0	0	0	112.1	I529 F533 I534 I554 D568 V570	I529-A564 HydrophobicContact CD1-CB 3.63Å; F533-A564 CarbonylContact C-O 3.59Å; F533-A564 VanDerWaalsContact CA-O 3.27Å; F533-A564 WeakPolarHBondContact CA-O 3.08Å; F533-A564 WeakPolarHBondContact CB-O 3.35Å; I534-A564 HydrophobicContact CG2-CB 4.27Å; I534-A564 PolarHBondContact N-O 3.02Å; I534-A564 PolarHBondContact O-N 3.28Å; I554-A564 HydrophobicContact CG2-CB 4.01Å; A564-D568 WeakPolarHBondContact CA-OD2 3.45Å; A564-D568 HydrophobicContact CB-CB 4.42Å; A564-D568 WeakPolarHBondContact CB-OD2 3.49Å; A564-V570 HydrophobicContact CB-CG1 3.62Å
565	V	88.9	Confident	87	Confident	3 Å²	3	35.1 Å²	35.1	2%	0.018	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	164.9	-174.1	-72.2	0	0	0	0	114	I267 L271 I504 F533 W563 G567 D568	I267-V565 HydrophobicContact CG2-CG1 3.38Å; L271-V565 HydrophobicContact CD1-CG2 3.79Å; I504-V565 HydrophobicContact CG1-CB 4.48Å; I504-V565 HydrophobicContact CG2-CG1 4.3Å; F533-V565 HydrophobicContact CB-CG1 3.98Å; W563-V565 HydrophobicContact CE3-CG1 3.98Å; W563-V565 HydrophobicContact CZ3-CB 4.42Å; W563-V565 HydrophobicContact CZ3-CG1 3.6Å; W563-V565 HydrophobicContact CZ3-CG2 4.18Å; V565-G567 PolarHBondContact O-N 3.25Å; V565-D568 WeakPolarHBondContact CG2-OD1 3.33Å; V565-D568 WeakPolarHBondContact CG2-OD2 3.32Å; V565-D568 PolarHBondContact N-OD2 3.02Å; V565-D568 VanDerWaalsContact O-CB 3.23Å; V565-D568 WeakPolarHBondContact O-CB 3.18Å; V565-D568 PolarHBondContact O-N 3.05Å
566	A	88.3	Confident	86.8	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.008	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	124.9	169.1	0	0	0	0	0	112.8	R502 I529 G532	R502-A566 HydrophobicContact CB-CB 4.45Å; R502-A566 WeakPolarHBondContact CB-O 3.49Å; R502-A566 VanDerWaalsContact CD-O 3.22Å; R502-A566 WeakPolarHBondContact CD-O 3.45Å; R502-A566 VanDerWaalsContact CG-O 3.23Å; R502-A566 WeakPolarHBondContact CG-O 3.32Å; I529-A566 HydrophobicContact CG2-CB 4.4Å; I529-A566 CarbonylContact O-C 3.54Å; I529-A566 WeakPolarHBondContact O-CA 3.37Å; G532-A566 PolarHBondContact O-N 2.85Å
567	G	85.4	Confident	86.8	Confident	2 Å²	2	36.7 Å²	36.7	2%	0.021	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	112.6	-34.9	-171.9	0	0	0	0	0	112.9	N282 I529 V565	N282-G567 PolarHBondContact ND2-O 2.96Å; N282-G567 VanDerWaalsContact ND2-O 3.07Å; I529-G567 PolarHBondContact O-N 3.12Å; V565-G567 PolarHBondContact O-N 3.25Å
568	D	87.1	Confident	87.3	Confident	9 Å²	9	38 Å²	38	5%	0.048	23%	0.231	C	C	.	.			trans	-68.9	139.1	-173.9	-59.3	-4.5	0	0	0	111.7	L280 K528 I529 L556 A564 V565 V570	L280-D568 WeakPolarHBondContact CD1-OD1 3.15Å; K528-D568 WeakPolarHBondContact CA-O 3.27Å; I529-D568 HydrophobicContact CD1-CB 4.48Å; I529-D568 PolarHBondContact N-O 2.88Å; L556-D568 HydrophobicContact CD1-CB 3.81Å; A564-D568 WeakPolarHBondContact CA-OD2 3.45Å; A564-D568 HydrophobicContact CB-CB 4.42Å; A564-D568 WeakPolarHBondContact CB-OD2 3.49Å; V565-D568 WeakPolarHBondContact CG2-OD1 3.33Å; V565-D568 WeakPolarHBondContact CG2-OD2 3.32Å; V565-D568 PolarHBondContact N-OD2 3.02Å; V565-D568 VanDerWaalsContact O-CB 3.23Å; V565-D568 WeakPolarHBondContact O-CB 3.18Å; V565-D568 PolarHBondContact O-N 3.05Å; D568-V570 HydrophobicContact CB-CG1 3.92Å
569	H	87.5	Confident	87.8	Confident	18 Å²	18	33.5 Å²	33.5	8%	0.083	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	117.8	164.4	-75.9	-101.6	0	0	0	108.3	N282 M363 Q381 L556	N282-H569 VanDerWaalsContact CB-NE2 3.34Å; N282-H569 WeakPolarHBondContact CB-NE2 3.41Å; N282-H569 PolarHBondContact ND2-CD2 3.32Å; N282-H569 PolarHBondContact ND2-NE2 2.65Å; N282-H569 PolarHBondContact OD1-NE2 2.67Å; M363-H569 WeakPolarHBondContact CE-CE1 3.07Å; M363-H569 WeakPolarHBondContact CE-NE2 3.09Å; Q381-H569 WeakPolarHBondContact CB-CE1 3.34Å; Q381-H569 VanDerWaalsContact CG-CE1 3.47Å; Q381-H569 WeakPolarHBondContact CG-CE1 3.29Å; Q381-H569 PolarHBondContact O-NE2 2.96Å; Q381-H569 PolarHBondContact OE1-CE1 3.02Å; L556-H569 WeakPolarHBondContact CD1-O 3.5Å
570	V	89.9	Confident	88	Confident	4 Å²	4	35.7 Å²	35.7	2%	0.024	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	148.7	-171.6	-65	0	0	0	0	112.5	L510 T526 G527 I529 I554 T555 L556 A564 D568 L572	L510-V570 HydrophobicContact CD1-CG2 3.78Å; T526-V570 CarbonylContact C-O 3.58Å; T526-V570 WeakPolarHBondContact CA-O 3.31Å; G527-V570 PolarHBondContact N-O 3.25Å; G527-V570 PolarHBondContact O-N 3.16Å; I529-V570 HydrophobicContact CD1-CG1 4.24Å; I529-V570 HydrophobicContact CD1-CG2 4.01Å; I529-V570 HydrophobicContact CG1-CG2 3.89Å; I554-V570 HydrophobicContact CG2-CB 4.11Å; I554-V570 HydrophobicContact CG2-CG1 3.97Å; T555-V570 WeakPolarHBondContact O-CA 3.37Å; L556-V570 HydrophobicContact CD1-CG1 4.19Å; A564-V570 HydrophobicContact CB-CG1 3.62Å; D568-V570 HydrophobicContact CB-CG1 3.92Å; V570-L572 HydrophobicContact CB-CD2 4.39Å; V570-L572 HydrophobicContact CG2-CD2 4Å; V570-L572 HydrophobicContact CG2-CG 4.14Å
571	S	91.8	Very high	88.1	Confident	31 Å²	31	35.2 Å²	35.2	22%	0.217	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	111.7	168.5	-76.2	0	0	0	0	108	T555	T555-S571 PolarHBondContact N-O 2.96Å; T555-S571 PolarHBondContact O-N 3.09Å; T555-S571 VanDerWaalsContact OG1-CB 3.23Å; T555-S571 WeakPolarHBondContact OG1-CB 3.02Å; T555-S571 PolarHBondContact OG1-O 2.95Å
572	L	91.7	Very high	88.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	115.7	-178.3	-64.4	-168.3	0	0	0	111.1	L510 C524 V525 I534 I540 V551 I554 V570 V574	L510-L572 HydrophobicContact CD1-CD1 3.45Å; L510-L572 VanDerWaalsContact CD1-CD1 3.45Å; L510-L572 HydrophobicContact CD1-CG 4.01Å; C524-L572 CarbonylContact C-O 3.58Å; C524-L572 WeakPolarHBondContact CA-O 3.48Å; V525-L572 PolarHBondContact N-O 2.87Å; V525-L572 PolarHBondContact O-N 3.46Å; I534-L572 HydrophobicContact CD1-CD1 4.24Å; I540-L572 HydrophobicContact CD1-CD1 4.24Å; V551-L572 HydrophobicContact CG1-CD2 4.35Å; V551-L572 HydrophobicContact CG2-CD1 4.26Å; I554-L572 HydrophobicContact CB-CD2 4.18Å; I554-L572 HydrophobicContact CG1-CD2 3.76Å; I554-L572 HydrophobicContact CG2-CD2 3.93Å; V570-L572 HydrophobicContact CB-CD2 4.39Å; V570-L572 HydrophobicContact CG2-CD2 4Å; V570-L572 HydrophobicContact CG2-CG 4.14Å; L572-V574 HydrophobicContact CB-CG1 4.07Å; L572-V574 PolarHBondContact O-N 2.71Å
573	T	91.9	Very high	88.2	Confident	32 Å²	32	33.6 Å²	33.6	20%	0.196	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	108.4	167.1	-39.9	0	0	0	0	109	K552 G553	K552-T573 PolarHBondContact N-O 3.1Å; G553-T573 PolarHBondContact N-O 3Å; G553-T573 PolarHBondContact O-N 2.92Å
574	V	91.6	Very high	88.3	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	150.8	-174.5	-70	0	0	0	0	113.1	F523 V525 I540 C549 T550 V551 L572	F523-V574 HydrophobicContact CD1-CG2 4.3Å; F523-V574 HydrophobicContact CD2-CG2 3.73Å; F523-V574 HydrophobicContact CE1-CG2 3.94Å; F523-V574 HydrophobicContact CE2-CG2 3.34Å; F523-V574 HydrophobicContact CG-CG2 4.2Å; F523-V574 HydrophobicContact CZ-CG2 3.46Å; F523-V574 VanDerWaalsContact CZ-CG2 3.46Å; F523-V574 PolarHBondContact N-O 3.35Å; F523-V574 PolarHBondContact O-N 3.34Å; V525-V574 HydrophobicContact CG2-CG2 3.79Å; I540-V574 HydrophobicContact CD1-CG1 4.36Å; C549-V574 HydrophobicContact CB-CB 4.49Å; T550-V574 CarbonylContact O-C 3.45Å; T550-V574 WeakPolarHBondContact O-CA 2.99Å; V551-V574 HydrophobicContact CG2-CG1 4.22Å; L572-V574 HydrophobicContact CB-CG1 4.07Å; L572-V574 PolarHBondContact O-N 2.71Å
575	T	90.7	Very high	88.2	Confident	28 Å²	28	37.2 Å²	37.2	17%	0.172	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	154.5	174.1	45.9	0	0	0	0	114.3	S521 C549 T550 K552	S521-T575 WeakPolarHBondContact O-CG2 3.26Å; C549-T575 CarbonylContact C-O 3.59Å; C549-T575 WeakPolarHBondContact CA-O 3.1Å; C549-T575 WeakPolarHBondContact CB-O 3.37Å; T550-T575 PolarHBondContact N-O 3.17Å; T550-T575 PolarHBondContact O-N 2.96Å; T550-T575 PolarHBondContact OG1-O 3.02Å; T550-T575 PolarHBondContact OG1-OG1 3.48Å; K552-T575 HydrophobicContact CD-CG2 3.76Å; K552-T575 VanDerWaalsContact CE-CG2 3.42Å; K552-T575 WeakPolarHBondContact CE-OG1 3.44Å; K552-T575 HydrophobicContact CG-CG2 4.35Å
576	G	84.9	Confident	88.2	Confident	65 Å²	65	37.3 Å²	37.3	67%	0.67	22%	0.219	S	C	*	.	S	Bend	trans	99.6	11.6	-178	0	0	0	0	0	114.5
577	M	84.5	Confident	88.4	Confident	17 Å²	17	37.4 Å²	37.4	8%	0.084	22%	0.219	C	C	.	.	S	Bend	trans	-138.6	158.7	176.6	179	162.1	69.9	0	0	108.9	F523 A542 E547 C549 I582 F588	F523-M577 HydrophobicContact CE1-CB 4.36Å; F523-M577 WeakPolarHBondContact CE1-O 3.44Å; F523-M577 HydrophobicContact CE2-CE 4.32Å; F523-M577 HydrophobicContact CZ-CB 4.24Å; F523-M577 HydrophobicContact CZ-CE 3.74Å; F523-M577 HydrophobicContact CZ-CG 4.38Å; A542-M577 HydrophobicContact CB-CE 3.85Å; A542-M577 HydrophobicContact CB-SD 3.71Å; E547-M577 HydrophobicContact CB-CG 4.27Å; E547-M577 HydrophobicContact CB-SD 3.87Å; C549-M577 HydrophobicContact CB-CB 4.05Å; M577-I582 HydrophobicContact CE-CB 3.92Å; M577-I582 HydrophobicContact CE-CD1 3.92Å; M577-I582 HydrophobicContact CE-CG1 4.32Å; M577-I582 HydrophobicContact CE-CG2 4.44Å; M577-F588 HydrophobicContact CE-CE1 3.88Å; M577-F588 HydrophobicContact CE-CZ 4.16Å
578	D	86.7	Confident	88.8	Confident	89 Å²	89	37.3 Å²	37.3	48%	0.476	22%	0.218	S	C	.	.			trans	-93.5	135.3	175.6	-60.4	-61.4	0	0	0	111	I580 K581	D578-I580 PolarHBondContact O-N 3.24Å; D578-I580 VanDerWaalsContact O-N 3.09Å; D578-K581 HydrophobicContact CB-CD 4.14Å; D578-K581 HydrophobicContact CB-CG 4.26Å; D578-K581 PolarHBondContact O-N 3.33Å; D578-K581 WeakPolarHBondContact OD2-CE 3.46Å; D578-K581 IonicContact OD2-NZ 3.34Å; D578-K581 PolarHBondContact OD2-NZ 3.47Å
579	I	86.5	Confident	89	Confident	67 Å²	67	36.9 Å²	36.9	34%	0.344	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-26.3	-179.7	-165.4	171.1	0	0	0	113.1	V515 K517 F523 K581 I582	V515-I579 HydrophobicContact CG1-CD1 4.21Å; V515-I579 HydrophobicContact CG1-CG1 3.84Å; K517-I579 HydrophobicContact CB-CD1 3.97Å; F523-I579 HydrophobicContact CB-CD1 4Å; F523-I579 HydrophobicContact CB-CG1 4.37Å; F523-I579 HydrophobicContact CD1-CB 4.37Å; F523-I579 HydrophobicContact CD2-CG1 4.41Å; F523-I579 HydrophobicContact CG-CB 4.34Å; F523-I579 HydrophobicContact CG-CD1 4.47Å; F523-I579 HydrophobicContact CG-CG1 4.31Å; I579-K581 VanDerWaalsContact C-N 3.28Å; I579-K581 PolarHBondContact O-N 3.12Å; I579-I582 VanDerWaalsContact O-CG2 3.28Å; I579-I582 WeakPolarHBondContact O-CG2 3.43Å
580	I	88.4	Confident	89.2	Confident	152 Å²	152	37.9 Å²	37.9	78%	0.779	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-22.5	-179.4	-58.4	169.8	0	0	0	112.4	D578	D578-I580 PolarHBondContact O-N 3.24Å; D578-I580 VanDerWaalsContact O-N 3.09Å
581	K	86.9	Confident	89.2	Confident	77 Å²	77	40.3 Å²	40.3	34%	0.335	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-25.2	-174.5	-61.6	173.8	-169.3	161.5	0	113.5	E547 D578 I579	E547-K581 HydrophobicContact CG-CD 4.49Å; E547-K581 WeakPolarHBondContact OE1-CD 3.42Å; E547-K581 WeakPolarHBondContact OE1-CE 3.27Å; E547-K581 IonicContact OE1-NZ 3.84Å; E547-K581 PolarHBondContact OE1-NZ 3.26Å; E547-K581 WeakPolarHBondContact OE2-CD 3.4Å; E547-K581 IonicContact OE2-NZ 3.7Å; E547-K581 PolarHBondContact OE2-NZ 3.27Å; D578-K581 HydrophobicContact CB-CD 4.14Å; D578-K581 HydrophobicContact CB-CG 4.26Å; D578-K581 PolarHBondContact O-N 3.33Å; D578-K581 WeakPolarHBondContact OD2-CE 3.46Å; D578-K581 IonicContact OD2-NZ 3.34Å; D578-K581 PolarHBondContact OD2-NZ 3.47Å; I579-K581 VanDerWaalsContact C-N 3.28Å; I579-K581 PolarHBondContact O-N 3.12Å
582	I	87.6	Confident	89	Confident	8 Å²	8	47.2 Å²	47.2	4%	0.041	26%	0.264	C	S	.	.			trans	-83.3	143.5	172.4	-173.3	174.7	0	0	0	109.1	V512 V515 F523 V525 M577 I579 C586 F588	V512-I582 HydrophobicContact CG1-CD1 4.5Å; V512-I582 HydrophobicContact CG2-CD1 4.32Å; V515-I582 HydrophobicContact CG1-CG2 3.82Å; V515-I582 HydrophobicContact CG2-CD1 3.87Å; V515-I582 HydrophobicContact CG2-CG1 3.98Å; V515-I582 HydrophobicContact CG2-CG2 4.29Å; F523-I582 HydrophobicContact CE2-CD1 4.12Å; F523-I582 HydrophobicContact CE2-CG2 3.78Å; F523-I582 HydrophobicContact CZ-CG2 4.16Å; V525-I582 HydrophobicContact CG1-CD1 4.05Å; V525-I582 HydrophobicContact CG2-CD1 3.76Å; M577-I582 HydrophobicContact CE-CB 3.92Å; M577-I582 HydrophobicContact CE-CD1 3.92Å; M577-I582 HydrophobicContact CE-CG1 4.32Å; M577-I582 HydrophobicContact CE-CG2 4.44Å; I579-I582 VanDerWaalsContact O-CG2 3.28Å; I579-I582 WeakPolarHBondContact O-CG2 3.43Å; I582-C586 HydrophobicContact CG1-CB 4.17Å; I582-F588 HydrophobicContact CD1-CE1 4.44Å; I582-F588 HydrophobicContact CD1-CE2 4.31Å; I582-F588 HydrophobicContact CD1-CZ 3.74Å
583	N	87.6	Confident	88.8	Confident	97 Å²	97	52 Å²	52	52%	0.519	29%	0.287	S	S	.	.			trans	-136	157.2	176.7	-72.4	-96.2	0	0	0	108.6	G585 C586	N583-G585 PolarHBondContact O-N 2.81Å; N583-C586 PolarHBondContact N-SG 2.97Å; N583-C586 VanDerWaalsContact N-SG 3.39Å; N583-C586 VanDerWaalsContact O-CB 3.32Å; N583-C586 WeakPolarHBondContact O-CB 3.3Å; N583-C586 PolarHBondContact O-N 2.85Å; N583-C586 PolarHBondContact O-SG 3.02Å
584	V	87.9	Confident	88.6	Confident	69 Å²	69	53.5 Å²	53.5	42%	0.418	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	136.4	166	177	0	0	0	0	109.3	S513	S513-V584 VanDerWaalsContact O-CG1 3.3Å; S513-V584 WeakPolarHBondContact O-CG1 3.28Å; S513-V584 WeakPolarHBondContact O-CG2 3.41Å
585	G	85.5	Confident	88.5	Confident	13 Å²	13	53.6 Å²	53.6	13%	0.134	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	-1.6	-173.4	0	0	0	0	0	115.9	V512 N583 T626	V512-G585 PolarHBondContact O-N 3.17Å; V512-G585 VanDerWaalsContact O-N 3.14Å; N583-G585 PolarHBondContact O-N 2.81Å; G585-T626 WeakPolarHBondContact CA-OG1 3.12Å
586	C	90.5	Very high	88.4	Confident	5 Å²	5	61 Å²	61	3%	0.034	32%	0.322	C	S	.	.			trans	-63.6	151.5	163.5	-70.4	0	0	0	0	110.7	V512 I582 N583	V512-C586 HydrophobicContact CB-CB 4.44Å; V512-C586 VanDerWaalsContact CB-O 3.32Å; V512-C586 WeakPolarHBondContact CB-O 3.36Å; V512-C586 HydrophobicContact CG2-CB 4.21Å; V512-C586 WeakPolarHBondContact CG2-O 3.33Å; V512-C586 PolarHBondContact N-O 3.13Å; I582-C586 HydrophobicContact CG1-CB 4.17Å; N583-C586 PolarHBondContact N-SG 2.97Å; N583-C586 VanDerWaalsContact N-SG 3.39Å; N583-C586 VanDerWaalsContact O-CB 3.32Å; N583-C586 WeakPolarHBondContact O-CB 3.3Å; N583-C586 PolarHBondContact O-N 2.85Å; N583-C586 PolarHBondContact O-SG 3.02Å
587	V	91.9	Very high	88.6	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.012	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	124.2	174.2	-179.1	0	0	0	0	108.4	L510 M543 I595	L510-V587 WeakPolarHBondContact O-CA 3.45Å; M543-V587 PolarHBondContact N-O 2.92Å; M543-V587 PolarHBondContact O-N 3.08Å; V587-I595 HydrophobicContact CB-CD1 4.34Å; V587-I595 HydrophobicContact CB-CG2 4.38Å; V587-I595 HydrophobicContact CG1-CD1 4.03Å; V587-I595 HydrophobicContact CG1-CG2 4.37Å; V587-I595 HydrophobicContact CG2-CD1 4.4Å
588	F	93.2	Very high	88.9	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	136.8	167.2	-70.1	-60.2	0	0	0	110.2	F508 R509 L510 V512 V525 I540 L541 A542 C549 M577 I582	F508-F588 HydrophobicContact CE1-CB 3.92Å; R509-F588 WeakPolarHBondContact CA-O 3.4Å; L510-F588 HydrophobicContact CB-CB 4.41Å; L510-F588 HydrophobicContact CD2-CD2 4.21Å; L510-F588 PolarHBondContact N-O 3Å; L510-F588 PolarHBondContact O-N 3.5Å; V512-F588 HydrophobicContact CG2-CD2 3.93Å; V512-F588 HydrophobicContact CG2-CE2 3.88Å; V525-F588 HydrophobicContact CB-CE2 4.03Å; V525-F588 HydrophobicContact CG1-CE2 3.72Å; V525-F588 HydrophobicContact CG1-CZ 4.39Å; V525-F588 HydrophobicContact CG2-CE2 4.2Å; V525-F588 HydrophobicContact CG2-CZ 4.19Å; I540-F588 HydrophobicContact CD1-CB 4.06Å; I540-F588 HydrophobicContact CD1-CD1 3.67Å; I540-F588 HydrophobicContact CD1-CD2 4.05Å; I540-F588 HydrophobicContact CD1-CE1 4Å; I540-F588 HydrophobicContact CD1-CE2 4.35Å; I540-F588 HydrophobicContact CD1-CG 3.7Å; I540-F588 HydrophobicContact CD1-CZ 4.34Å; I540-F588 HydrophobicContact CG1-CD1 3.94Å; I540-F588 HydrophobicContact CG1-CE1 4.34Å; I540-F588 HydrophobicContact CG1-CG 4.36Å; L541-F588 CarbonylContact O-C 3.53Å; L541-F588 WeakPolarHBondContact O-CA 3.45Å; A542-F588 HydrophobicContact CB-CD1 3.89Å; A542-F588 HydrophobicContact CB-CE1 3.75Å; C549-F588 VanDerWaalsContact SG-CE1 3.59Å; M577-F588 HydrophobicContact CE-CE1 3.88Å; M577-F588 HydrophobicContact CE-CZ 4.16Å; I582-F588 HydrophobicContact CD1-CE1 4.44Å; I582-F588 HydrophobicContact CD1-CE2 4.31Å; I582-F588 HydrophobicContact CD1-CZ 3.74Å
589	C	92.9	Very high	89.2	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	159.5	-179.2	54.5	0	0	0	0	113.2	F508 L541 I595	F508-C589 WeakPolarHBondContact O-CA 3.41Å; L541-C589 PolarHBondContact N-O 2.85Å; L541-C589 PolarHBondContact O-N 2.83Å; L541-C589 PolarHBondContact O-SG 2.8Å; L541-C589 VanDerWaalsContact O-SG 3.36Å; C589-I595 HydrophobicContact CB-CG2 4.31Å
590	D	91.4	Very high	89.5	Confident	39 Å²	39	57.3 Å²	57.3	21%	0.209	29%	0.287	C	S	.	.			trans	-61.9	126	168.8	-174.1	-36.3	0	0	0	109.6	F508 K592 E593	F508-D590 HydrophobicContact CB-CB 4.34Å; F508-D590 PolarHBondContact O-N 2.92Å; D590-K592 PolarHBondContact O-N 3.43Å; D590-K592 WeakPolarHBondContact OD1-CB 3.46Å; D590-K592 VanDerWaalsContact OD1-CG 3.24Å; D590-K592 WeakPolarHBondContact OD1-CG 3.49Å; D590-K592 PolarHBondContact OD1-N 2.87Å; D590-K592 IonicContact OD1-NZ 3.4Å; D590-K592 PolarHBondContact OD1-NZ 3.2Å; D590-K592 IonicContact OD2-NZ 2.73Å; D590-K592 PolarHBondContact OD2-NZ 2.75Å; D590-E593 CarbonylContact O-C 3.32Å; D590-E593 PolarHBondContact O-N 2.83Å
591	P	88.7	Confident	89.9	Confident	56 Å²	56	50.1 Å²	50.1	36%	0.364	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-16.3	178.7	-25.5	35	0	0	0	115.5	K539 L541	K539-P591 VanDerWaalsContact O-CD 3.26Å; K539-P591 WeakPolarHBondContact O-CD 3.31Å; K539-P591 WeakPolarHBondContact O-CG 3.43Å; L541-P591 HydrophobicContact CB-CG 4.29Å
592	K	88.5	Confident	90.2	Very high	175 Å²	175	49.8 Å²	49.8	76%	0.761	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-32.9	174.5	-59.6	176	-146.5	103.5	0	113.2	D590	D590-K592 PolarHBondContact O-N 3.43Å; D590-K592 WeakPolarHBondContact OD1-CB 3.46Å; D590-K592 VanDerWaalsContact OD1-CG 3.24Å; D590-K592 WeakPolarHBondContact OD1-CG 3.49Å; D590-K592 PolarHBondContact OD1-N 2.87Å; D590-K592 IonicContact OD1-NZ 3.4Å; D590-K592 PolarHBondContact OD1-NZ 3.2Å; D590-K592 IonicContact OD2-NZ 2.73Å; D590-K592 PolarHBondContact OD2-NZ 2.75Å
593	E	87.2	Confident	90.6	Very high	102 Å²	102	49.4 Å²	49.4	48%	0.477	25%	0.245	S	C	.	.	S	Bend	trans	-134.7	72.6	-176.6	-165.2	177.3	144.1	0	0	109.6	P507 R509 D590	P507-E593 HydrophobicContact CB-CB 4.39Å; P507-E593 HydrophobicContact CG-CB 4.4Å; P507-E593 VanDerWaalsContact CG-CD 3.5Å; P507-E593 HydrophobicContact CG-CG 4.43Å; P507-E593 VanDerWaalsContact CG-OE2 3.24Å; P507-E593 WeakPolarHBondContact CG-OE2 3.12Å; R509-E593 PolarHBondContact NH1-O 2.86Å; R509-E593 PolarHBondContact NH2-O 2.91Å; D590-E593 CarbonylContact O-C 3.32Å; D590-E593 PolarHBondContact O-N 2.83Å
594	P	88.1	Confident	90.8	Very high	62 Å²	62	48.8 Å²	48.8	40%	0.403	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-67.3	142.7	-176.2	29.2	-36.5	0	0	0	111.7	L541	L541-P594 HydrophobicContact CD2-CB 3.64Å
595	I	89.7	Confident	91.1	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.01	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-64.8	143.9	173.2	-177.4	158.6	0	0	0	110.7	M543 V587 C589 E674 L682	M543-I595 HydrophobicContact CB-CG2 3.43Å; M543-I595 VanDerWaalsContact CB-CG2 3.43Å; M543-I595 WeakPolarHBondContact CE-O 3.1Å; M543-I595 HydrophobicContact CG-CG2 3.68Å; V587-I595 HydrophobicContact CB-CD1 4.34Å; V587-I595 HydrophobicContact CB-CG2 4.38Å; V587-I595 HydrophobicContact CG1-CD1 4.03Å; V587-I595 HydrophobicContact CG1-CG2 4.37Å; V587-I595 HydrophobicContact CG2-CD1 4.4Å; C589-I595 HydrophobicContact CB-CG2 4.31Å; I595-E674 HydrophobicContact CD1-CG 3.65Å; I595-E674 HydrophobicContact CG1-CG 3.62Å; I595-L682 HydrophobicContact CD1-CD1 4.36Å
596	R	87.3	Confident	91.3	Very high	183 Å²	183	47.5 Å²	47.5	69%	0.691	22%	0.223	S	C	*	.	P	Polyproline II helix	trans	-80.7	130.9	178.6	-62.5	-173	-171.8	-167.8	3.2	110.7	L673	R596-L673 PolarHBondContact O-N 3.27Å
597	V	90.6	Very high	91.3	Very high	54 Å²	54	47.4 Å²	47.4	33%	0.327	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	129.1	174.5	172.7	0	0	0	0	108.3	M543 P544 P670 V671	M543-V597 HydrophobicContact CB-CG2 4.06Å; M543-V597 HydrophobicContact CE-CG2 3.85Å; M543-V597 HydrophobicContact SD-CG2 4.45Å; P544-V597 HydrophobicContact CB-CG1 4.07Å; P544-V597 HydrophobicContact CB-CG2 4.06Å; P544-V597 HydrophobicContact CG-CG1 4.5Å; P544-V597 HydrophobicContact CG-CG2 4.42Å; V597-P670 HydrophobicContact CG1-CB 3.61Å; V597-V671 WeakPolarHBondContact CA-O 3.31Å
598	C	90.4	Very high	91.1	Very high	6 Å²	6	48.1 Å²	48.1	4%	0.041	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	157.1	178.5	63.2	0	0	0	0	112.4	V671 I702 K703	C598-V671 PolarHBondContact N-O 2.92Å; C598-V671 PolarHBondContact O-N 3.44Å; C598-I702 HydrophobicContact CB-CG2 3.85Å; C598-K703 WeakPolarHBondContact CB-O 3.39Å
599	T	92	Very high	90.6	Very high	41 Å²	41	53.1 Å²	53.1	25%	0.252	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-12.2	167.4	62.7	0	0	0	0	112.1	Q666 T667 P670	T599-Q666 CarbonylContact O-C 3.59Å; T599-Q666 VanDerWaalsContact O-CA 3.24Å; T599-Q666 WeakPolarHBondContact O-CA 3.48Å; T599-T667 WeakPolarHBondContact CA-OG1 3.31Å; T599-T667 PolarHBondContact O-N 2.8Å; T599-T667 PolarHBondContact O-OG1 3.35Å; T599-P670 HydrophobicContact CG2-CB 4.09Å
600	R	94	Very high	90	Very high	60 Å²	60	54.3 Å²	54.3	23%	0.226	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	130.9	-168.6	-68.8	172.5	68.9	-151.4	0.4	110.9	E664 I665 Q666 K703 E704	R600-E664 IonicContact CZ-OE1 2.94Å; R600-E664 IonicContact NE-OE1 2.71Å; R600-E664 IonicContact NH2-OE1 3.11Å; R600-E664 PolarHBondContact NH2-OE1 2.62Å; R600-I665 WeakPolarHBondContact CA-O 3.4Å; R600-Q666 HydrophobicContact CG-CB 4.01Å; R600-Q666 HydrophobicContact CG-CG 3.87Å; R600-K703 HydrophobicContact CB-CB 4.29Å; R600-K703 CarbonylContact O-C 3.45Å; R600-K703 WeakPolarHBondContact O-CA 3.45Å; R600-K703 WeakPolarHBondContact O-CB 3.28Å; R600-K703 PolarHBondContact O-N 3.02Å; R600-E704 PolarHBondContact NH1-O 3.2Å
601	F	95.1	Very high	89.5	Confident	1 Å²	1	61.4 Å²	61.4	0%	0.004	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	162.2	178.3	58.6	-83.9	0	0	0	110.8	A603 L622 E664 I665 T667 L673 F685 V699	F601-A603 HydrophobicContact CD2-CB 4.13Å; F601-A603 HydrophobicContact CE2-CB 4.12Å; F601-L622 HydrophobicContact CE1-CD2 4.2Å; F601-L622 HydrophobicContact CZ-CD1 4.36Å; F601-L622 HydrophobicContact CZ-CD2 3.99Å; F601-E664 WeakPolarHBondContact O-CA 3.46Å; F601-I665 HydrophobicContact CE1-CB 4.21Å; F601-I665 HydrophobicContact CE1-CG2 4.12Å; F601-I665 HydrophobicContact CE2-CB 4.11Å; F601-I665 HydrophobicContact CE2-CD1 3.92Å; F601-I665 HydrophobicContact CE2-CG1 4.43Å; F601-I665 HydrophobicContact CZ-CB 3.92Å; F601-I665 HydrophobicContact CZ-CD1 4.12Å; F601-I665 HydrophobicContact CZ-CG2 3.9Å; F601-I665 PolarHBondContact N-O 3.47Å; F601-I665 VanDerWaalsContact N-O 3.16Å; F601-I665 PolarHBondContact O-N 3.41Å; F601-T667 HydrophobicContact CE1-CG2 4.23Å; F601-L673 HydrophobicContact CD1-CD1 3.39Å; F601-L673 HydrophobicContact CD2-CD1 4.47Å; F601-L673 HydrophobicContact CE1-CD1 3.45Å; F601-L673 VanDerWaalsContact CE1-CD1 3.45Å; F601-L673 HydrophobicContact CG-CD1 3.94Å; F601-L673 HydrophobicContact CZ-CD1 4.04Å; F601-F685 HydrophobicContact CE2-CD1 4.34Å; F601-F685 AromaticContact CE2-CE1 3.71Å; F601-F685 HydrophobicContact CE2-CE1 3.71Å; F601-F685 AromaticContact CE2-CZ 3.82Å; F601-F685 HydrophobicContact CE2-CZ 3.82Å; F601-V699 HydrophobicContact CD2-CG1 4.44Å; F601-V699 HydrophobicContact CD2-CG2 4.36Å; F601-V699 HydrophobicContact CE2-CG2 4.45Å
602	R	95	Very high	89.3	Confident	71 Å²	71	62.3 Å²	62.3	27%	0.268	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	136.4	167.6	-72.1	163.6	162.8	-178.2	-7.7	109.3	I637 V663 E664 T700 E701	R602-I637 HydrophobicContact CG-CD1 3.79Å; R602-I637 VanDerWaalsContact NE-CD1 3.34Å; R602-V663 VanDerWaalsContact CA-O 3.26Å; R602-V663 WeakPolarHBondContact CA-O 3.15Å; R602-E664 HydrophobicContact CG-CB 4.33Å; R602-E664 HydrophobicContact CG-CG 4.43Å; R602-E664 IonicContact NE-OE2 2.98Å; R602-T700 PolarHBondContact O-N 3.38Å; R602-T700 PolarHBondContact O-OG1 3.46Å; R602-E701 HydrophobicContact CB-CB 4.17Å; R602-E701 WeakPolarHBondContact CD-OE2 3.13Å; R602-E701 IonicContact CZ-OE2 2.7Å; R602-E701 PolarHBondContact N-O 2.68Å; R602-E701 IonicContact NE-OE2 3.4Å; R602-E701 IonicContact NH1-OE1 2.61Å; R602-E701 IonicContact NH1-OE2 3.37Å; R602-E701 PolarHBondContact NH1-OE2 3.02Å; R602-E701 PolarHBondContact O-N 3.34Å; R602-E701 VanDerWaalsContact O-N 3.09Å
603	A	94.6	Very high	89.4	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	150.7	179	0	0	0	0	0	111	F601 I662 V663 F685 V698	F601-A603 HydrophobicContact CD2-CB 4.13Å; F601-A603 HydrophobicContact CE2-CB 4.12Å; A603-I662 WeakPolarHBondContact O-CA 3.12Å; A603-V663 PolarHBondContact N-O 3.46Å; A603-V663 PolarHBondContact O-N 2.96Å; A603-F685 HydrophobicContact CB-CE1 3.45Å; A603-F685 VanDerWaalsContact CB-CE1 3.45Å; A603-F685 HydrophobicContact CB-CZ 3.35Å; A603-V698 CarbonylContact C-O 3.57Å; A603-V698 WeakPolarHBondContact CA-O 3.49Å; A603-V698 VanDerWaalsContact CB-O 3.3Å; A603-V698 WeakPolarHBondContact CB-O 3.46Å
604	R	93.1	Very high	89.6	Confident	83 Å²	83	52 Å²	52	31%	0.313	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	113.8	162.5	177.3	175.6	175	169.9	-2.5	107.6	L640 K642 N660 A661 V698 T700	R604-L640 HydrophobicContact CG-CD1 4.21Å; R604-K642 PolarHBondContact NH2-O 3.25Å; R604-N660 PolarHBondContact NH2-ND2 3.41Å; R604-A661 CarbonylContact C-O 3.56Å; R604-A661 WeakPolarHBondContact CA-O 3.3Å; R604-V698 PolarHBondContact N-O 3.32Å; R604-V698 PolarHBondContact O-N 2.61Å; R604-T700 HydrophobicContact CB-CG2 3.99Å
605	I	93.1	Very high	89.7	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	150.5	171.6	61.2	169.8	0	0	0	111	L607 I614 L655 N660 A661 V663 F685 L687 A695 A696	I605-L607 HydrophobicContact CD1-CD2 4.35Å; I605-L607 HydrophobicContact CD1-CG 4.44Å; I605-I614 HydrophobicContact CD1-CD1 4.48Å; I605-L655 HydrophobicContact CD1-CD1 4.05Å; I605-N660 CarbonylContact O-C 3.52Å; I605-N660 VanDerWaalsContact O-CA 3.28Å; I605-N660 WeakPolarHBondContact O-CA 3.27Å; I605-A661 HydrophobicContact CG1-CB 4.17Å; I605-A661 PolarHBondContact N-O 3.23Å; I605-A661 PolarHBondContact O-N 2.85Å; I605-V663 HydrophobicContact CD1-CG1 3.77Å; I605-V663 HydrophobicContact CD1-CG2 3.96Å; I605-V663 HydrophobicContact CG1-CG1 4.16Å; I605-V663 HydrophobicContact CG1-CG2 4.02Å; I605-V663 HydrophobicContact CG2-CG2 3.82Å; I605-F685 HydrophobicContact CG2-CE2 4.32Å; I605-F685 HydrophobicContact CG2-CZ 4.18Å; I605-L687 HydrophobicContact CG2-CD1 4.24Å; I605-A695 HydrophobicContact CB-CB 4.3Å; I605-A696 CarbonylContact C-O 3.52Å; I605-A696 VanDerWaalsContact CA-O 3.25Å; I605-A696 WeakPolarHBondContact CA-O 3.45Å
606	L	90.6	Very high	89.9	Confident	55 Å²	55	58.1 Å²	58.1	29%	0.288	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	120	168.7	179.1	150.4	0	0	0	107.6	F608 N660 A695 A696	L606-F608 HydrophobicContact CD2-CD1 3.71Å; L606-F608 HydrophobicContact CD2-CE1 3.53Å; L606-N660 WeakPolarHBondContact CA-OD1 3.17Å; L606-N660 VanDerWaalsContact CB-OD1 3.26Å; L606-N660 WeakPolarHBondContact CB-OD1 3.48Å; L606-N660 WeakPolarHBondContact CD1-OD1 3.43Å; L606-N660 VanDerWaalsContact CG-OD1 3.26Å; L606-N660 WeakPolarHBondContact CG-OD1 3.29Å; L606-A695 VanDerWaalsContact O-CA 3.22Å; L606-A695 WeakPolarHBondContact O-CA 3.26Å; L606-A695 VanDerWaalsContact O-CB 3.32Å; L606-A695 WeakPolarHBondContact O-CB 3.33Å; L606-A696 PolarHBondContact N-O 3.27Å; L606-A696 PolarHBondContact O-N 2.91Å; L606-A696 VanDerWaalsContact O-N 3.11Å
607	L	90.6	Very high	90.1	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	136.9	-176	-71.5	160	0	0	0	112.1	I605 I610 I614 L655 G658 M659 I694 A695	I605-L607 HydrophobicContact CD1-CD2 4.35Å; I605-L607 HydrophobicContact CD1-CG 4.44Å; L607-I610 HydrophobicContact CD2-CD1 3.88Å; L607-I614 HydrophobicContact CD2-CD1 3.37Å; L607-I614 HydrophobicContact CD2-CG1 4.07Å; L607-L655 HydrophobicContact CD1-CB 3.38Å; L607-L655 HydrophobicContact CD1-CD1 3.84Å; L607-L655 HydrophobicContact CD1-CG 4.23Å; L607-G658 WeakPolarHBondContact O-CA 3.35Å; L607-G658 PolarHBondContact O-N 3.4Å; L607-G658 VanDerWaalsContact O-N 3.11Å; L607-M659 WeakPolarHBondContact CB-O 3.39Å; L607-M659 HydrophobicContact CD1-CB 4.29Å; L607-M659 PolarHBondContact N-O 3.44Å; L607-I694 HydrophobicContact CD2-CG2 4.22Å; L607-A695 HydrophobicContact CD2-CB 3.88Å
608	F	87.8	Confident	90.2	Very high	18 Å²	18	49.7 Å²	49.7	8%	0.079	26%	0.258	C	S	.	.			trans	-85.9	-169.5	175.8	-57.5	-35.2	0	0	0	111.3	L411 L606 I610 K657 G658 T693 I694 A696	L411-F608 HydrophobicContact CD1-CD1 4.22Å; L411-F608 HydrophobicContact CD1-CE1 3.77Å; L411-F608 HydrophobicContact CD1-CZ 4.37Å; L411-F608 HydrophobicContact CD2-CB 4.27Å; L411-F608 HydrophobicContact CD2-CD1 3.51Å; L411-F608 HydrophobicContact CD2-CD2 4.23Å; L411-F608 HydrophobicContact CD2-CE1 3.73Å; L411-F608 HydrophobicContact CD2-CE2 4.43Å; L411-F608 HydrophobicContact CD2-CG 3.76Å; L411-F608 HydrophobicContact CD2-CZ 4.18Å; L411-F608 HydrophobicContact CG-CD1 3.92Å; L411-F608 HydrophobicContact CG-CE1 3.56Å; L411-F608 HydrophobicContact CG-CE2 4.37Å; L411-F608 HydrophobicContact CG-CG 4.44Å; L411-F608 HydrophobicContact CG-CZ 3.8Å; L606-F608 HydrophobicContact CD2-CD1 3.71Å; L606-F608 HydrophobicContact CD2-CE1 3.53Å; F608-I610 VanDerWaalsContact C-N 3.34Å; F608-I610 PolarHBondContact O-N 3.42Å; F608-K657 WeakPolarHBondContact O-CA 3.09Å; F608-K657 WeakPolarHBondContact O-CB 3.39Å; F608-G658 PolarHBondContact O-N 3.05Å; F608-T693 HydrophobicContact CD2-CG2 3.83Å; F608-T693 HydrophobicContact CE2-CG2 3.61Å; F608-I694 PolarHBondContact N-O 2.92Å; F608-A696 HydrophobicContact CE1-CB 4.25Å; F608-A696 HydrophobicContact CE2-CB 4.38Å; F608-A696 HydrophobicContact CZ-CB 3.63Å
609	N	81.8	Confident	90.4	Very high	104 Å²	104	52.8 Å²	52.8	56%	0.556	28%	0.277	S	S	*	.	S	Bend	trans	-80.4	84.9	177	-178.3	76.6	0	0	0	109.8	K657	N609-K657 WeakPolarHBondContact OD1-CD 3.39Å; N609-K657 PolarHBondContact OD1-NZ 2.94Å; N609-K657 VanDerWaalsContact OD1-NZ 3.12Å
610	I	81.1	Confident	90.5	Very high	26 Å²	26	51.2 Å²	51.2	13%	0.133	27%	0.268	C	S	.	.			trans	-101.2	145.1	-179.8	68.3	-175.9	0	0	0	110.9	L607 F608 V612 I614 I694	L607-I610 HydrophobicContact CD2-CD1 3.88Å; F608-I610 VanDerWaalsContact C-N 3.34Å; F608-I610 PolarHBondContact O-N 3.42Å; I610-V612 WeakPolarHBondContact CD1-O 3.34Å; I610-I614 HydrophobicContact CD1-CG1 4.07Å; I610-I694 HydrophobicContact CD1-CG2 3.72Å; I610-I694 HydrophobicContact CG2-CB 4.36Å; I610-I694 HydrophobicContact CG2-CG2 3.78Å
611	E	79.4	Confident	90.5	Very high	188 Å²	188	51.3 Å²	51.3	88%	0.879	27%	0.273	S	S	*	.	S	Bend	trans	-81.8	-50.9	175.3	-59.7	-179.6	167.5	0	0	110.9	P613	E611-P613 WeakPolarHBondContact O-CD 3.46Å
612	V	85.8	Confident	90.4	Very high	75 Å²	75	51.3 Å²	51.3	46%	0.455	27%	0.273	S	S	.	.	S	Bend	trans	-78.4	117.8	178.3	-175.3	0	0	0	0	110	I610 F618	I610-V612 WeakPolarHBondContact CD1-O 3.34Å; V612-F618 HydrophobicContact CG1-CE2 3.76Å; V612-F618 HydrophobicContact CG1-CZ 4.15Å
613	P	89.2	Confident	90.2	Very high	60 Å²	60	48.3 Å²	48.3	39%	0.39	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-75.5	134.8	179.5	30.3	-34.2	0	0	0	111.5	E611 T615 L655	E611-P613 WeakPolarHBondContact O-CD 3.46Å; P613-T615 PolarHBondContact O-N 3.12Å; P613-L655 WeakPolarHBondContact CA-O 3.44Å; P613-L655 WeakPolarHBondContact CB-O 3.47Å
614	I	91.7	Very high	90	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	127.1	179.6	-60.5	-171.6	0	0	0	110.5	I605 L607 I610 F618 I633 L636 C654 L655 I694	I605-I614 HydrophobicContact CD1-CD1 4.48Å; L607-I614 HydrophobicContact CD2-CD1 3.37Å; L607-I614 HydrophobicContact CD2-CG1 4.07Å; I610-I614 HydrophobicContact CD1-CG1 4.07Å; I614-F618 HydrophobicContact CG2-CB 4.07Å; I614-F618 HydrophobicContact CG2-CG 4.44Å; I614-I633 HydrophobicContact CD1-CD1 3.8Å; I614-I633 HydrophobicContact CG2-CD1 3.65Å; I614-I633 HydrophobicContact CG2-CG2 4.39Å; I614-L636 HydrophobicContact CG2-CD2 4.3Å; I614-C654 CarbonylContact O-C 3.45Å; I614-C654 WeakPolarHBondContact O-CA 3.41Å; I614-L655 HydrophobicContact CB-CB 4.36Å; I614-L655 PolarHBondContact N-O 3.21Å; I614-L655 PolarHBondContact O-N 3.32Å; I614-I694 HydrophobicContact CD1-CG2 3.71Å; I614-I694 HydrophobicContact CG1-CG2 4Å
615	T	92	Very high	89.8	Confident	66 Å²	66	45.2 Å²	45.2	41%	0.405	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	173.1	172.3	55.9	0	0	0	0	111.5	P613 F618 C654	P613-T615 PolarHBondContact O-N 3.12Å; T615-F618 WeakPolarHBondContact O-CB 3.06Å; T615-F618 PolarHBondContact O-N 2.87Å; T615-C654 HydrophobicContact CG2-CB 4.47Å
616	Q	92.6	Very high	89.4	Confident	127 Å²	127	45.9 Å²	45.9	59%	0.593	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	130.4	169.8	-174	-179.7	-3.6	0	0	110.1	K634	Q616-K634 VanDerWaalsContact CG-O 3.3Å; Q616-K634 WeakPolarHBondContact CG-O 3.08Å; Q616-K634 PolarHBondContact NE2-O 3.02Å
617	G	91.6	Very high	89.3	Confident	42 Å²	42	44 Å²	44	43%	0.433	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.2	4.7	-175.4	0	0	0	0	0	114.1	T632 I633	G617-T632 WeakPolarHBondContact O-CG2 3.4Å; G617-I633 PolarHBondContact N-O 3.49Å
618	F	93.1	Very high	89.3	Confident	18 Å²	18	46.5 Å²	46.5	8%	0.079	26%	0.263	C	S	.	.			trans	-62.4	127.1	178.8	-164.4	-91.5	0	0	0	111.1	V612 I614 T615 V620 I633 Y689 I694	V612-F618 HydrophobicContact CG1-CE2 3.76Å; V612-F618 HydrophobicContact CG1-CZ 4.15Å; I614-F618 HydrophobicContact CG2-CB 4.07Å; I614-F618 HydrophobicContact CG2-CG 4.44Å; T615-F618 WeakPolarHBondContact O-CB 3.06Å; T615-F618 PolarHBondContact O-N 2.87Å; F618-V620 HydrophobicContact CD1-CG1 3.71Å; F618-V620 HydrophobicContact CE1-CG1 4.16Å; F618-I633 PolarHBondContact O-N 3.48Å; F618-Y689 HydrophobicContact CE1-CD1 4.39Å; F618-Y689 AromaticContact CE1-CD2 3.66Å; F618-Y689 HydrophobicContact CE1-CD2 3.66Å; F618-Y689 HydrophobicContact CE1-CE2 4.08Å; F618-Y689 AromaticContact CE1-CG 3.84Å; F618-Y689 HydrophobicContact CE1-CG 3.84Å; F618-Y689 AromaticContact CZ-CD1 3.98Å; F618-Y689 HydrophobicContact CZ-CD1 3.98Å; F618-Y689 AromaticContact CZ-CD2 3.76Å; F618-Y689 HydrophobicContact CZ-CD2 3.76Å; F618-Y689 AromaticContact CZ-CE1 4Å; F618-Y689 HydrophobicContact CZ-CE1 4Å; F618-Y689 AromaticContact CZ-CE2 3.78Å; F618-Y689 HydrophobicContact CZ-CE2 3.78Å; F618-Y689 AromaticContact CZ-CG 3.87Å; F618-Y689 HydrophobicContact CZ-CG 3.87Å; F618-Y689 AromaticContact CZ-CZ 3.9Å; F618-I694 HydrophobicContact CE1-CD1 4.18Å
619	P	94	Very high	89.5	Confident	70 Å²	70	46.1 Å²	46.1	46%	0.455	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	139.4	176.3	32.2	-33.8	0	0	0	110.2	Y689	P619-Y689 HydrophobicContact CG-CE2 4.23Å; P619-Y689 WeakPolarHBondContact O-CD2 3.46Å
620	V	93.8	Very high	90.1	Very high	8 Å²	8	43.8 Å²	43.8	5%	0.048	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	153	179.7	-63.6	0	0	0	0	109.7	F618 A631 I633 L687 I694	F618-V620 HydrophobicContact CD1-CG1 3.71Å; F618-V620 HydrophobicContact CE1-CG1 4.16Å; V620-A631 HydrophobicContact CG2-CB 4.02Å; V620-A631 PolarHBondContact N-O 2.93Å; V620-A631 CarbonylContact O-C 3.53Å; V620-A631 WeakPolarHBondContact O-CA 3.45Å; V620-A631 PolarHBondContact O-N 3.19Å; V620-I633 HydrophobicContact CG1-CD1 3.76Å; V620-I633 HydrophobicContact CG1-CG1 4.11Å; V620-I633 HydrophobicContact CG2-CG1 4.11Å; V620-L687 HydrophobicContact CB-CB 4.41Å; V620-L687 HydrophobicContact CB-CD2 4.33Å; V620-L687 HydrophobicContact CG2-CD1 4.42Å; V620-L687 HydrophobicContact CG2-CD2 3.83Å; V620-I694 HydrophobicContact CB-CD1 4.2Å; V620-I694 HydrophobicContact CG1-CD1 3.49Å; V620-I694 VanDerWaalsContact CG1-CD1 3.49Å
621	L	93.7	Very high	90.8	Very high	63 Å²	63	42.6 Å²	42.6	33%	0.33	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121.9	169.9	-174.5	160.7	0	0	0	108.2	H623 S628 L687 R688	L621-H623 WeakPolarHBondContact CD2-CE1 3.38Å; L621-H623 WeakPolarHBondContact CD2-NE2 3.41Å; L621-S628 WeakPolarHBondContact CD2-OG 3.16Å; L621-L687 WeakPolarHBondContact O-CA 3.47Å; L621-R688 PolarHBondContact N-O 3.36Å; L621-R688 PolarHBondContact O-N 3.02Å
622	L	93.8	Very high	91.5	Very high	1 Å²	1	36 Å²	36	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	111.6	-176.2	175.5	70.3	0	0	0	109.5	F601 S628 E629 A631 T667 F685 M686 L687	F601-L622 HydrophobicContact CE1-CD2 4.2Å; F601-L622 HydrophobicContact CZ-CD1 4.36Å; F601-L622 HydrophobicContact CZ-CD2 3.99Å; L622-S628 WeakPolarHBondContact O-CA 3.41Å; L622-E629 WeakPolarHBondContact CB-O 3.26Å; L622-E629 PolarHBondContact N-O 3Å; L622-E629 PolarHBondContact O-N 2.73Å; L622-A631 HydrophobicContact CB-CB 4.15Å; L622-T667 HydrophobicContact CD2-CG2 3.51Å; L622-F685 HydrophobicContact CD1-CB 3.72Å; L622-F685 HydrophobicContact CD1-CD2 3.22Å; L622-F685 HydrophobicContact CD1-CE2 3.89Å; L622-F685 HydrophobicContact CD1-CG 3.61Å; L622-M686 WeakPolarHBondContact CA-O 3.49Å; L622-L687 HydrophobicContact CB-CD2 4.31Å; L622-L687 HydrophobicContact CD1-CD2 3.7Å
623	H	91.8	Very high	91.9	Very high	7 Å²	7	32.4 Å²	32.4	3%	0.032	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	128.9	166.4	-63.2	-76.4	0	0	0	109.9	I376 L621 V627 F685 M686 R688	I376-H623 HydrophobicContact CG2-CB 3.94Å; L621-H623 WeakPolarHBondContact CD2-CE1 3.38Å; L621-H623 WeakPolarHBondContact CD2-NE2 3.41Å; H623-V627 WeakPolarHBondContact CA-O 3.46Å; H623-F685 WeakPolarHBondContact O-CA 3.47Å; H623-F685 WeakPolarHBondContact O-CB 3.33Å; H623-M686 HydrophobicContact CB-CB 4.32Å; H623-M686 PolarHBondContact N-O 3.46Å; H623-M686 PolarHBondContact O-N 2.92Å; H623-R688 VanDerWaalsContact NE2-CD 3.33Å; H623-R688 WeakPolarHBondContact NE2-CD 3.16Å
624	Y	89.8	Confident	92.1	Very high	5 Å²	5	33.4 Å²	33.4	2%	0.02	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	112.6	-178.1	169.1	-101.1	0	0	0	110	T626 V627 V671 S672 L673 L682 R684 F685	Y624-T626 PolarHBondContact O-N 3.4Å; Y624-V627 HydrophobicContact CD1-CG1 4.09Å; Y624-V627 PolarHBondContact N-O 2.99Å; Y624-V627 PolarHBondContact O-N 3.45Å; Y624-V671 HydrophobicContact CD1-CG1 4.02Å; Y624-V671 HydrophobicContact CE1-CG1 4.32Å; Y624-S672 WeakPolarHBondContact CE1-O 3.34Å; Y624-S672 PolarHBondContact OH-O 2.97Å; Y624-S672 VanDerWaalsContact OH-O 3.08Å; Y624-L673 HydrophobicContact CD1-CD2 3.84Å; Y624-L673 HydrophobicContact CD2-CD2 3.71Å; Y624-L673 HydrophobicContact CE1-CD2 3.64Å; Y624-L673 HydrophobicContact CE2-CD2 3.52Å; Y624-L673 HydrophobicContact CG-CD2 3.85Å; Y624-L673 VanDerWaalsContact CZ-CD2 3.45Å; Y624-L682 WeakPolarHBondContact CE2-O 3.43Å; Y624-L682 WeakPolarHBondContact OH-CB 3.49Å; Y624-L682 WeakPolarHBondContact OH-CD2 3.48Å; Y624-L682 PolarHBondContact OH-O 3.31Å; Y624-R684 VanDerWaalsContact CD2-O 3.31Å; Y624-R684 WeakPolarHBondContact CD2-O 3.21Å; Y624-F685 HydrophobicContact CD2-CB 4.33Å
625	Q	88.3	Confident	92.2	Very high	13 Å²	13	37.9 Å²	37.9	6%	0.061	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.6	-104.7	-167.3	-59.7	-57.5	92.8	0	0	111.7	C511 E530 L682	C511-Q625 HydrophobicContact CB-CB 4.37Å; E530-Q625 PolarHBondContact OE1-NE2 3.14Å; E530-Q625 VanDerWaalsContact OE1-NE2 3.16Å; Q625-L682 HydrophobicContact CG-CD2 4.27Å
626	T	85.8	Confident	92.3	Very high	16 Å²	16	35.3 Å²	35.3	10%	0.098	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-5.8	-178.5	51.5	0	0	0	0	114	V512 G585 Y624	V512-T626 WeakPolarHBondContact O-CB 3.4Å; V512-T626 PolarHBondContact O-OG1 2.85Å; G585-T626 WeakPolarHBondContact CA-OG1 3.12Å; Y624-T626 PolarHBondContact O-N 3.4Å
627	V	88.1	Confident	92.3	Very high	15 Å²	15	31.3 Å²	31.3	9%	0.091	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	150.9	-176.8	91.8	0	0	0	0	113.2	H623 Y624 E629 V671	H623-V627 WeakPolarHBondContact CA-O 3.46Å; Y624-V627 HydrophobicContact CD1-CG1 4.09Å; Y624-V627 PolarHBondContact N-O 2.99Å; Y624-V627 PolarHBondContact O-N 3.45Å; V627-E629 HydrophobicContact CG1-CG 4.14Å; V627-E629 HydrophobicContact CG2-CG 4.13Å; V627-V671 HydrophobicContact CG1-CG1 4.4Å
628	S	90.3	Very high	92.3	Very high	55 Å²	55	29.7 Å²	29.7	39%	0.385	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	105	179.1	176.4	0	0	0	0	108.9	L621 L622	L621-S628 WeakPolarHBondContact CD2-OG 3.16Å; L622-S628 WeakPolarHBondContact O-CA 3.41Å
629	E	92.1	Very high	92.3	Very high	10 Å²	10	29.4 Å²	29.4	5%	0.047	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	130.7	-171.3	-74.6	-60.6	147.4	0	0	113.4	L622 V627 A631 R669 V671	L622-E629 WeakPolarHBondContact CB-O 3.26Å; L622-E629 PolarHBondContact N-O 3Å; L622-E629 PolarHBondContact O-N 2.73Å; V627-E629 HydrophobicContact CG1-CG 4.14Å; V627-E629 HydrophobicContact CG2-CG 4.13Å; E629-A631 PolarHBondContact O-N 3.09Å; E629-R669 VanDerWaalsContact CD-NE 3.33Å; E629-R669 IonicContact OE1-CZ 3.31Å; E629-R669 IonicContact OE1-NE 2.81Å; E629-R669 PolarHBondContact OE1-NE 2.89Å; E629-R669 IonicContact OE1-NH2 3.52Å; E629-R669 PolarHBondContact OE1-NH2 3.49Å; E629-R669 WeakPolarHBondContact OE2-CB 3.44Å; E629-R669 IonicContact OE2-CZ 2.67Å; E629-R669 IonicContact OE2-NE 2.77Å; E629-R669 PolarHBondContact OE2-NE 3.4Å; E629-R669 IonicContact OE2-NH2 2.79Å; E629-V671 HydrophobicContact CG-CG2 3.91Å
630	P	94.4	Very high	92.1	Very high	54 Å²	54	26.6 Å²	26.6	35%	0.351	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	131.1	167.2	-23.6	35.2	0	0	0	111.9	Q668	P630-Q668 HydrophobicContact CB-CG 4.13Å; P630-Q668 PolarHBondContact O-N 3Å
631	A	94.8	Very high	91.8	Very high	2 Å²	2	29.9 Å²	29.9	2%	0.017	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	173.2	-177.4	0	0	0	0	0	112.2	V620 L622 E629 I665 Q666 T667	V620-A631 HydrophobicContact CG2-CB 4.02Å; V620-A631 PolarHBondContact N-O 2.93Å; V620-A631 CarbonylContact O-C 3.53Å; V620-A631 WeakPolarHBondContact O-CA 3.45Å; V620-A631 PolarHBondContact O-N 3.19Å; L622-A631 HydrophobicContact CB-CB 4.15Å; E629-A631 PolarHBondContact O-N 3.09Å; A631-I665 HydrophobicContact CB-CG2 4Å; A631-Q666 CarbonylContact C-O 3.6Å; A631-Q666 VanDerWaalsContact CA-O 3.23Å; A631-Q666 WeakPolarHBondContact CA-O 3.32Å; A631-Q666 WeakPolarHBondContact CB-O 3.36Å; A631-T667 HydrophobicContact CB-CG2 4.14Å
632	T	95.1	Very high	90.9	Very high	49 Å²	49	33 Å²	33	30%	0.301	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	134.6	-178.2	-54.2	0	0	0	0	110.7	G617 K634 Q666	G617-T632 WeakPolarHBondContact O-CG2 3.4Å; T632-K634 VanDerWaalsContact C-N 3.34Å; T632-K634 PolarHBondContact O-N 3.14Å; T632-Q666 PolarHBondContact N-O 2.97Å; T632-Q666 PolarHBondContact O-N 2.94Å
633	I	94.9	Very high	90.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	83.6	-179.7	-59.4	178.3	0	0	0	109	I614 G617 F618 V620 K635 L636 V663 L687	I614-I633 HydrophobicContact CD1-CD1 3.8Å; I614-I633 HydrophobicContact CG2-CD1 3.65Å; I614-I633 HydrophobicContact CG2-CG2 4.39Å; G617-I633 PolarHBondContact N-O 3.49Å; F618-I633 PolarHBondContact O-N 3.48Å; V620-I633 HydrophobicContact CG1-CD1 3.76Å; V620-I633 HydrophobicContact CG1-CG1 4.11Å; V620-I633 HydrophobicContact CG2-CG1 4.11Å; I633-K635 PolarHBondContact O-N 2.82Å; I633-L636 HydrophobicContact CG2-CD2 3.61Å; I633-V663 HydrophobicContact CG2-CB 4.09Å; I633-V663 HydrophobicContact CG2-CG1 4.12Å; I633-L687 HydrophobicContact CD1-CD1 4.17Å
634	K	93.4	Very high	89.4	Confident	80 Å²	80	40.5 Å²	40.5	35%	0.348	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	-35.1	-169.8	-165.7	169.7	-163.8	162.5	0	113.7	Q616 T632 E664 Q666	Q616-K634 VanDerWaalsContact CG-O 3.3Å; Q616-K634 WeakPolarHBondContact CG-O 3.08Å; Q616-K634 PolarHBondContact NE2-O 3.02Å; T632-K634 VanDerWaalsContact C-N 3.34Å; T632-K634 PolarHBondContact O-N 3.14Å; K634-E664 PolarHBondContact N-O 2.94Å; K634-Q666 HydrophobicContact CD-CB 4.37Å
635	K	93.2	Very high	88.8	Confident	95 Å²	95	41.5 Å²	41.5	41%	0.413	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	135.3	178.2	-57.1	178.1	-178.6	163.4	0	112.4	I633 V663 E664	I633-K635 PolarHBondContact O-N 2.82Å; K635-V663 WeakPolarHBondContact O-CA 3.33Å; K635-E664 HydrophobicContact CB-CB 4.03Å; K635-E664 PolarHBondContact N-O 2.83Å; K635-E664 IonicContact NZ-OE1 2.84Å; K635-E664 PolarHBondContact O-N 3.17Å
636	L	93.8	Very high	88.7	Confident	12 Å²	12	47.2 Å²	47.2	6%	0.063	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	114.6	166.8	-50.3	179.8	0	0	0	108.7	I614 I633 P652 L655 V663	I614-L636 HydrophobicContact CG2-CD2 4.3Å; I633-L636 HydrophobicContact CG2-CD2 3.61Å; L636-P652 HydrophobicContact CB-CG 3.97Å; L636-P652 HydrophobicContact CD1-CG 4.47Å; L636-L655 HydrophobicContact CD1-CG 4.19Å; L636-L655 HydrophobicContact CD2-CD1 3.96Å; L636-L655 HydrophobicContact CD2-CG 4.23Å; L636-V663 HydrophobicContact CD2-CG1 3.77Å
637	I	92.8	Very high	88.9	Confident	43 Å²	43	50 Å²	50	22%	0.221	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-53.1	-172.3	-62	173.1	0	0	0	110.7	R602 K651 I662 E664	R602-I637 HydrophobicContact CG-CD1 3.79Å; R602-I637 VanDerWaalsContact NE-CD1 3.34Å; I637-K651 PolarHBondContact O-N 3.13Å; I637-I662 HydrophobicContact CB-CB 4.31Å; I637-I662 HydrophobicContact CB-CG2 4.39Å; I637-I662 WeakPolarHBondContact CB-O 3.08Å; I637-I662 HydrophobicContact CD1-CG2 4.14Å; I637-I662 PolarHBondContact N-O 3.29Å; I637-E664 HydrophobicContact CD1-CB 4.27Å
638	S	92.3	Very high	88.8	Confident	8 Å²	8	54.9 Å²	54.9	6%	0.056	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164	140.4	-177.3	50.7	0	0	0	0	113	K649 A661 I662	S638-K649 CarbonylContact C-O 3.59Å; S638-K649 WeakPolarHBondContact CA-O 3.31Å; S638-A661 CarbonylContact O-C 3.6Å; S638-A661 VanDerWaalsContact O-CA 3.23Å; S638-A661 WeakPolarHBondContact O-CA 3.48Å; S638-I662 PolarHBondContact N-O 3.13Å; S638-I662 PolarHBondContact O-N 3.36Å
639	V	92.8	Very high	88.8	Confident	11 Å²	11	58.5 Å²	58.5	7%	0.067	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	135.4	165	-171.6	0	0	0	0	109.1	L648 K649 P652 L655 M659 N660	V639-L648 HydrophobicContact CB-CB 4.44Å; V639-L648 HydrophobicContact CG1-CB 4.43Å; V639-L648 HydrophobicContact CG1-CD1 4.32Å; V639-L648 PolarHBondContact O-N 3.37Å; V639-K649 HydrophobicContact CB-CB 4.31Å; V639-K649 HydrophobicContact CG2-CB 4.23Å; V639-K649 PolarHBondContact N-O 2.88Å; V639-P652 HydrophobicContact CG2-CB 3.81Å; V639-P652 HydrophobicContact CG2-CG 3.74Å; V639-L655 HydrophobicContact CG2-CD2 3.95Å; V639-M659 HydrophobicContact CG1-CB 4.37Å; V639-M659 HydrophobicContact CG1-SD 4.21Å; V639-N660 WeakPolarHBondContact CA-O 3.31Å; V639-N660 WeakPolarHBondContact CG1-O 3.35Å
640	L	89.9	Confident	88.7	Confident	12 Å²	12	66 Å²	66	6%	0.063	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	153.8	174.4	-54.3	-175.5	0	0	0	110.8	R604 E646 V647 N660 I662	R604-L640 HydrophobicContact CG-CD1 4.21Å; L640-E646 CarbonylContact C-O 3.49Å; L640-E646 VanDerWaalsContact CA-O 3.29Å; L640-E646 WeakPolarHBondContact CA-O 3.09Å; L640-V647 HydrophobicContact CD2-CB 4.46Å; L640-V647 HydrophobicContact CD2-CG2 3.71Å; L640-N660 HydrophobicContact CB-CB 4.03Å; L640-N660 PolarHBondContact N-O 3.25Å; L640-I662 HydrophobicContact CD1-CD1 4.12Å; L640-I662 HydrophobicContact CD1-CG1 3.76Å; L640-I662 HydrophobicContact CD2-CD1 4.22Å; L640-I662 HydrophobicContact CD2-CG1 4.24Å; L640-I662 HydrophobicContact CG-CD1 4.5Å; L640-I662 HydrophobicContact CG-CG1 4.05Å
641	H	85.9	Confident	88.4	Confident	77 Å²	77	71.9 Å²	71.9	36%	0.356	36%	0.364	S	S	.	.			trans	-73.8	159.3	168.9	-171.3	-134.2	0	0	0	112.4	S643 S644 E646 L648 N660	H641-S643 PolarHBondContact CE1-OG 2.91Å; H641-S644 PolarHBondContact ND1-OG 3.13Å; H641-E646 PolarHBondContact N-O 3.02Å; H641-L648 HydrophobicContact CB-CD1 4.01Å; H641-L648 HydrophobicContact CB-CG 4.28Å; H641-N660 PolarHBondContact O-ND2 2.88Å
642	K	75.4	Confident	88.3	Confident	128 Å²	128	72.4 Å²	72.4	56%	0.557	37%	0.367	S	S	*	.	S	Bend	trans	-69.7	-51.7	-176.2	-167.3	173.9	178.6	179.9	0	112.1	R604 N660	R604-K642 PolarHBondContact NH2-O 3.25Å; K642-N660 WeakPolarHBondContact CA-ND2 3.28Å
643	S	78.3	Confident	87.9	Confident	104 Å²	104	79.6 Å²	79.6	73%	0.727	39%	0.394	S	S	*	.	S	Bend	trans	-90.1	-59	-176.5	51.3	0	0	0	0	113.5	H641 G645	H641-S643 PolarHBondContact CE1-OG 2.91Å; S643-G645 VanDerWaalsContact C-N 3.28Å; S643-G645 PolarHBondContact O-N 3.39Å
644	S	76.6	Confident	87.7	Confident	62 Å²	62	82.4 Å²	82.4	43%	0.434	41%	0.413	S	S	.	.	S	Bend	trans	-71.5	-18.2	-173.7	60.2	0	0	0	0	114.5	H641 E646	H641-S644 PolarHBondContact ND1-OG 3.13Å; S644-E646 WeakPolarHBondContact CB-OE2 3.3Å; S644-E646 PolarHBondContact O-N 3.48Å; S644-E646 VanDerWaalsContact O-N 3.16Å; S644-E646 PolarHBondContact OG-OE2 3Å
645	G	77.3	Confident	87.5	Confident	26 Å²	26	78.6 Å²	78.6	27%	0.268	40%	0.397	S	S	.	.			trans	69.7	4.2	-179.3	0	0	0	0	0	115	S643	S643-G645 VanDerWaalsContact C-N 3.28Å; S643-G645 PolarHBondContact O-N 3.39Å
646	E	85.7	Confident	87.2	Confident	132 Å²	132	76.6 Å²	76.6	62%	0.617	40%	0.395	S	S	*	.			trans	-66.6	149.6	-178.6	-66.3	164.4	123.8	0	0	112.4	L640 H641 S644 L648	L640-E646 CarbonylContact C-O 3.49Å; L640-E646 VanDerWaalsContact CA-O 3.29Å; L640-E646 WeakPolarHBondContact CA-O 3.09Å; H641-E646 PolarHBondContact N-O 3.02Å; S644-E646 WeakPolarHBondContact CB-OE2 3.3Å; S644-E646 PolarHBondContact O-N 3.48Å; S644-E646 VanDerWaalsContact O-N 3.16Å; S644-E646 PolarHBondContact OG-OE2 3Å; E646-L648 PolarHBondContact O-N 3.43Å; E646-L648 VanDerWaalsContact O-N 3.15Å
647	V	88.9	Confident	86.9	Confident	75 Å²	75	82.1 Å²	82.1	46%	0.455	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	94.2	-178.8	176.2	0	0	0	0	110.3	L640 K650	L640-V647 HydrophobicContact CD2-CB 4.46Å; L640-V647 HydrophobicContact CD2-CG2 3.71Å; V647-K650 HydrophobicContact CG1-CG 3.7Å
648	L	87.5	Confident	86.4	Confident	118 Å²	118	82.6 Å²	82.6	62%	0.618	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.8	-42.1	176.6	-74.2	166.1	0	0	0	112.6	V639 H641 E646	V639-L648 HydrophobicContact CB-CB 4.44Å; V639-L648 HydrophobicContact CG1-CB 4.43Å; V639-L648 HydrophobicContact CG1-CD1 4.32Å; V639-L648 PolarHBondContact O-N 3.37Å; H641-L648 HydrophobicContact CB-CD1 4.01Å; H641-L648 HydrophobicContact CB-CG 4.28Å; E646-L648 PolarHBondContact O-N 3.43Å; E646-L648 VanDerWaalsContact O-N 3.15Å
649	K	88.9	Confident	86.2	Confident	131 Å²	131	85.8 Å²	85.8	57%	0.57	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-153.4	123.5	-175.6	-166.8	168.7	-172.5	169.6	0	111.7	S638 V639	S638-K649 CarbonylContact C-O 3.59Å; S638-K649 WeakPolarHBondContact CA-O 3.31Å; V639-K649 HydrophobicContact CB-CB 4.31Å; V639-K649 HydrophobicContact CG2-CB 4.23Å; V639-K649 PolarHBondContact N-O 2.88Å
650	K	90.6	Very high	86.1	Confident	168 Å²	168	85.5 Å²	85.5	73%	0.73	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	140.4	171.8	-64.3	175.8	-177.6	174.7	0	109.5	V647	V647-K650 HydrophobicContact CG1-CG 3.7Å
651	K	89.3	Confident	86.3	Confident	177 Å²	177	85 Å²	85	77%	0.77	44%	0.444	S	S	*	.	S	Bend	trans	46.8	64.7	-179.3	-59.9	-178	-177.9	178.2	0	114.2	I637	I637-K651 PolarHBondContact O-N 3.13Å
652	P	90.9	Very high	86.6	Confident	12 Å²	12	83.4 Å²	83.4	8%	0.078	44%	0.438	C	S	.	.			trans	-64	149.9	170.9	31.8	-36.7	0	0	0	111.2	L636 V639 L655	L636-P652 HydrophobicContact CB-CG 3.97Å; L636-P652 HydrophobicContact CD1-CG 4.47Å; V639-P652 HydrophobicContact CG2-CB 3.81Å; V639-P652 HydrophobicContact CG2-CG 3.74Å; P652-L655 HydrophobicContact CB-CD2 4.15Å; P652-L655 HydrophobicContact CG-CD2 3.6Å
653	K	88.6	Confident	87.6	Confident	200 Å²	200	77.3 Å²	77.3	87%	0.87	41%	0.411	S	S	*	.	S	Bend	trans	-74.4	-38.7	175.7	-71.9	-170.8	175.2	-173.7	0	112.4
654	C	88.9	Confident	88.4	Confident	59 Å²	59	72.5 Å²	72.5	40%	0.399	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	163.6	176.5	55.2	0	0	0	0	109.3	I614 T615	I614-C654 CarbonylContact O-C 3.45Å; I614-C654 WeakPolarHBondContact O-CA 3.41Å; T615-C654 HydrophobicContact CG2-CB 4.47Å
655	L	89.9	Confident	89.3	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	142.5	170.2	-53.4	176.7	0	0	0	109.9	I605 L607 P613 I614 L636 V639 P652 A661 V663	I605-L655 HydrophobicContact CD1-CD1 4.05Å; L607-L655 HydrophobicContact CD1-CB 3.38Å; L607-L655 HydrophobicContact CD1-CD1 3.84Å; L607-L655 HydrophobicContact CD1-CG 4.23Å; P613-L655 WeakPolarHBondContact CA-O 3.44Å; P613-L655 WeakPolarHBondContact CB-O 3.47Å; I614-L655 HydrophobicContact CB-CB 4.36Å; I614-L655 PolarHBondContact N-O 3.21Å; I614-L655 PolarHBondContact O-N 3.32Å; L636-L655 HydrophobicContact CD1-CG 4.19Å; L636-L655 HydrophobicContact CD2-CD1 3.96Å; L636-L655 HydrophobicContact CD2-CG 4.23Å; V639-L655 HydrophobicContact CG2-CD2 3.95Å; P652-L655 HydrophobicContact CB-CD2 4.15Å; P652-L655 HydrophobicContact CG-CD2 3.6Å; L655-A661 HydrophobicContact CD1-CB 3.48Å; L655-A661 VanDerWaalsContact CD1-CB 3.48Å; L655-A661 HydrophobicContact CD2-CB 3.83Å; L655-A661 HydrophobicContact CG-CB 4.33Å; L655-V663 HydrophobicContact CD1-CG1 4.19Å
656	S	88.1	Confident	90.1	Very high	53 Å²	53	71.3 Å²	71.3	37%	0.371	36%	0.358	S	S	.	.			trans	-111	165.2	179.4	-53.2	0	0	0	0	111.2	M659	S656-M659 WeakPolarHBondContact O-CB 3.32Å; S656-M659 WeakPolarHBondContact O-CG 3.41Å; S656-M659 PolarHBondContact O-N 2.92Å
657	K	85.6	Confident	90.5	Very high	129 Å²	129	65.1 Å²	65.1	56%	0.561	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.1	142.1	177.6	57.4	176.1	176.2	-172.6	0	114.1	F608 N609 M659	F608-K657 WeakPolarHBondContact O-CA 3.09Å; F608-K657 WeakPolarHBondContact O-CB 3.39Å; N609-K657 WeakPolarHBondContact OD1-CD 3.39Å; N609-K657 PolarHBondContact OD1-NZ 2.94Å; N609-K657 VanDerWaalsContact OD1-NZ 3.12Å; K657-M659 PolarHBondContact O-N 3.05Å
658	G	83.1	Confident	90.7	Very high	53 Å²	53	68.4 Å²	68.4	55%	0.546	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	-3.9	177.8	0	0	0	0	0	116.2	L607 F608	L607-G658 WeakPolarHBondContact O-CA 3.35Å; L607-G658 PolarHBondContact O-N 3.4Å; L607-G658 VanDerWaalsContact O-N 3.11Å; F608-G658 PolarHBondContact O-N 3.05Å
659	M	87.8	Confident	90.8	Very high	74 Å²	74	69.8 Å²	69.8	37%	0.365	34%	0.337	S	S	.	.			trans	-77.9	142	177.3	-66	-172.4	175.1	0	0	111.9	L607 V639 S656 K657	L607-M659 WeakPolarHBondContact CB-O 3.39Å; L607-M659 HydrophobicContact CD1-CB 4.29Å; L607-M659 PolarHBondContact N-O 3.44Å; V639-M659 HydrophobicContact CG1-CB 4.37Å; V639-M659 HydrophobicContact CG1-SD 4.21Å; S656-M659 WeakPolarHBondContact O-CB 3.32Å; S656-M659 WeakPolarHBondContact O-CG 3.41Å; S656-M659 PolarHBondContact O-N 2.92Å; K657-M659 PolarHBondContact O-N 3.05Å
660	N	91.1	Very high	90.9	Very high	6 Å²	6	66.8 Å²	66.8	3%	0.032	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	144.2	161.2	-73.5	-17.7	0	0	0	109.6	R604 I605 L606 V639 L640 H641 K642	R604-N660 PolarHBondContact NH2-ND2 3.41Å; I605-N660 CarbonylContact O-C 3.52Å; I605-N660 VanDerWaalsContact O-CA 3.28Å; I605-N660 WeakPolarHBondContact O-CA 3.27Å; L606-N660 WeakPolarHBondContact CA-OD1 3.17Å; L606-N660 VanDerWaalsContact CB-OD1 3.26Å; L606-N660 WeakPolarHBondContact CB-OD1 3.48Å; L606-N660 WeakPolarHBondContact CD1-OD1 3.43Å; L606-N660 VanDerWaalsContact CG-OD1 3.26Å; L606-N660 WeakPolarHBondContact CG-OD1 3.29Å; V639-N660 WeakPolarHBondContact CA-O 3.31Å; V639-N660 WeakPolarHBondContact CG1-O 3.35Å; L640-N660 HydrophobicContact CB-CB 4.03Å; L640-N660 PolarHBondContact N-O 3.25Å; H641-N660 PolarHBondContact O-ND2 2.88Å; K642-N660 WeakPolarHBondContact CA-ND2 3.28Å
661	A	93.1	Very high	90.9	Very high	1 Å²	1	59 Å²	59	1%	0.008	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	153.4	172.6	0	0	0	0	0	112.3	R604 I605 S638 L655 V663	R604-A661 CarbonylContact C-O 3.56Å; R604-A661 WeakPolarHBondContact CA-O 3.3Å; I605-A661 HydrophobicContact CG1-CB 4.17Å; I605-A661 PolarHBondContact N-O 3.23Å; I605-A661 PolarHBondContact O-N 2.85Å; S638-A661 CarbonylContact O-C 3.6Å; S638-A661 VanDerWaalsContact O-CA 3.23Å; S638-A661 WeakPolarHBondContact O-CA 3.48Å; L655-A661 HydrophobicContact CD1-CB 3.48Å; L655-A661 VanDerWaalsContact CD1-CB 3.48Å; L655-A661 HydrophobicContact CD2-CB 3.83Å; L655-A661 HydrophobicContact CG-CB 4.33Å; A661-V663 HydrophobicContact CB-CG1 4.28Å
662	I	94.3	Very high	90.9	Very high	43 Å²	43	50.7 Å²	50.7	22%	0.221	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	127.2	160	-49.7	-179.2	0	0	0	107.5	A603 I637 S638 L640	A603-I662 WeakPolarHBondContact O-CA 3.12Å; I637-I662 HydrophobicContact CB-CB 4.31Å; I637-I662 HydrophobicContact CB-CG2 4.39Å; I637-I662 WeakPolarHBondContact CB-O 3.08Å; I637-I662 HydrophobicContact CD1-CG2 4.14Å; I637-I662 PolarHBondContact N-O 3.29Å; S638-I662 PolarHBondContact N-O 3.13Å; S638-I662 PolarHBondContact O-N 3.36Å; L640-I662 HydrophobicContact CD1-CD1 4.12Å; L640-I662 HydrophobicContact CD1-CG1 3.76Å; L640-I662 HydrophobicContact CD2-CD1 4.22Å; L640-I662 HydrophobicContact CD2-CG1 4.24Å; L640-I662 HydrophobicContact CG-CD1 4.5Å; L640-I662 HydrophobicContact CG-CG1 4.05Å
663	V	94.8	Very high	90.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	151.8	179.4	-65.6	0	0	0	0	110.8	R602 A603 I605 I633 K635 L636 L655 A661 I665	R602-V663 VanDerWaalsContact CA-O 3.26Å; R602-V663 WeakPolarHBondContact CA-O 3.15Å; A603-V663 PolarHBondContact N-O 3.46Å; A603-V663 PolarHBondContact O-N 2.96Å; I605-V663 HydrophobicContact CD1-CG1 3.77Å; I605-V663 HydrophobicContact CD1-CG2 3.96Å; I605-V663 HydrophobicContact CG1-CG1 4.16Å; I605-V663 HydrophobicContact CG1-CG2 4.02Å; I605-V663 HydrophobicContact CG2-CG2 3.82Å; I633-V663 HydrophobicContact CG2-CB 4.09Å; I633-V663 HydrophobicContact CG2-CG1 4.12Å; K635-V663 WeakPolarHBondContact O-CA 3.33Å; L636-V663 HydrophobicContact CD2-CG1 3.77Å; L655-V663 HydrophobicContact CD1-CG1 4.19Å; A661-V663 HydrophobicContact CB-CG1 4.28Å; V663-I665 HydrophobicContact CG2-CD1 4.06Å; V663-I665 HydrophobicContact CG2-CG1 3.87Å
664	E	95.6	Very high	91	Very high	3 Å²	3	41.6 Å²	41.6	1%	0.014	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	113.3	167	-169.7	170.6	119.2	0	0	107.8	R600 F601 R602 K634 K635 I637 K703	R600-E664 IonicContact CZ-OE1 2.94Å; R600-E664 IonicContact NE-OE1 2.71Å; R600-E664 IonicContact NH2-OE1 3.11Å; R600-E664 PolarHBondContact NH2-OE1 2.62Å; F601-E664 WeakPolarHBondContact O-CA 3.46Å; R602-E664 HydrophobicContact CG-CB 4.33Å; R602-E664 HydrophobicContact CG-CG 4.43Å; R602-E664 IonicContact NE-OE2 2.98Å; K634-E664 PolarHBondContact N-O 2.94Å; K635-E664 HydrophobicContact CB-CB 4.03Å; K635-E664 PolarHBondContact N-O 2.83Å; K635-E664 IonicContact NZ-OE1 2.84Å; K635-E664 PolarHBondContact O-N 3.17Å; I637-E664 HydrophobicContact CD1-CB 4.27Å; E664-K703 IonicContact OE2-NZ 3.33Å; E664-K703 PolarHBondContact OE2-NZ 3.14Å
665	I	95.1	Very high	91.1	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	144.8	179.1	-57.8	178.7	0	0	0	108.2	R600 F601 A631 V663 F685 L687	R600-I665 WeakPolarHBondContact CA-O 3.4Å; F601-I665 HydrophobicContact CE1-CB 4.21Å; F601-I665 HydrophobicContact CE1-CG2 4.12Å; F601-I665 HydrophobicContact CE2-CB 4.11Å; F601-I665 HydrophobicContact CE2-CD1 3.92Å; F601-I665 HydrophobicContact CE2-CG1 4.43Å; F601-I665 HydrophobicContact CZ-CB 3.92Å; F601-I665 HydrophobicContact CZ-CD1 4.12Å; F601-I665 HydrophobicContact CZ-CG2 3.9Å; F601-I665 PolarHBondContact N-O 3.47Å; F601-I665 VanDerWaalsContact N-O 3.16Å; F601-I665 PolarHBondContact O-N 3.41Å; A631-I665 HydrophobicContact CB-CG2 4Å; V663-I665 HydrophobicContact CG2-CD1 4.06Å; V663-I665 HydrophobicContact CG2-CG1 3.87Å; I665-F685 HydrophobicContact CD1-CE2 3.74Å; I665-F685 HydrophobicContact CD1-CZ 3.69Å; I665-L687 HydrophobicContact CD1-CD1 4.13Å; I665-L687 HydrophobicContact CD1-CD2 4.34Å
666	Q	95.2	Very high	91.2	Very high	63 Å²	63	44.9 Å²	44.9	29%	0.294	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	127.2	167.1	177.1	171.1	-8.9	0	0	109.7	T599 R600 A631 T632 K634	T599-Q666 CarbonylContact O-C 3.59Å; T599-Q666 VanDerWaalsContact O-CA 3.24Å; T599-Q666 WeakPolarHBondContact O-CA 3.48Å; R600-Q666 HydrophobicContact CG-CB 4.01Å; R600-Q666 HydrophobicContact CG-CG 3.87Å; A631-Q666 CarbonylContact C-O 3.6Å; A631-Q666 VanDerWaalsContact CA-O 3.23Å; A631-Q666 WeakPolarHBondContact CA-O 3.32Å; A631-Q666 WeakPolarHBondContact CB-O 3.36Å; T632-Q666 PolarHBondContact N-O 2.97Å; T632-Q666 PolarHBondContact O-N 2.94Å; K634-Q666 HydrophobicContact CD-CB 4.37Å
667	T	94.1	Very high	91.3	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.012	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	159.7	169.9	53.5	0	0	0	0	110.9	T599 F601 L622 A631 R669 V671	T599-T667 WeakPolarHBondContact CA-OG1 3.31Å; T599-T667 PolarHBondContact O-N 2.8Å; T599-T667 PolarHBondContact O-OG1 3.35Å; F601-T667 HydrophobicContact CE1-CG2 4.23Å; L622-T667 HydrophobicContact CD2-CG2 3.51Å; A631-T667 HydrophobicContact CB-CG2 4.14Å; T667-R669 VanDerWaalsContact CB-O 3.24Å; T667-R669 WeakPolarHBondContact CB-O 3.42Å; T667-R669 PolarHBondContact OG1-O 3.29Å; T667-V671 HydrophobicContact CG2-CG2 4.05Å
668	Q	91.7	Very high	91.5	Very high	145 Å²	145	49.3 Å²	49.3	68%	0.678	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	-49.5	171.2	-68	-173.5	12.8	0	0	111.5	P630	P630-Q668 HydrophobicContact CB-CG 4.13Å; P630-Q668 PolarHBondContact O-N 3Å
669	R	91.1	Very high	91.7	Very high	147 Å²	147	47.3 Å²	47.3	56%	0.555	22%	0.221	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	152.7	173.9	-56.9	-166.9	-73.3	-161.9	2.8	111	E629 T667	E629-R669 VanDerWaalsContact CD-NE 3.33Å; E629-R669 IonicContact OE1-CZ 3.31Å; E629-R669 IonicContact OE1-NE 2.81Å; E629-R669 PolarHBondContact OE1-NE 2.89Å; E629-R669 IonicContact OE1-NH2 3.52Å; E629-R669 PolarHBondContact OE1-NH2 3.49Å; E629-R669 WeakPolarHBondContact OE2-CB 3.44Å; E629-R669 IonicContact OE2-CZ 2.67Å; E629-R669 IonicContact OE2-NE 2.77Å; E629-R669 PolarHBondContact OE2-NE 3.4Å; E629-R669 IonicContact OE2-NH2 2.79Å; T667-R669 VanDerWaalsContact CB-O 3.24Å; T667-R669 WeakPolarHBondContact CB-O 3.42Å; T667-R669 PolarHBondContact OG1-O 3.29Å
670	P	90.6	Very high	91.7	Very high	67 Å²	67	49.2 Å²	49.2	44%	0.435	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	135.3	174.1	29.7	-35	0	0	0	111.1	P544 V597 T599	P544-P670 WeakPolarHBondContact CG-O 3.3Å; V597-P670 HydrophobicContact CG1-CB 3.61Å; T599-P670 HydrophobicContact CG2-CB 4.09Å
671	V	90.7	Very high	91.4	Very high	6 Å²	6	51.3 Å²	51.3	4%	0.036	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	141.6	-176.5	-172.8	0	0	0	0	110.7	V597 C598 Y624 V627 E629 T667 L673	V597-V671 WeakPolarHBondContact CA-O 3.31Å; C598-V671 PolarHBondContact N-O 2.92Å; C598-V671 PolarHBondContact O-N 3.44Å; Y624-V671 HydrophobicContact CD1-CG1 4.02Å; Y624-V671 HydrophobicContact CE1-CG1 4.32Å; V627-V671 HydrophobicContact CG1-CG1 4.4Å; E629-V671 HydrophobicContact CG-CG2 3.91Å; T667-V671 HydrophobicContact CG2-CG2 4.05Å; V671-L673 HydrophobicContact CB-CD1 4.5Å; V671-L673 HydrophobicContact CB-CG 4.18Å; V671-L673 HydrophobicContact CG1-CD2 3.79Å; V671-L673 HydrophobicContact CG1-CG 3.96Å; V671-L673 PolarHBondContact O-N 3.38Å
672	S	89.8	Confident	91.2	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.007	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	105.8	173.2	-57.7	0	0	0	0	110.4	M543 Y624	M543-S672 WeakPolarHBondContact CB-OG 3.4Å; M543-S672 PolarHBondContact O-OG 3.05Å; Y624-S672 WeakPolarHBondContact CE1-O 3.34Å; Y624-S672 PolarHBondContact OH-O 2.97Å; Y624-S672 VanDerWaalsContact OH-O 3.08Å
673	L	89.3	Confident	91	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.01	23%	0.226	C	C	.	.			trans	-128.8	145.1	-173.6	-64.1	179.4	0	0	0	111.6	R596 F601 Y624 V671 I702	R596-L673 PolarHBondContact O-N 3.27Å; F601-L673 HydrophobicContact CD1-CD1 3.39Å; F601-L673 HydrophobicContact CD2-CD1 4.47Å; F601-L673 HydrophobicContact CE1-CD1 3.45Å; F601-L673 VanDerWaalsContact CE1-CD1 3.45Å; F601-L673 HydrophobicContact CG-CD1 3.94Å; F601-L673 HydrophobicContact CZ-CD1 4.04Å; Y624-L673 HydrophobicContact CD1-CD2 3.84Å; Y624-L673 HydrophobicContact CD2-CD2 3.71Å; Y624-L673 HydrophobicContact CE1-CD2 3.64Å; Y624-L673 HydrophobicContact CE2-CD2 3.52Å; Y624-L673 HydrophobicContact CG-CD2 3.85Å; Y624-L673 VanDerWaalsContact CZ-CD2 3.45Å; V671-L673 HydrophobicContact CB-CD1 4.5Å; V671-L673 HydrophobicContact CB-CG 4.18Å; V671-L673 HydrophobicContact CG1-CD2 3.79Å; V671-L673 HydrophobicContact CG1-CG 3.96Å; V671-L673 PolarHBondContact O-N 3.38Å; L673-I702 WeakPolarHBondContact O-CD1 3.31Å
674	E	90.9	Very high	90.9	Very high	19 Å²	19	51 Å²	51	9%	0.089	23%	0.233	C	C	.	.			trans	-125.3	167.7	173.9	-66	-172.7	136.6	0	0	111.7	R509 I595 Y679 L682 V699	R509-E674 IonicContact CZ-OE1 2.88Å; R509-E674 IonicContact CZ-OE2 2.68Å; R509-E674 IonicContact NE-OE1 2.71Å; R509-E674 PolarHBondContact NE-OE1 2.8Å; R509-E674 VanDerWaalsContact NE-OE1 3.11Å; R509-E674 IonicContact NE-OE2 2.66Å; R509-E674 PolarHBondContact NE-OE2 3.26Å; R509-E674 IonicContact NH2-OE1 2.68Å; R509-E674 PolarHBondContact NH2-OE1 3.44Å; R509-E674 IonicContact NH2-OE2 2.66Å; I595-E674 HydrophobicContact CD1-CG 3.65Å; I595-E674 HydrophobicContact CG1-CG 3.62Å; E674-Y679 HydrophobicContact CB-CD2 4.14Å; E674-Y679 WeakPolarHBondContact OE2-CD2 3.5Å; E674-Y679 VanDerWaalsContact OE2-CE2 3.31Å; E674-Y679 WeakPolarHBondContact OE2-CE2 3.32Å; E674-L682 HydrophobicContact CB-CB 4.25Å; E674-L682 PolarHBondContact N-O 2.75Å; E674-L682 WeakPolarHBondContact OE2-CD1 3.42Å; E674-V699 WeakPolarHBondContact O-CB 3.25Å; E674-V699 WeakPolarHBondContact O-CG1 3.22Å
675	L	92.3	Very high	90.8	Very high	46 Å²	46	51 Å²	51	24%	0.241	23%	0.233	C	C	.	.			trans	-82.8	139.9	-178.8	-52.3	179.8	0	0	0	110.1	K677 D678 Y679 V699 I702	L675-K677 PolarHBondContact O-N 3.46Å; L675-D678 WeakPolarHBondContact CB-OD2 3.41Å; L675-D678 PolarHBondContact O-N 2.67Å; L675-Y679 PolarHBondContact O-N 3.35Å; L675-V699 HydrophobicContact CD2-CG1 4.14Å; L675-I702 HydrophobicContact CD2-CB 4.38Å; L675-I702 HydrophobicContact CD2-CD1 3.7Å; L675-I702 HydrophobicContact CD2-CG1 3.78Å; L675-I702 HydrophobicContact CG-CD1 4.2Å
676	Y	91.4	Very high	90.6	Very high	82 Å²	82	51.1 Å²	51.1	32%	0.322	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-19.5	179.3	-176.7	-104.4	0	0	0	115.1	Y679 K680 R684 V698 V699	Y676-Y679 VanDerWaalsContact CA-O 3.32Å; Y676-Y679 WeakPolarHBondContact CA-O 3.41Å; Y676-K680 HydrophobicContact CD2-CB 4.17Å; Y676-K680 WeakPolarHBondContact CD2-O 3.47Å; Y676-K680 HydrophobicContact CE2-CB 3.65Å; Y676-K680 HydrophobicContact CE2-CG 4.15Å; Y676-K680 VanDerWaalsContact CE2-O 3.25Å; Y676-K680 WeakPolarHBondContact CE2-O 3.38Å; Y676-R684 HydrophobicContact CD2-CG 4.19Å; Y676-R684 HydrophobicContact CE2-CG 3.97Å; Y676-R684 PolarHBondContact OH-NH2 3.45Å; Y676-R684 VanDerWaalsContact OH-NH2 3.13Å; Y676-V698 HydrophobicContact CD1-CG1 3.57Å; Y676-V698 HydrophobicContact CD2-CG1 3.86Å; Y676-V698 HydrophobicContact CE1-CG1 4.34Å; Y676-V698 HydrophobicContact CG-CG1 3.29Å; Y676-V699 PolarHBondContact N-O 3.19Å
677	K	89.9	Confident	90.6	Very high	187 Å²	187	48.1 Å²	48.1	81%	0.813	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-34.7	173.6	-66.8	179.7	-179.7	176.9	0	112.2	L675	L675-K677 PolarHBondContact O-N 3.46Å
678	D	88.9	Confident	90.4	Very high	88 Å²	88	48.8 Å²	48.8	47%	0.471	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-48.1	-168.9	-48.6	-24.2	0	0	0	108.5	K506 L675	K506-D678 WeakPolarHBondContact CE-O 3.37Å; K506-D678 PolarHBondContact NZ-O 3.48Å; L675-D678 WeakPolarHBondContact CB-OD2 3.41Å; L675-D678 PolarHBondContact O-N 2.67Å
679	Y	87.6	Confident	90.3	Very high	11 Å²	11	46.4 Å²	46.4	4%	0.043	21%	0.207	C	C	.	.			trans	-131.9	122.2	173.2	-61.2	-100.7	0	0	0	108.8	K506 P507 R509 A531 E674 L675 Y676 E681 L682 G683	K506-Y679 HydrophobicContact CB-CE1 4.28Å; K506-Y679 HydrophobicContact CD-CD1 3.88Å; K506-Y679 HydrophobicContact CD-CE1 3.54Å; P507-Y679 WeakPolarHBondContact CD-OH 3.29Å; P507-Y679 WeakPolarHBondContact CG-OH 3.42Å; R509-Y679 HydrophobicContact CG-CD1 4.34Å; R509-Y679 HydrophobicContact CG-CE1 3.79Å; A531-Y679 HydrophobicContact CB-CD1 4.06Å; A531-Y679 HydrophobicContact CB-CE1 3.61Å; E674-Y679 HydrophobicContact CB-CD2 4.14Å; E674-Y679 WeakPolarHBondContact OE2-CD2 3.5Å; E674-Y679 VanDerWaalsContact OE2-CE2 3.31Å; E674-Y679 WeakPolarHBondContact OE2-CE2 3.32Å; L675-Y679 PolarHBondContact O-N 3.35Å; Y676-Y679 VanDerWaalsContact CA-O 3.32Å; Y676-Y679 WeakPolarHBondContact CA-O 3.41Å; Y679-E681 VanDerWaalsContact C-N 3.33Å; Y679-L682 HydrophobicContact CD1-CD1 4.28Å; Y679-L682 HydrophobicContact CG-CD1 4.27Å; Y679-G683 PolarHBondContact O-N 3.49Å
680	K	87.6	Confident	90	Very high	115 Å²	115	45.1 Å²	45.1	50%	0.5	22%	0.215	S	C	.	.	S	Bend	trans	-80.4	-26	-174.9	-60.7	169.6	-175.1	164.9	0	111.3	Y676 R684	Y676-K680 HydrophobicContact CD2-CB 4.17Å; Y676-K680 WeakPolarHBondContact CD2-O 3.47Å; Y676-K680 HydrophobicContact CE2-CB 3.65Å; Y676-K680 HydrophobicContact CE2-CG 4.15Å; Y676-K680 VanDerWaalsContact CE2-O 3.25Å; Y676-K680 WeakPolarHBondContact CE2-O 3.38Å; K680-R684 WeakPolarHBondContact O-CD 3.45Å; K680-R684 VanDerWaalsContact O-CG 3.3Å; K680-R684 WeakPolarHBondContact O-CG 3.38Å; K680-R684 PolarHBondContact O-NE 3.47Å
681	E	86	Confident	89.6	Confident	50 Å²	50	43.9 Å²	43.9	23%	0.234	22%	0.215	C	C	.	.	S	Bend	trans	-75.4	-65.8	-177.3	-55.6	66.5	-143.8	0	0	107.4	Y679 G683 R684	Y679-E681 VanDerWaalsContact C-N 3.33Å; E681-G683 PolarHBondContact O-N 3.05Å; E681-R684 PolarHBondContact O-N 3.18Å
682	L	88.7	Confident	89.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	4.7	172.3	-56.8	174.4	0	0	0	115.1	R509 C511 I595 Y624 Q625 E674 Y679	R509-L682 HydrophobicContact CB-CD1 3.97Å; R509-L682 HydrophobicContact CG-CD1 3.79Å; C511-L682 WeakPolarHBondContact SG-CD2 3.34Å; I595-L682 HydrophobicContact CD1-CD1 4.36Å; Y624-L682 WeakPolarHBondContact CE2-O 3.43Å; Y624-L682 WeakPolarHBondContact OH-CB 3.49Å; Y624-L682 WeakPolarHBondContact OH-CD2 3.48Å; Y624-L682 PolarHBondContact OH-O 3.31Å; Q625-L682 HydrophobicContact CG-CD2 4.27Å; E674-L682 HydrophobicContact CB-CB 4.25Å; E674-L682 PolarHBondContact N-O 2.75Å; E674-L682 WeakPolarHBondContact OE2-CD1 3.42Å; Y679-L682 HydrophobicContact CD1-CD1 4.28Å; Y679-L682 HydrophobicContact CG-CD1 4.27Å
683	G	89.3	Confident	89.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-2.3	177	0	0	0	0	0	114.6	Y679 E681 V698 V699	Y679-G683 PolarHBondContact O-N 3.49Å; E681-G683 PolarHBondContact O-N 3.05Å; G683-V698 CarbonylContact O-C 3.6Å; G683-V698 WeakPolarHBondContact O-CA 3.33Å; G683-V699 PolarHBondContact O-N 2.93Å
684	R	92.2	Very high	89.3	Confident	37 Å²	37	48 Å²	48	14%	0.14	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	148.1	-179.4	-71.7	167.4	-174	139.8	14.1	111.4	S415 L416 Y624 Y676 K680 E681 G697	S415-R684 WeakPolarHBondContact O-CD 3.35Å; L416-R684 WeakPolarHBondContact O-CD 3.43Å; L416-R684 PolarHBondContact O-NE 3.09Å; L416-R684 PolarHBondContact O-NH1 3.16Å; Y624-R684 VanDerWaalsContact CD2-O 3.31Å; Y624-R684 WeakPolarHBondContact CD2-O 3.21Å; Y676-R684 HydrophobicContact CD2-CG 4.19Å; Y676-R684 HydrophobicContact CE2-CG 3.97Å; Y676-R684 PolarHBondContact OH-NH2 3.45Å; Y676-R684 VanDerWaalsContact OH-NH2 3.13Å; K680-R684 WeakPolarHBondContact O-CD 3.45Å; K680-R684 VanDerWaalsContact O-CG 3.3Å; K680-R684 WeakPolarHBondContact O-CG 3.38Å; K680-R684 PolarHBondContact O-NE 3.47Å; E681-R684 PolarHBondContact O-N 3.18Å; R684-G697 WeakPolarHBondContact CA-O 3.32Å
685	F	93.6	Very high	89.3	Confident	4 Å²	4	47 Å²	47	2%	0.018	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	165.9	173.5	64.5	-92.9	0	0	0	111.5	F601 A603 I605 L622 H623 Y624 I665 L687 G697 V699	F601-F685 HydrophobicContact CE2-CD1 4.34Å; F601-F685 AromaticContact CE2-CE1 3.71Å; F601-F685 HydrophobicContact CE2-CE1 3.71Å; F601-F685 AromaticContact CE2-CZ 3.82Å; F601-F685 HydrophobicContact CE2-CZ 3.82Å; A603-F685 HydrophobicContact CB-CE1 3.45Å; A603-F685 VanDerWaalsContact CB-CE1 3.45Å; A603-F685 HydrophobicContact CB-CZ 3.35Å; I605-F685 HydrophobicContact CG2-CE2 4.32Å; I605-F685 HydrophobicContact CG2-CZ 4.18Å; L622-F685 HydrophobicContact CD1-CB 3.72Å; L622-F685 HydrophobicContact CD1-CD2 3.22Å; L622-F685 HydrophobicContact CD1-CE2 3.89Å; L622-F685 HydrophobicContact CD1-CG 3.61Å; H623-F685 WeakPolarHBondContact O-CA 3.47Å; H623-F685 WeakPolarHBondContact O-CB 3.33Å; Y624-F685 HydrophobicContact CD2-CB 4.33Å; I665-F685 HydrophobicContact CD1-CE2 3.74Å; I665-F685 HydrophobicContact CD1-CZ 3.69Å; F685-L687 HydrophobicContact CD2-CD2 3.96Å; F685-L687 HydrophobicContact CD2-CG 4.17Å; F685-L687 HydrophobicContact CE2-CD1 4.22Å; F685-L687 HydrophobicContact CE2-CD2 3.8Å; F685-L687 HydrophobicContact CE2-CG 3.84Å; F685-G697 VanDerWaalsContact CE1-C 3.48Å; F685-G697 PolarHBondContact N-O 3Å; F685-G697 PolarHBondContact O-N 3.33Å; F685-V699 HydrophobicContact CD1-CG2 3.9Å; F685-V699 HydrophobicContact CE1-CG2 3.95Å
686	M	92.8	Very high	89.3	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	152.3	171.5	-55.2	-57.4	177.2	0	0	111.5	I376 L412 S415 L416 L622 H623 A696	I376-M686 HydrophobicContact CD1-CB 4.43Å; I376-M686 HydrophobicContact CD1-CG 4.29Å; I376-M686 HydrophobicContact CG2-CG 4.46Å; L412-M686 HydrophobicContact CD2-CE 3.9Å; L412-M686 HydrophobicContact CD2-CG 3.77Å; L412-M686 HydrophobicContact CD2-SD 3.83Å; L412-M686 WeakPolarHBondContact O-CE 3.43Å; S415-M686 VanDerWaalsContact CB-CE 3.43Å; L416-M686 HydrophobicContact CB-CE 4.46Å; L416-M686 HydrophobicContact CD1-CE 4.41Å; L416-M686 HydrophobicContact CD2-CE 3.62Å; L416-M686 HydrophobicContact CG-CE 3.5Å; L416-M686 VanDerWaalsContact CG-CE 3.5Å; L622-M686 WeakPolarHBondContact CA-O 3.49Å; H623-M686 HydrophobicContact CB-CB 4.32Å; H623-M686 PolarHBondContact N-O 3.46Å; H623-M686 PolarHBondContact O-N 2.92Å; M686-A696 HydrophobicContact SD-CB 3.89Å
687	L	93.2	Very high	89.3	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124	168.5	-58.2	-179	0	0	0	109.3	I605 V620 L621 L622 I633 I665 F685 I694 A695	I605-L687 HydrophobicContact CG2-CD1 4.24Å; V620-L687 HydrophobicContact CB-CB 4.41Å; V620-L687 HydrophobicContact CB-CD2 4.33Å; V620-L687 HydrophobicContact CG2-CD1 4.42Å; V620-L687 HydrophobicContact CG2-CD2 3.83Å; L621-L687 WeakPolarHBondContact O-CA 3.47Å; L622-L687 HydrophobicContact CB-CD2 4.31Å; L622-L687 HydrophobicContact CD1-CD2 3.7Å; I633-L687 HydrophobicContact CD1-CD1 4.17Å; I665-L687 HydrophobicContact CD1-CD1 4.13Å; I665-L687 HydrophobicContact CD1-CD2 4.34Å; F685-L687 HydrophobicContact CD2-CD2 3.96Å; F685-L687 HydrophobicContact CD2-CG 4.17Å; F685-L687 HydrophobicContact CE2-CD1 4.22Å; F685-L687 HydrophobicContact CE2-CD2 3.8Å; F685-L687 HydrophobicContact CE2-CG 3.84Å; L687-I694 HydrophobicContact CB-CD1 4.21Å; L687-I694 WeakPolarHBondContact O-CG1 3.48Å; L687-I694 PolarHBondContact O-N 3.44Å; L687-A695 HydrophobicContact CB-CB 4.48Å; L687-A695 PolarHBondContact N-O 3.48Å; L687-A695 PolarHBondContact O-N 3.42Å
688	R	91.6	Very high	89.5	Confident	16 Å²	16	35 Å²	35	6%	0.06	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	154.5	173.3	-63.6	-172.6	78	-147.6	6.7	111.4	R369 I372 P373 L621 H623 G691 S692 T693	R369-R688 PolarHBondContact O-NH2 3.26Å; R369-R688 VanDerWaalsContact O-NH2 3.14Å; I372-R688 VanDerWaalsContact CB-NH2 3.32Å; I372-R688 VanDerWaalsContact CG2-CZ 3.41Å; P373-R688 VanDerWaalsContact CD-NH1 3.31Å; L621-R688 PolarHBondContact N-O 3.36Å; L621-R688 PolarHBondContact O-N 3.02Å; H623-R688 VanDerWaalsContact NE2-CD 3.33Å; H623-R688 WeakPolarHBondContact NE2-CD 3.16Å; R688-G691 PolarHBondContact NH2-O 3.16Å; R688-S692 CarbonylContact C-O 3.55Å; R688-S692 VanDerWaalsContact CA-O 3.29Å; R688-S692 WeakPolarHBondContact CA-O 3.31Å; R688-T693 HydrophobicContact CG-CG2 4.16Å; R688-T693 PolarHBondContact NE-OG1 3.46Å
689	Y	89.7	Confident	89.8	Confident	96 Å²	96	30.9 Å²	30.9	38%	0.376	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	128	174.4	173.2	-92.2	0	0	0	108.3	F618 P619 G691 S692 I694	F618-Y689 HydrophobicContact CE1-CD1 4.39Å; F618-Y689 AromaticContact CE1-CD2 3.66Å; F618-Y689 HydrophobicContact CE1-CD2 3.66Å; F618-Y689 HydrophobicContact CE1-CE2 4.08Å; F618-Y689 AromaticContact CE1-CG 3.84Å; F618-Y689 HydrophobicContact CE1-CG 3.84Å; F618-Y689 AromaticContact CZ-CD1 3.98Å; F618-Y689 HydrophobicContact CZ-CD1 3.98Å; F618-Y689 AromaticContact CZ-CD2 3.76Å; F618-Y689 HydrophobicContact CZ-CD2 3.76Å; F618-Y689 AromaticContact CZ-CE1 4Å; F618-Y689 HydrophobicContact CZ-CE1 4Å; F618-Y689 AromaticContact CZ-CE2 3.78Å; F618-Y689 HydrophobicContact CZ-CE2 3.78Å; F618-Y689 AromaticContact CZ-CG 3.87Å; F618-Y689 HydrophobicContact CZ-CG 3.87Å; F618-Y689 AromaticContact CZ-CZ 3.9Å; P619-Y689 HydrophobicContact CG-CE2 4.23Å; P619-Y689 WeakPolarHBondContact O-CD2 3.46Å; Y689-G691 PolarHBondContact O-N 3.49Å; Y689-S692 PolarHBondContact N-O 2.82Å; Y689-S692 PolarHBondContact O-N 3.05Å; Y689-I694 VanDerWaalsContact CB-CD1 3.47Å
690	V	84.8	Confident	90	Very high	119 Å²	119	32.9 Å²	32.9	72%	0.721	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	43.6	64.5	178.6	-170.8	0	0	0	0	111.8	S692	V690-S692 PolarHBondContact O-N 3.03Å
691	G	80.4	Confident	90.2	Very high	42 Å²	42	31.8 Å²	31.8	43%	0.433	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	-9.3	179.5	0	0	0	0	0	116.6	R688 Y689	R688-G691 PolarHBondContact NH2-O 3.16Å; Y689-G691 PolarHBondContact O-N 3.49Å
692	S	84.9	Confident	90.4	Very high	74 Å²	74	31.4 Å²	31.4	52%	0.517	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	138.2	-174.7	-61.5	0	0	0	0	112.5	R688 Y689 V690 I694	R688-S692 CarbonylContact C-O 3.55Å; R688-S692 VanDerWaalsContact CA-O 3.29Å; R688-S692 WeakPolarHBondContact CA-O 3.31Å; Y689-S692 PolarHBondContact N-O 2.82Å; Y689-S692 PolarHBondContact O-N 3.05Å; V690-S692 PolarHBondContact O-N 3.03Å; S692-I694 PolarHBondContact O-N 3.31Å
693	T	88.8	Confident	90.3	Very high	11 Å²	11	34.2 Å²	34.2	7%	0.067	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	118.5	171.6	-49.7	0	0	0	0	112	E408 L412 F608 R688	E408-T693 WeakPolarHBondContact OE1-CB 3.25Å; E408-T693 PolarHBondContact OE1-N 3.32Å; E408-T693 PolarHBondContact OE1-OG1 2.83Å; L412-T693 HydrophobicContact CD2-CG2 3.77Å; F608-T693 HydrophobicContact CD2-CG2 3.83Å; F608-T693 HydrophobicContact CE2-CG2 3.61Å; R688-T693 HydrophobicContact CG-CG2 4.16Å; R688-T693 PolarHBondContact NE-OG1 3.46Å
694	I	90.4	Very high	89.4	Confident	9 Å²	9	44.4 Å²	44.4	5%	0.046	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-46.4	-174.4	-33.9	167.9	0	0	0	111.1	L607 F608 I610 I614 F618 V620 L687 Y689 S692	L607-I694 HydrophobicContact CD2-CG2 4.22Å; F608-I694 PolarHBondContact N-O 2.92Å; I610-I694 HydrophobicContact CD1-CG2 3.72Å; I610-I694 HydrophobicContact CG2-CB 4.36Å; I610-I694 HydrophobicContact CG2-CG2 3.78Å; I614-I694 HydrophobicContact CD1-CG2 3.71Å; I614-I694 HydrophobicContact CG1-CG2 4Å; F618-I694 HydrophobicContact CE1-CD1 4.18Å; V620-I694 HydrophobicContact CB-CD1 4.2Å; V620-I694 HydrophobicContact CG1-CD1 3.49Å; V620-I694 VanDerWaalsContact CG1-CD1 3.49Å; L687-I694 HydrophobicContact CB-CD1 4.21Å; L687-I694 WeakPolarHBondContact O-CG1 3.48Å; L687-I694 PolarHBondContact O-N 3.44Å; Y689-I694 VanDerWaalsContact CB-CD1 3.47Å; S692-I694 PolarHBondContact O-N 3.31Å
695	A	91.6	Very high	89.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	148.7	-169.2	0	0	0	0	0	112.5	I605 L606 L607 L687	I605-A695 HydrophobicContact CB-CB 4.3Å; L606-A695 VanDerWaalsContact O-CA 3.22Å; L606-A695 WeakPolarHBondContact O-CA 3.26Å; L606-A695 VanDerWaalsContact O-CB 3.32Å; L606-A695 WeakPolarHBondContact O-CB 3.33Å; L607-A695 HydrophobicContact CD2-CB 3.88Å; L687-A695 HydrophobicContact CB-CB 4.48Å; L687-A695 PolarHBondContact N-O 3.48Å; L687-A695 PolarHBondContact O-N 3.42Å
696	A	91.8	Very high	89	Confident	11 Å²	11	46.9 Å²	46.9	9%	0.091	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	149.3	158.2	0	0	0	0	0	110.7	S415 I605 L606 F608 M686	S415-A696 VanDerWaalsContact CB-CB 3.43Å; S415-A696 WeakPolarHBondContact OG-CB 3.46Å; I605-A696 CarbonylContact C-O 3.52Å; I605-A696 VanDerWaalsContact CA-O 3.25Å; I605-A696 WeakPolarHBondContact CA-O 3.45Å; L606-A696 PolarHBondContact N-O 3.27Å; L606-A696 PolarHBondContact O-N 2.91Å; L606-A696 VanDerWaalsContact O-N 3.11Å; F608-A696 HydrophobicContact CE1-CB 4.25Å; F608-A696 HydrophobicContact CE2-CB 4.38Å; F608-A696 HydrophobicContact CZ-CB 3.63Å; M686-A696 HydrophobicContact SD-CB 3.89Å
697	G	92.3	Very high	88.8	Confident	3 Å²	3	49.5 Å²	49.5	3%	0.031	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	148.5	-176.3	0	0	0	0	0	114.2	R684 F685	R684-G697 WeakPolarHBondContact CA-O 3.32Å; F685-G697 VanDerWaalsContact CE1-C 3.48Å; F685-G697 PolarHBondContact N-O 3Å; F685-G697 PolarHBondContact O-N 3.33Å
698	V	93.1	Very high	88.5	Confident	47 Å²	47	52.4 Å²	52.4	29%	0.285	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	119.4	179.3	-179.7	0	0	0	0	109	A603 R604 Y676 G683 T700	A603-V698 CarbonylContact C-O 3.57Å; A603-V698 WeakPolarHBondContact CA-O 3.49Å; A603-V698 VanDerWaalsContact CB-O 3.3Å; A603-V698 WeakPolarHBondContact CB-O 3.46Å; R604-V698 PolarHBondContact N-O 3.32Å; R604-V698 PolarHBondContact O-N 2.61Å; Y676-V698 HydrophobicContact CD1-CG1 3.57Å; Y676-V698 HydrophobicContact CD2-CG1 3.86Å; Y676-V698 HydrophobicContact CE1-CG1 4.34Å; Y676-V698 HydrophobicContact CG-CG1 3.29Å; G683-V698 CarbonylContact O-C 3.6Å; G683-V698 WeakPolarHBondContact O-CA 3.33Å; V698-T700 PolarHBondContact O-N 3.33Å
699	V	94.5	Very high	88.4	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.012	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	122.8	-178.2	-175	0	0	0	0	110.2	F601 E674 L675 Y676 G683 F685 I702	F601-V699 HydrophobicContact CD2-CG1 4.44Å; F601-V699 HydrophobicContact CD2-CG2 4.36Å; F601-V699 HydrophobicContact CE2-CG2 4.45Å; E674-V699 WeakPolarHBondContact O-CB 3.25Å; E674-V699 WeakPolarHBondContact O-CG1 3.22Å; L675-V699 HydrophobicContact CD2-CG1 4.14Å; Y676-V699 PolarHBondContact N-O 3.19Å; G683-V699 PolarHBondContact O-N 2.93Å; F685-V699 HydrophobicContact CD1-CG2 3.9Å; F685-V699 HydrophobicContact CE1-CG2 3.95Å; V699-I702 HydrophobicContact CG1-CG1 4.17Å
700	T	92.5	Very high	88.3	Confident	54 Å²	54	51.9 Å²	51.9	33%	0.331	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-35.1	-176	52.1	0	0	0	0	114	R602 R604 V698	R602-T700 PolarHBondContact O-N 3.38Å; R602-T700 PolarHBondContact O-OG1 3.46Å; R604-T700 HydrophobicContact CB-CG2 3.99Å; V698-T700 PolarHBondContact O-N 3.33Å
701	E	92.9	Very high	88.5	Confident	91 Å²	91	47.1 Å²	47.1	43%	0.425	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	132.6	176.8	-51.5	172.6	-178.3	0	0	109.1	R602	R602-E701 HydrophobicContact CB-CB 4.17Å; R602-E701 WeakPolarHBondContact CD-OE2 3.13Å; R602-E701 IonicContact CZ-OE2 2.7Å; R602-E701 PolarHBondContact N-O 2.68Å; R602-E701 IonicContact NE-OE2 3.4Å; R602-E701 IonicContact NH1-OE1 2.61Å; R602-E701 IonicContact NH1-OE2 3.37Å; R602-E701 PolarHBondContact NH1-OE2 3.02Å; R602-E701 PolarHBondContact O-N 3.34Å; R602-E701 VanDerWaalsContact O-N 3.09Å
702	I	89.6	Confident	89.1	Confident	43 Å²	43	47.5 Å²	47.5	22%	0.221	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	149.4	172.9	-71.5	156.9	0	0	0	109.3	C598 L673 L675 V699	C598-I702 HydrophobicContact CB-CG2 3.85Å; L673-I702 WeakPolarHBondContact O-CD1 3.31Å; L675-I702 HydrophobicContact CD2-CB 4.38Å; L675-I702 HydrophobicContact CD2-CD1 3.7Å; L675-I702 HydrophobicContact CD2-CG1 3.78Å; L675-I702 HydrophobicContact CG-CD1 4.2Å; V699-I702 HydrophobicContact CG1-CG1 4.17Å
703	K	86.2	Confident	89.5	Confident	58 Å²	58	45.3 Å²	45.3	25%	0.252	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	165.2	174	-61.3	-174.5	171.7	-167.6	0	110.8	C598 R600 E664	C598-K703 WeakPolarHBondContact CB-O 3.39Å; R600-K703 HydrophobicContact CB-CB 4.29Å; R600-K703 CarbonylContact O-C 3.45Å; R600-K703 WeakPolarHBondContact O-CA 3.45Å; R600-K703 WeakPolarHBondContact O-CB 3.28Å; R600-K703 PolarHBondContact O-N 3.02Å; E664-K703 IonicContact OE2-NZ 3.33Å; E664-K703 PolarHBondContact OE2-NZ 3.14Å
704	E	70.1	Confident	89.5	Confident	215 Å²	215	48.5 Å²	48.5	100%	1.005	25%	0.245	S	C	*	.			trans	-82.4	0	164.1	-65.9	156.5	-163.9	0	0	110.1	R600	R600-E704 PolarHBondContact NH1-O 3.2Å

Retrieved 704 of 704 residues in 151.7 ms (Link to these results)

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