A0A087Y1B3_POEFO Loading...

DNA replication licensing factor MCM2

AlphaFold DB , UniProt , Accession A0A087Y1B3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 886 aa.

						>A0A087Y1B3_POEFO|A0A087Y1B3
MADSSESFHMATSPSRASRRGDLTSSPGRDLPPFEDESEGLLGDGPLPEEDDGEELIGDGMERDYRAIPELDRYEAEGLDLDDEDLSELSPGARAAAEEAMRRRDREQGLSGRLRRGLLYDSEDEDDGPPGARRRRIAERAAEGITDGDEEEMIESIENLEDMKGHTVREWVSMAAPRLEIYNRFKNFLRTHVDENGHNVFKEKISDMCKENRESLVVNYEDLAAREHVLAYFLPEAPTEMLKIFDEAAKEVVLAMYPKYDRIAHEIHVRICNLPLVEEIRALRQLHLNQLIRTSGVVSSCTGVLPQLSMVKYNCSKCSFVLGPFFQSQNQEVKPGSCPECQSQGPFEVNMEETVYQNYQRITIQESPGKVAAGRLPRSKDAVLLADLVDSCKPGDEIELTGIYHNNYDGSLNTANGFPVFATVILANHITRRDEGVAVAELTDEDVKAIVALSKDERIGERIFASIAPSIYGHEDIKRALALSLFGGEPKNPGGKHKVRGDINVLLCGDPGTAKSQFLKYVEKVASRAVFTTGQGASAVGLTAYVQRHPVSREWTLEAGALVLADRGVCLIDEFDKMNDADRTSIHEAMEQQSISISKAGIVTSLQARCTVMAAANPIGGRYDPSLTFSENVDLTEPIVSRFDVLCVVRDTVDPVQDEMLARFVVGSHIKHHPSNKEGGVALEDVVLPNSSDVPSIPQELLRKYIIYAKERVHPKLNQMDQDKVARIYSDLRKESMATGSIPITVRHIESMIRMAEAHAKMHLRDYVLEDDVNMAIRVMLESFIDTQKFSVMRSMRKTFARYLAFRRDNNELLLFILKQLVAEQVAYQRSRYGVQNDTIEIPEKDLHDKARQISIHNLSAFYDSELFRSNRFSHDGKKKLILQQF
					

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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	32.6	Very low	31	Very low	243 Å²	243	147 Å²	147	100%	1.197	83%	0.831	S	S	*	*				0	86.9	0	-71.6	179.4	173.4	0	0	105.6
2	A	31.9	Very low	30.9	Very low	94 Å²	94	146.3 Å²	146.3	78%	0.777	83%	0.833	S	S	*	*				86.9	140.1	93.6	0	0	0	0	0	110
3	D	33.5	Very low	31.2	Very low	157 Å²	157	143.4 Å²	143.4	84%	0.84	83%	0.827	S	S	*	*			cis	176.5	147.3	-19	-120	-23.2	0	0	0	103.3
4	S	33.9	Very low	31.7	Very low	106 Å²	106	142.1 Å²	142.1	74%	0.741	83%	0.827	S	S	*	*			trans	149.7	97.6	145.1	62.3	0	0	0	0	110.1
5	S	34.6	Very low	31.6	Very low	111 Å²	111	140.6 Å²	140.6	78%	0.776	83%	0.827	S	S	*	*				64.8	111.7	72.7	76.3	0	0	0	0	114.2
6	E	31.3	Very low	31.5	Very low	205 Å²	205	147.7 Å²	147.7	96%	0.958	84%	0.835	S	S	*	*			trans	-163.5	135.4	132.6	-109.5	172.8	-165.1	0	0	111.2
7	S	29.6	Very low	31.4	Very low	96 Å²	96	144.9 Å²	144.9	67%	0.671	84%	0.835	S	S	*	*			trans	-144.6	155.9	-174.3	50	0	0	0	0	109.7
8	F	28.5	Very low	31.4	Very low	175 Å²	175	143.7 Å²	143.7	77%	0.768	84%	0.836	S	S	*	*			trans	87.3	133.7	170.5	-63.9	-83.9	0	0	0	116.4
9	H	28.2	Very low	31.2	Very low	161 Å²	161	149 Å²	149	75%	0.745	84%	0.841	S	S	*	*			cis	-153.7	148.6	40.6	-95.6	-76	0	0	0	116
10	M	29	Very low	31.1	Very low	165 Å²	165	154.4 Å²	154.4	81%	0.813	85%	0.847	S	S	*	*			trans	5.6	138.8	146	-64.7	163.9	80.3	0	0	122.1
11	A	28.4	Very low	30.9	Very low	104 Å²	104	150.2 Å²	150.2	86%	0.86	84%	0.84	S	S	*	*				-168.9	133.8	122.5	0	0	0	0	0	112.8
12	T	29.8	Very low	30.7	Very low	139 Å²	139	145.8 Å²	145.8	85%	0.853	82%	0.821	S	S	*	*			trans	-79.4	156.3	177.7	30.9	0	0	0	0	114.1
13	S	33.9	Very low	30.7	Very low	108 Å²	108	148 Å²	148	76%	0.755	82%	0.819	S	S	*	*			trans	-32.9	162.6	176.3	61.9	0	0	0	0	119.5
14	P	38.3	Very low	30.5	Very low	126 Å²	126	146.5 Å²	146.5	82%	0.818	82%	0.815	S	S	*	*				-145.4	171.3	92.4	34.4	-15.1	0	0	0	117.2
15	S	30.4	Very low	30.3	Very low	119 Å²	119	147.1 Å²	147.1	83%	0.832	82%	0.82	S	S	*	*			trans	-57.7	158	-175.4	49.2	0	0	0	0	117.7
16	R	30.5	Very low	30.1	Very low	254 Å²	254	147.4 Å²	147.4	96%	0.958	82%	0.822	S	S	*	*			trans	-142.5	117.2	165.6	-144.7	173.2	178.7	-175.5	-1.2	112.4
17	A	29.3	Very low	30.4	Very low	101 Å²	101	143.7 Å²	143.7	84%	0.835	82%	0.816	S	S	*	*			trans	-80.5	148.5	173.5	0	0	0	0	0	111.9
18	S	30.9	Very low	30.4	Very low	122 Å²	122	142.6 Å²	142.6	85%	0.853	82%	0.819	S	S	*	*			trans	-94.9	141	175	50.8	0	0	0	0	112
19	R	28.6	Very low	30.7	Very low	245 Å²	245	145.7 Å²	145.7	93%	0.925	83%	0.826	S	S	*	*			trans	-141.1	155.3	172.5	-122.5	-173	-176.2	-170.5	1.2	110
20	R	29.1	Very low	30.9	Very low	257 Å²	257	146 Å²	146	97%	0.97	83%	0.833	S	S	*	*			trans	105.2	133.1	174.7	-65.3	-176.8	176.4	-157.8	-1	112.4
21	G	26.7	Very low	31.4	Very low	67 Å²	67	145.3 Å²	145.3	69%	0.691	83%	0.832	S	S	*	*			cis	148	122.5	4.5	0	0	0	0	0	109.9
22	D	29	Very low	31.9	Very low	149 Å²	149	145.7 Å²	145.7	80%	0.797	83%	0.825	S	S	*	*			trans	68.5	115.9	147.5	-65.7	-15.9	0	0	0	124.8
23	L	30.2	Very low	32.1	Very low	142 Å²	142	144.7 Å²	144.7	74%	0.743	82%	0.821	S	S	*	*				81.9	115.2	115	-67.8	170.6	0	0	0	123.3
24	T	29.8	Very low	32	Very low	124 Å²	124	149.7 Å²	149.7	76%	0.761	83%	0.83	S	S	*	*			trans	75	119.7	136.9	86.6	0	0	0	0	122.9
25	S	29.9	Very low	31.8	Very low	119 Å²	119	152.3 Å²	152.3	83%	0.832	83%	0.831	S	S	*	*				169.7	123.7	101.7	63	0	0	0	0	112.5
26	S	31.5	Very low	31.8	Very low	117 Å²	117	154 Å²	154	82%	0.818	83%	0.831	S	S	*	*			trans	-79.9	178.3	-179.6	-24.6	0	0	0	0	112.8
27	P	37	Very low	31.9	Very low	128 Å²	128	151.6 Å²	151.6	83%	0.831	83%	0.83	S	S	*	*			cis	-133.4	132.3	20.7	33.5	-11.6	0	0	0	116.9
28	G	29.3	Very low	32.3	Very low	72 Å²	72	151.5 Å²	151.5	74%	0.742	82%	0.824	S	S	*	*			trans	-84.5	141.4	164.3	0	0	0	0	0	111.1
29	R	34.1	Very low	32.6	Very low	241 Å²	241	155 Å²	155	91%	0.909	83%	0.826	S	S	*	*			trans	-57.9	131.7	170.7	-92.9	167.1	155.2	164.8	-8.1	110.7	L31	R29-L31 PolarHBondContact O-N 3.33Å; R29-L31 VanDerWaalsContact O-N 3.17Å
30	D	32.3	Very low	32.8	Very low	167 Å²	167	146.7 Å²	146.7	89%	0.893	82%	0.817	S	S	*	*			trans	-63.3	107.8	167.3	-67.9	-50.7	0	0	0	110.4
31	L	40.8	Very low	32.9	Very low	150 Å²	150	142.7 Å²	142.7	79%	0.785	81%	0.814	S	S	*	*			trans	-123.9	133.8	157	-79.6	161.5	0	0	0	105.8	R29	R29-L31 PolarHBondContact O-N 3.33Å; R29-L31 VanDerWaalsContact O-N 3.17Å
32	P	37.8	Very low	33.5	Very low	112 Å²	112	148.4 Å²	148.4	73%	0.727	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-64.9	146.2	-174.8	26.2	-32	0	0	0	110.9
33	P	35.6	Very low	33.6	Very low	119 Å²	119	145.1 Å²	145.1	77%	0.773	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-66.7	139.2	176.5	-10.6	26.4	0	0	0	110.1	E35	P33-E35 PolarHBondContact O-N 3.42Å
34	F	31.1	Very low	34.1	Very low	213 Å²	213	146.8 Å²	146.8	93%	0.934	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-55.9	117	164.5	-89.4	-101.6	0	0	0	108.9
35	E	33.5	Very low	34.1	Very low	181 Å²	181	143.6 Å²	143.6	85%	0.846	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-76.8	132.5	167.8	-72.6	-179.2	153.6	0	0	109	P33 E37	P33-E35 PolarHBondContact O-N 3.42Å; E35-E37 PolarHBondContact O-N 3.21Å
36	D	31.3	Very low	34.5	Very low	154 Å²	154	144.2 Å²	144.2	82%	0.824	83%	0.832	S	S	*	*			trans	-59.9	106.9	170.4	-87.9	-42.9	0	0	0	110.2	S38	D36-S38 PolarHBondContact O-N 3.18Å
37	E	31.9	Very low	34.5	Very low	203 Å²	203	146.5 Å²	146.5	95%	0.949	83%	0.834	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	62.9	168.7	-71.9	-166.5	136.8	0	0	111.4	E35	E35-E37 PolarHBondContact O-N 3.21Å
38	S	38.3	Very low	34.3	Very low	99 Å²	99	145.9 Å²	145.9	69%	0.692	83%	0.83	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.2	12.5	173.2	71.9	0	0	0	0	116.9	D36	D36-S38 PolarHBondContact O-N 3.18Å
39	E	37.2	Very low	34.5	Very low	195 Å²	195	151.3 Å²	151.3	91%	0.911	84%	0.836	S	S	*	*	S	Bend	trans	-144	97.6	167.9	-78.4	-166.1	152.1	0	0	111.4
40	G	31.9	Very low	34.5	Very low	71 Å²	71	149.1 Å²	149.1	73%	0.732	84%	0.836	S	S	*	*			trans	179.2	47	176.3	0	0	0	0	0	114.9
41	L	32.6	Very low	34.6	Very low	173 Å²	173	147.5 Å²	147.5	91%	0.906	83%	0.827	S	S	*	*			trans	-155.2	67.8	164.1	-136.6	85.1	0	0	0	112.3
42	L	38.9	Very low	34.7	Very low	187 Å²	187	148.8 Å²	148.8	98%	0.979	84%	0.835	S	S	*	*			trans	-131.5	97	158	-79.4	173.3	0	0	0	107.7
43	G	30.4	Very low	34.7	Very low	80 Å²	80	145.5 Å²	145.5	83%	0.825	82%	0.821	S	S	*	*			trans	-153.2	102.3	177	0	0	0	0	0	109.3
44	D	40.8	Very low	35	Very low	178 Å²	178	148.5 Å²	148.5	95%	0.952	83%	0.825	S	S	*	*			trans	-70.9	129.4	-178.6	-167.2	23.3	0	0	0	111.4
45	G	30.6	Very low	35.7	Very low	56 Å²	56	146.7 Å²	146.7	58%	0.577	82%	0.82	S	S	*	*			trans	160.9	123.9	177	0	0	0	0	0	112.2	L47	G45-L47 PolarHBondContact O-N 3.09Å
46	P	38.6	Very low	36.7	Very low	132 Å²	132	145.6 Å²	145.6	86%	0.857	82%	0.819	S	S	*	*			trans	-84.7	120.8	-171	32.5	-30.5	0	0	0	110.9
47	L	30.4	Very low	37.4	Very low	166 Å²	166	146.2 Å²	146.2	87%	0.869	82%	0.82	S	S	*	*			trans	-137.7	151.4	165.4	-82.2	175.5	0	0	0	109	G45	G45-L47 PolarHBondContact O-N 3.09Å
48	P	32.4	Very low	38.8	Very low	114 Å²	114	138.3 Å²	138.3	74%	0.74	79%	0.793	S	S	*	*				-84.2	144.7	-129.6	32.2	-34.9	0	0	0	112.9
49	E	33.7	Very low	39.7	Very low	186 Å²	186	142.3 Å²	142.3	87%	0.869	81%	0.807	S	S	*	*			trans	-66.7	129	169.7	-69.8	177.5	154.3	0	0	109.8	D51	E49-D51 PolarHBondContact O-N 3.37Å
50	E	33.6	Very low	40.4	Very low	196 Å²	196	135.3 Å²	135.3	92%	0.916	79%	0.787	S	S	*	*			trans	-71.6	98.8	163.8	-71.2	177.8	160.4	0	0	107.7	D52	E50-D52 PolarHBondContact O-N 3.28Å
51	D	34.6	Very low	41.3	Very low	132 Å²	132	139.6 Å²	139.6	71%	0.706	79%	0.79	S	S	*	*			trans	-93	80.2	178.2	-147.9	6.3	0	0	0	108.8	E49 G53	E49-D51 PolarHBondContact O-N 3.37Å; D51-G53 PolarHBondContact O-N 3.05Å
52	D	43.9	Very low	42.1	Very low	177 Å²	177	140.2 Å²	140.2	95%	0.947	79%	0.788	S	S	*	*			trans	-86.7	57.1	164.4	-86.5	-19.1	0	0	0	109.5	E50	E50-D52 PolarHBondContact O-N 3.28Å
53	G	37.6	Very low	42.8	Very low	43 Å²	43	142.1 Å²	142.1	44%	0.443	78%	0.782	S	S	.	*			trans	-112.6	111.1	162.6	0	0	0	0	0	108.4	D51 E55	D51-G53 PolarHBondContact O-N 3.05Å; G53-E55 PolarHBondContact O-N 3.18Å
54	E	42.4	Very low	43.9	Very low	183 Å²	183	145.6 Å²	145.6	86%	0.855	78%	0.782	S	S	*	*			trans	-61.3	111.5	170.9	-68.5	177.3	165	0	0	109.1	L56	E54-L56 PolarHBondContact O-N 3.5Å
55	E	44.9	Very low	44.4	Very low	175 Å²	175	144.4 Å²	144.4	82%	0.818	77%	0.765	S	S	*	*			trans	-63.2	92.1	173.5	-77	-174.2	153	0	0	110.4	G53 I57	G53-E55 PolarHBondContact O-N 3.18Å; E55-I57 PolarHBondContact O-N 2.64Å; E55-I57 VanDerWaalsContact O-N 3.14Å
56	L	53.8	Low	45.5	Very low	157 Å²	157	152.5 Å²	152.5	82%	0.822	78%	0.778	S	S	*	*	S	Bend	trans	-68.8	-1.9	178.9	-89.8	149.9	0	0	0	114.8	E54	E54-L56 PolarHBondContact O-N 3.5Å
57	I	46.7	Very low	46.3	Very low	168 Å²	168	149.6 Å²	149.6	86%	0.862	77%	0.765	S	S	*	*	S	Bend	trans	-142.9	73	-176.3	-45.2	178	0	0	0	109.9	E55	E55-I57 PolarHBondContact O-N 2.64Å; E55-I57 VanDerWaalsContact O-N 3.14Å
58	G	61.9	Low	47.7	Very low	36 Å²	36	146.2 Å²	146.2	37%	0.371	75%	0.747	S	S	.	*	S	Bend	trans	-138.5	170.7	171.6	0	0	0	0	0	112.2	G60 M61	G58-G60 PolarHBondContact O-N 3.18Å; G58-M61 PolarHBondContact O-N 3.15Å
59	D	56.2	Low	48.7	Very low	184 Å²	184	145.6 Å²	145.6	98%	0.984	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	2	-177.4	-74	-23.7	0	0	0	114.9
60	G	51.7	Low	49.7	Very low	48 Å²	48	145.3 Å²	145.3	50%	0.495	74%	0.741	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.9	-3.2	174.6	0	0	0	0	0	115.7	G58 E62 R63	G58-G60 PolarHBondContact O-N 3.18Å; G60-E62 PolarHBondContact O-N 3.16Å; G60-R63 PolarHBondContact O-N 3.09Å; G60-R63 VanDerWaalsContact O-N 3.12Å
61	M	51.9	Low	50.6	Low	160 Å²	160	142.7 Å²	142.7	79%	0.788	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-53.3	-30.2	-174.1	-170.8	179.6	-175.7	0	0	114.6	G58 R63	G58-M61 PolarHBondContact O-N 3.15Å; M61-R63 VanDerWaalsContact C-N 3.28Å; M61-R63 PolarHBondContact O-N 3.21Å
62	E	48.3	Very low	51.3	Low	186 Å²	186	140.7 Å²	140.7	87%	0.869	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-76	-10	-176.6	-65.3	-175	161.1	0	0	114.2	G60	G60-E62 PolarHBondContact O-N 3.16Å
63	R	55.3	Low	51.7	Low	228 Å²	228	142.1 Å²	142.1	86%	0.86	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-91.8	-13.5	-174.9	-73.3	-175.3	166.6	-162	-2.2	115.1	G60 M61	G60-R63 PolarHBondContact O-N 3.09Å; G60-R63 VanDerWaalsContact O-N 3.12Å; M61-R63 VanDerWaalsContact C-N 3.28Å; M61-R63 PolarHBondContact O-N 3.21Å
64	D	51.6	Low	52.3	Low	152 Å²	152	150.5 Å²	150.5	81%	0.813	73%	0.734	S	S	*	*	S	Bend	trans	-95.3	-4.1	-177.5	-75.5	-19.1	0	0	0	114.3	R66	D64-R66 PolarHBondContact O-N 3.28Å
65	Y	52.3	Low	52.5	Low	154 Å²	154	150.1 Å²	150.1	60%	0.604	73%	0.733	S	S	*	*			trans	-80.1	112.2	175.6	-162.7	-101.4	0	0	0	111.8	A67 D72	Y65-A67 HydrophobicContact CD1-CB 4.4Å; Y65-A67 HydrophobicContact CE1-CB 4.05Å; Y65-D72 PolarHBondContact OH-OD1 3.41Å; Y65-D72 VanDerWaalsContact OH-OD1 3.05Å; Y65-D72 PolarHBondContact OH-OD2 2.93Å
66	R	54.6	Low	52.7	Low	226 Å²	226	145.5 Å²	145.5	85%	0.853	72%	0.724	S	S	*	*			trans	-96.6	107.5	163.8	-74.3	-177.1	-179.4	176.3	2.4	108.7	D64 I68	D64-R66 PolarHBondContact O-N 3.28Å; R66-I68 PolarHBondContact O-N 3.03Å
67	A	55.4	Low	52.3	Low	71 Å²	71	147 Å²	147	59%	0.587	73%	0.727	S	S	*	*			trans	-59.4	121.3	174.8	0	0	0	0	0	110.4	Y65 P69	Y65-A67 HydrophobicContact CD1-CB 4.4Å; Y65-A67 HydrophobicContact CE1-CB 4.05Å; A67-P69 WeakPolarHBondContact O-CD 3.34Å
68	I	59.2	Low	52.6	Low	94 Å²	94	142.8 Å²	142.8	48%	0.482	73%	0.725	S	S	.	*			trans	-109.7	99.3	172.9	-60.4	165.4	0	0	0	106.5	R66 E70 L71 D72	R66-I68 PolarHBondContact O-N 3.03Å; I68-E70 PolarHBondContact O-N 3.32Å; I68-L71 HydrophobicContact CG2-CD1 4.09Å; I68-L71 PolarHBondContact O-N 3.17Å; I68-L71 VanDerWaalsContact O-N 3.15Å; I68-D72 PolarHBondContact O-N 2.84Å
69	P	52.6	Low	51.7	Low	101 Å²	101	146.3 Å²	146.3	66%	0.656	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-12.8	-168.8	-24.7	34.7	0	0	0	115.9	A67	A67-P69 WeakPolarHBondContact O-CD 3.34Å
70	E	55.3	Low	51.1	Low	180 Å²	180	145.4 Å²	145.4	84%	0.841	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-21.4	-179.5	-66.9	-179.6	172.4	0	0	113.4	I68	I68-E70 PolarHBondContact O-N 3.32Å
71	L	52.3	Low	50.8	Low	141 Å²	141	149.9 Å²	149.9	74%	0.738	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	-15.4	-177.8	-82.3	150.7	0	0	0	113.5	I68 R73	I68-L71 HydrophobicContact CG2-CD1 4.09Å; I68-L71 PolarHBondContact O-N 3.17Å; I68-L71 VanDerWaalsContact O-N 3.15Å; L71-R73 VanDerWaalsContact C-N 3.3Å; L71-R73 PolarHBondContact O-N 3.44Å
72	D	48.8	Very low	50.4	Low	90 Å²	90	149.7 Å²	149.7	48%	0.481	74%	0.744	S	S	.	*	S	Bend	trans	-92.1	24.2	177.8	-76	-18.7	0	0	0	113.3	Y65 I68	Y65-D72 PolarHBondContact OH-OD1 3.41Å; Y65-D72 VanDerWaalsContact OH-OD1 3.05Å; Y65-D72 PolarHBondContact OH-OD2 2.93Å; I68-D72 PolarHBondContact O-N 2.84Å
73	R	52.4	Low	50.2	Low	207 Å²	207	146.7 Å²	146.7	78%	0.781	73%	0.734	S	S	*	*	S	Bend	trans	-117.4	118.8	170.3	-71.6	-174.4	177.6	-172.7	-0.4	108.9	L71 E75	L71-R73 VanDerWaalsContact C-N 3.3Å; L71-R73 PolarHBondContact O-N 3.44Å; R73-E75 PolarHBondContact O-N 3.01Å
74	Y	50.4	Low	49.8	Very low	219 Å²	219	145.1 Å²	145.1	86%	0.859	74%	0.736	S	S	*	*			trans	-58.7	131.7	168.4	-69.2	-81.6	0	0	0	109.7	A76	Y74-A76 PolarHBondContact O-N 3.2Å
75	E	46.4	Very low	49.7	Very low	176 Å²	176	145.7 Å²	145.7	82%	0.822	74%	0.74	S	S	*	*			trans	-61.1	124.1	166.5	-85.1	179.8	156.5	0	0	108.7	R73 E77	R73-E75 PolarHBondContact O-N 3.01Å; E75-E77 PolarHBondContact O-N 3.36Å
76	A	49.7	Very low	49.2	Very low	77 Å²	77	144.6 Å²	144.6	64%	0.636	74%	0.743	S	S	*	*			trans	-82.7	5.1	-176.2	0	0	0	0	0	113.5	Y74 G78	Y74-A76 PolarHBondContact O-N 3.2Å; A76-G78 PolarHBondContact O-N 3.46Å
77	E	45.3	Very low	49	Very low	188 Å²	188	138.6 Å²	138.6	88%	0.879	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	106.4	174.4	-86.6	-173.5	157.3	0	0	110	E75	E75-E77 PolarHBondContact O-N 3.36Å
78	G	52.3	Low	48.7	Very low	80 Å²	80	144.4 Å²	144.4	83%	0.825	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	113.4	-0.1	175.1	0	0	0	0	0	115.3	A76	A76-G78 PolarHBondContact O-N 3.46Å
79	L	43.3	Very low	48.7	Very low	111 Å²	111	145.1 Å²	145.1	58%	0.581	76%	0.755	S	S	*	*			trans	-94.9	98.6	163.6	-78.8	161	0	0	0	108.2	L81	L79-L81 HydrophobicContact CB-CG 4.35Å; L79-L81 PolarHBondContact O-N 3.06Å
80	D	43.3	Very low	49.7	Very low	164 Å²	164	143.7 Å²	143.7	88%	0.877	75%	0.748	S	S	*	*			trans	-60.4	101	165.4	-82.5	-29.8	0	0	0	108.2
81	L	45.8	Very low	50.2	Low	142 Å²	142	140.8 Å²	140.8	74%	0.743	74%	0.744	S	S	*	*			trans	-99.1	17.4	-179.9	-79.7	166.8	0	0	0	112.8	L79	L79-L81 HydrophobicContact CB-CG 4.35Å; L79-L81 PolarHBondContact O-N 3.06Å
82	D	44.2	Very low	51.3	Low	156 Å²	156	136.5 Å²	136.5	83%	0.834	74%	0.735	S	S	*	*			trans	-116.7	70.7	177.6	-70.3	-19	0	0	0	110.4
83	D	44	Very low	52.5	Low	124 Å²	124	134.1 Å²	134.1	66%	0.663	73%	0.728	S	S	*	*			trans	-125.6	33	171.3	-107.6	1.3	0	0	0	111.8	L86	D83-L86 WeakPolarHBondContact OD1-CD1 3.45Å
84	E	47.9	Very low	53.4	Low	194 Å²	194	132.5 Å²	132.5	91%	0.907	72%	0.722	S	S	*	*	S	Bend	trans	-88	4.9	168.7	-92.1	-170.1	165.5	0	0	114.3
85	D	48.9	Very low	54.3	Low	165 Å²	165	124.7 Å²	124.7	88%	0.882	70%	0.702	S	S	*	*			trans	-143.6	63	175.3	-84.5	-42.9	0	0	0	113.5
86	L	41.5	Very low	55.7	Low	130 Å²	130	119.1 Å²	119.1	68%	0.681	69%	0.686	S	S	*	*			trans	-100.8	99.4	160.9	-91.2	155.6	0	0	0	109.5	D83 E88	D83-L86 WeakPolarHBondContact OD1-CD1 3.45Å; L86-E88 PolarHBondContact O-N 3.33Å
87	S	50.6	Low	56.8	Low	101 Å²	101	117.8 Å²	117.8	71%	0.706	68%	0.675	S	S	*	*			trans	-53.7	129.6	170.4	57.5	0	0	0	0	110.4	L89	S87-L89 PolarHBondContact O-N 3.22Å
88	E	49.5	Very low	58.2	Low	193 Å²	193	113.7 Å²	113.7	90%	0.902	66%	0.656	S	S	*	*			trans	-46.3	115.7	176.8	-71.1	-175.6	158.9	0	0	111	L86 S90	L86-E88 PolarHBondContact O-N 3.33Å; E88-S90 PolarHBondContact O-N 3.46Å
89	L	58.7	Low	59.1	Low	108 Å²	108	116 Å²	116	57%	0.565	65%	0.645	S	S	*	*			trans	-60.1	125.2	174.9	-128.7	78.8	0	0	0	108.5	S87 A93	S87-L89 PolarHBondContact O-N 3.22Å; L89-A93 HydrophobicContact CD2-CB 3.82Å; L89-A93 HydrophobicContact CG-CB 3.87Å
90	S	73.4	Confident	60.6	Low	72 Å²	72	113 Å²	113	50%	0.503	64%	0.636	S	S	.	*			trans	-53.2	146.9	179	74.5	0	0	0	0	111.1	E88 G92 A93 R94	E88-S90 PolarHBondContact O-N 3.46Å; S90-G92 PolarHBondContact O-N 3.11Å; S90-A93 WeakPolarHBondContact O-CB 3.37Å; S90-A93 PolarHBondContact O-N 2.68Å; S90-A93 PolarHBondContact OG-N 3.04Å; S90-R94 PolarHBondContact O-N 2.91Å; S90-R94 VanDerWaalsContact O-N 3.15Å
91	P	66.6	Low	61.8	Low	118 Å²	118	110.2 Å²	110.2	77%	0.766	62%	0.619	S	S	*	*	H	α-helix	trans	-52.4	-30.7	-178.3	-28.8	34.8	0	0	0	114.1	A95	P91-A95 PolarHBondContact O-N 3.37Å; P91-A95 VanDerWaalsContact O-N 3.16Å
92	G	74.8	Confident	62.9	Low	52 Å²	52	111 Å²	111	54%	0.536	61%	0.612	S	S	.	*	H	α-helix	trans	-71.5	-36.8	175.4	0	0	0	0	0	114.1	S90 R94 A96	S90-G92 PolarHBondContact O-N 3.11Å; G92-R94 VanDerWaalsContact C-N 3.34Å; G92-A96 PolarHBondContact O-N 3.1Å; G92-A96 VanDerWaalsContact O-N 3.16Å
93	A	73.8	Confident	64.1	Low	40 Å²	40	111.8 Å²	111.8	33%	0.331	60%	0.603	S	S	.	*	H	α-helix	trans	-70	-34	176.2	0	0	0	0	0	111.7	L89 S90 A97	L89-A93 HydrophobicContact CD2-CB 3.82Å; L89-A93 HydrophobicContact CG-CB 3.87Å; S90-A93 WeakPolarHBondContact O-CB 3.37Å; S90-A93 PolarHBondContact O-N 2.68Å; S90-A93 PolarHBondContact OG-N 3.04Å; A93-A97 WeakPolarHBondContact O-CB 3.26Å; A93-A97 PolarHBondContact O-N 3.38Å; A93-A97 VanDerWaalsContact O-N 3.11Å
94	R	70.8	Confident	65	Low	173 Å²	173	112.5 Å²	112.5	65%	0.653	60%	0.597	S	S	*	*	H	α-helix	trans	-68.4	-42.9	176.1	-163.9	174.5	-175.5	150.4	2.6	112.2	S90 G92 A97 E98	S90-R94 PolarHBondContact O-N 2.91Å; S90-R94 VanDerWaalsContact O-N 3.15Å; G92-R94 VanDerWaalsContact C-N 3.34Å; R94-A97 PolarHBondContact O-N 3Å; R94-E98 PolarHBondContact O-N 3.49Å
95	A	70.5	Confident	65.8	Low	54 Å²	54	107.1 Å²	107.1	45%	0.446	57%	0.574	S	S	.	*	H	α-helix	trans	-62.9	-42.5	176.2	0	0	0	0	0	112.1	P91 A97 E98 E99	P91-A95 PolarHBondContact O-N 3.37Å; P91-A95 VanDerWaalsContact O-N 3.16Å; A95-A97 PolarHBondContact O-N 3.48Å; A95-E98 PolarHBondContact O-N 3.08Å; A95-E99 WeakPolarHBondContact O-CB 3.27Å; A95-E99 PolarHBondContact O-N 3.25Å
96	A	75.6	Confident	66.5	Low	59 Å²	59	109.9 Å²	109.9	49%	0.488	57%	0.572	S	S	.	*	H	α-helix	trans	-65.8	-36.6	177.7	0	0	0	0	0	112.9	G92 E99 A100	G92-A96 PolarHBondContact O-N 3.1Å; G92-A96 VanDerWaalsContact O-N 3.16Å; A96-E99 PolarHBondContact O-N 3.38Å; A96-A100 WeakPolarHBondContact O-CB 3.39Å; A96-A100 PolarHBondContact O-N 3.49Å
97	A	71.9	Confident	67.1	Low	49 Å²	49	110.6 Å²	110.6	41%	0.405	57%	0.572	S	S	.	*	H	α-helix	trans	-69.4	-40.9	176.4	0	0	0	0	0	112.3	A93 R94 A95 E99 A100 M101	A93-A97 WeakPolarHBondContact O-CB 3.26Å; A93-A97 PolarHBondContact O-N 3.38Å; A93-A97 VanDerWaalsContact O-N 3.11Å; R94-A97 PolarHBondContact O-N 3Å; A95-A97 PolarHBondContact O-N 3.48Å; A97-E99 VanDerWaalsContact C-N 3.34Å; A97-A100 PolarHBondContact O-N 3.39Å; A97-M101 PolarHBondContact O-N 3.4Å
98	E	74.1	Confident	67.5	Low	103 Å²	103	111.8 Å²	111.8	48%	0.481	57%	0.567	S	S	.	*	H	α-helix	trans	-63.4	-39.8	173.4	-89.3	-174.6	175.9	0	0	112	R94 A95 M101 R102	R94-E98 PolarHBondContact O-N 3.49Å; A95-E98 PolarHBondContact O-N 3.08Å; E98-M101 PolarHBondContact O-N 3.43Å; E98-R102 VanDerWaalsContact O-CB 3.28Å; E98-R102 WeakPolarHBondContact O-CB 3.42Å; E98-R102 PolarHBondContact O-N 2.95Å
99	E	72.3	Confident	67.4	Low	129 Å²	129	105.8 Å²	105.8	60%	0.603	56%	0.557	S	S	*	*	H	α-helix	trans	-68.4	-36.3	178.6	-162.8	158.1	-144.4	0	0	111.9	A95 A96 A97 R102 R103	A95-E99 WeakPolarHBondContact O-CB 3.27Å; A95-E99 PolarHBondContact O-N 3.25Å; A96-E99 PolarHBondContact O-N 3.38Å; A97-E99 VanDerWaalsContact C-N 3.34Å; E99-R102 PolarHBondContact O-N 3.09Å; E99-R103 WeakPolarHBondContact O-CB 3.29Å; E99-R103 PolarHBondContact O-N 3.19Å
100	A	73.9	Confident	67.2	Low	46 Å²	46	107.3 Å²	107.3	38%	0.38	57%	0.565	S	S	.	*	H	α-helix	trans	-67.5	-39	173.8	0	0	0	0	0	113.1	A96 A97 R104	A96-A100 WeakPolarHBondContact O-CB 3.39Å; A96-A100 PolarHBondContact O-N 3.49Å; A97-A100 PolarHBondContact O-N 3.39Å; A100-R104 PolarHBondContact O-N 3.29Å
101	M	69.1	Low	65.5	Low	107 Å²	107	109.4 Å²	109.4	53%	0.527	58%	0.579	S	S	.	*	H	α-helix	trans	-69.1	-43.1	173.7	-73.8	-151.5	-70.6	0	0	111.4	A97 E98 R103 R104 D105	A97-M101 PolarHBondContact O-N 3.4Å; E98-M101 PolarHBondContact O-N 3.43Å; M101-R103 VanDerWaalsContact C-N 3.27Å; M101-R103 PolarHBondContact O-N 2.72Å; M101-R104 WeakPolarHBondContact O-CB 3.44Å; M101-R104 PolarHBondContact O-N 3.48Å; M101-D105 VanDerWaalsContact O-CG 3.31Å; M101-D105 PolarHBondContact O-N 2.99Å
102	R	68.1	Low	64.2	Low	158 Å²	158	107.3 Å²	107.3	60%	0.596	58%	0.579	S	S	*	*	H	α-helix	trans	-63	-33.4	178.2	-151.7	-173.1	-60.3	149.3	0.2	112.3	E98 E99 R106	E98-R102 VanDerWaalsContact O-CB 3.28Å; E98-R102 WeakPolarHBondContact O-CB 3.42Å; E98-R102 PolarHBondContact O-N 2.95Å; E99-R102 PolarHBondContact O-N 3.09Å; R102-R106 VanDerWaalsContact O-CB 3.31Å; R102-R106 WeakPolarHBondContact O-CB 3.39Å; R102-R106 PolarHBondContact O-N 3.43Å; R102-R106 VanDerWaalsContact O-N 3.08Å
103	R	70.2	Confident	62.4	Low	172 Å²	172	116.8 Å²	116.8	65%	0.649	60%	0.599	S	S	*	*	H	α-helix	trans	-67	-42.8	172.6	-166.4	-179.6	73.6	179.5	1.6	111.7	E99 M101 R106 E107	E99-R103 WeakPolarHBondContact O-CB 3.29Å; E99-R103 PolarHBondContact O-N 3.19Å; M101-R103 VanDerWaalsContact C-N 3.27Å; M101-R103 PolarHBondContact O-N 2.72Å; R103-R106 PolarHBondContact O-N 2.97Å; R103-E107 WeakPolarHBondContact O-CG 3.42Å; R103-E107 PolarHBondContact O-N 3.17Å
104	R	62.7	Low	60.3	Low	139 Å²	139	123.2 Å²	123.2	53%	0.525	63%	0.626	S	S	.	*	H	α-helix	trans	-66.2	-42	177.9	-159.3	-171.7	-57.3	169.6	2.9	111.9	A100 M101 R106 E107 Q108	A100-R104 PolarHBondContact O-N 3.29Å; M101-R104 WeakPolarHBondContact O-CB 3.44Å; M101-R104 PolarHBondContact O-N 3.48Å; R104-R106 VanDerWaalsContact C-N 3.3Å; R104-R106 PolarHBondContact O-N 2.9Å; R104-E107 PolarHBondContact O-N 3.41Å; R104-Q108 WeakPolarHBondContact O-CB 3.39Å; R104-Q108 WeakPolarHBondContact O-CG 3.37Å; R104-Q108 PolarHBondContact O-N 3.24Å
105	D	64.4	Low	58.5	Low	81 Å²	81	126.7 Å²	126.7	43%	0.433	64%	0.64	S	S	.	*	H	α-helix	trans	-67.6	-32.4	177.8	-67.1	-8.8	0	0	0	111.7	M101 Q108 G109	M101-D105 VanDerWaalsContact O-CG 3.31Å; M101-D105 PolarHBondContact O-N 2.99Å; D105-Q108 PolarHBondContact O-N 3.13Å; D105-G109 PolarHBondContact O-N 3.43Å
106	R	63.2	Low	56.5	Low	224 Å²	224	136 Å²	136	85%	0.845	66%	0.663	S	S	*	*	H	α-helix	trans	-71.4	-36.3	173.4	-164.6	177.5	-173.3	-172	1.6	112.4	R102 R103 R104 Q108	R102-R106 VanDerWaalsContact O-CB 3.31Å; R102-R106 WeakPolarHBondContact O-CB 3.39Å; R102-R106 PolarHBondContact O-N 3.43Å; R102-R106 VanDerWaalsContact O-N 3.08Å; R103-R106 PolarHBondContact O-N 2.97Å; R104-R106 VanDerWaalsContact C-N 3.3Å; R104-R106 PolarHBondContact O-N 2.9Å; R106-Q108 VanDerWaalsContact C-N 3.32Å
107	E	55.8	Low	54.3	Low	145 Å²	145	136.6 Å²	136.6	68%	0.678	68%	0.675	S	S	*	*	H	α-helix	trans	-70.1	-28.3	172.8	-75	170.3	-178.7	0	0	112.2	R103 R104	R103-E107 WeakPolarHBondContact O-CG 3.42Å; R103-E107 PolarHBondContact O-N 3.17Å; R104-E107 PolarHBondContact O-N 3.41Å
108	Q	57.9	Low	52.4	Low	126 Å²	126	142.3 Å²	142.3	59%	0.589	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-1.5	-178.9	-68.5	-178.2	1	0	0	114.5	R104 D105 R106 L110	R104-Q108 WeakPolarHBondContact O-CB 3.39Å; R104-Q108 WeakPolarHBondContact O-CG 3.37Å; R104-Q108 PolarHBondContact O-N 3.24Å; D105-Q108 PolarHBondContact O-N 3.13Å; R106-Q108 VanDerWaalsContact C-N 3.32Å; Q108-L110 PolarHBondContact O-N 2.66Å; Q108-L110 VanDerWaalsContact O-N 3.12Å
109	G	48.6	Very low	50.1	Low	67 Å²	67	146 Å²	146	69%	0.691	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.9	9.2	171.5	0	0	0	0	0	115.9	D105 S111	D105-G109 PolarHBondContact O-N 3.43Å; G109-S111 PolarHBondContact O-N 2.98Å
110	L	54	Low	48.2	Very low	140 Å²	140	150.3 Å²	150.3	73%	0.733	73%	0.732	S	S	*	*			trans	-89.5	90.4	175	-92.8	96.7	0	0	0	110.7	Q108	Q108-L110 PolarHBondContact O-N 2.66Å; Q108-L110 VanDerWaalsContact O-N 3.12Å
111	S	37.8	Very low	45.9	Very low	116 Å²	116	155 Å²	155	81%	0.811	75%	0.751	S	S	*	*			trans	-135.4	102.3	157.1	-170.4	0	0	0	0	110.5	G109	G109-S111 PolarHBondContact O-N 2.98Å
112	G	38.3	Very low	43.9	Very low	74 Å²	74	153.9 Å²	153.9	76%	0.763	75%	0.753	S	S	*	*			trans	-67.8	138.6	171.4	0	0	0	0	0	111.9
113	R	37.3	Very low	42	Very low	250 Å²	250	154.6 Å²	154.6	94%	0.943	76%	0.763	S	S	*	*			trans	-59.3	129.6	177.6	-70.9	173.8	173.6	179.6	-0.8	112.3
114	L	29.6	Very low	40.1	Very low	175 Å²	175	152.9 Å²	152.9	92%	0.916	77%	0.767	S	S	*	*			trans	-144.1	124.4	147.6	-105.2	151.4	0	0	0	110
115	R	33.1	Very low	38.5	Very low	247 Å²	247	154.8 Å²	154.8	93%	0.932	78%	0.782	S	S	*	*			trans	-67	134.2	176.7	-83.4	-179.9	166.1	-173.5	-2.6	111.2
116	R	27.9	Very low	36.8	Very low	250 Å²	250	157.9 Å²	157.9	94%	0.943	80%	0.799	S	S	*	*			trans	-164.9	119.6	135.5	-146.7	166.9	-179.7	172.4	-1.7	113.6
117	G	30.4	Very low	35.3	Very low	70 Å²	70	154.5 Å²	154.5	72%	0.722	80%	0.797	S	S	*	*			trans	64.5	116.6	131.1	0	0	0	0	0	121.4
118	L	31	Very low	34.1	Very low	170 Å²	170	150.7 Å²	150.7	89%	0.89	80%	0.797	S	S	*	*			trans	-9.2	136	152.1	-81.2	88.8	0	0	0	118
119	L	27.2	Very low	33.1	Very low	180 Å²	180	150.6 Å²	150.6	94%	0.942	81%	0.808	S	S	*	*				-164.9	152.9	127.9	-98.1	156.3	0	0	0	110.6
120	Y	31.9	Very low	32.5	Very low	220 Å²	220	154 Å²	154	86%	0.863	82%	0.817	S	S	*	*			trans	-82.2	174.6	-171	-123.4	-105.2	0	0	0	113.3
121	D	25.9	Very low	32	Very low	144 Å²	144	150.2 Å²	150.2	77%	0.77	81%	0.813	S	S	*	*			trans	81.8	138.2	171.9	-83.2	-2.6	0	0	0	117.7
122	S	26.8	Very low	32.2	Very low	84 Å²	84	148.6 Å²	148.6	59%	0.587	81%	0.806	S	S	*	*			cis	-176.6	148.4	-13.2	39.2	0	0	0	0	106.8
123	E	28.2	Very low	32.4	Very low	172 Å²	172	155.5 Å²	155.5	80%	0.804	81%	0.809	S	S	*	*			trans	63.6	138.2	159.8	-64.1	168.6	-171.8	0	0	116.7
124	D	29.2	Very low	32.9	Very low	137 Å²	137	154.5 Å²	154.5	73%	0.733	81%	0.805	S	S	*	*			cis	-162.8	142	-1	-84.6	-35.8	0	0	0	102.4
125	E	30	Very low	33.5	Very low	179 Å²	179	156 Å²	156	84%	0.836	80%	0.799	S	S	*	*				154.4	125.2	86.2	-121.5	170.5	-173.1	0	0	104
126	D	28.9	Very low	34	Very low	146 Å²	146	153.6 Å²	153.6	78%	0.781	79%	0.79	S	S	*	*			trans	150.1	137.3	141.2	-90.9	-25.7	0	0	0	115.4
127	D	32	Very low	34.9	Very low	152 Å²	152	147.4 Å²	147.4	81%	0.813	77%	0.774	S	S	*	*			trans	77.2	131.6	148.2	-72	-40.7	0	0	0	123.1
128	G	30.4	Very low	35.6	Very low	66 Å²	66	147.4 Å²	147.4	68%	0.68	77%	0.767	S	S	*	*			trans	-75.4	175.3	-174.7	0	0	0	0	0	116.4
129	P	35.6	Very low	36.3	Very low	124 Å²	124	145.8 Å²	145.8	81%	0.805	76%	0.755	S	S	*	*			trans	-97.6	140.5	-155.1	34.1	-32.6	0	0	0	115.4
130	P	37.9	Very low	37.4	Very low	137 Å²	137	147.7 Å²	147.7	89%	0.89	75%	0.75	S	S	*	*			trans	-99	75	160.6	35.3	-27.2	0	0	0	110.7
131	G	42.1	Very low	38.2	Very low	62 Å²	62	141.4 Å²	141.4	64%	0.639	74%	0.744	S	S	*	*			trans	-97.4	-3.2	-179.3	0	0	0	0	0	116.3
132	A	43.4	Very low	39.1	Very low	82 Å²	82	138.6 Å²	138.6	68%	0.678	74%	0.74	S	S	*	*	S	Bend	trans	-94.3	-9.5	-163.2	0	0	0	0	0	116.2
133	R	42.4	Very low	39.8	Very low	218 Å²	218	141.6 Å²	141.6	82%	0.823	75%	0.745	S	S	*	*	S	Bend	trans	-93.6	-26	-174.4	-153.3	173.3	-176.9	-177.5	-0.7	114.4
134	R	46	Very low	40.4	Very low	229 Å²	229	137.3 Å²	137.3	86%	0.864	75%	0.747	S	S	*	*	H	α-helix	trans	-79.3	-23.2	-179	-82.1	-179	173	173	-1.8	114.3
135	R	42.6	Very low	40.6	Very low	206 Å²	206	138.1 Å²	138.1	78%	0.777	75%	0.749	S	S	*	*	H	α-helix	trans	-79.4	-29.9	-179.1	-145	173.3	-174.1	171.3	0.9	113.3	E139	R135-E139 PolarHBondContact O-N 3.23Å
136	R	43.9	Very low	41.1	Very low	197 Å²	197	135.3 Å²	135.3	74%	0.743	75%	0.745	S	S	*	*	H	α-helix	trans	-75.4	-24.4	178.1	-80.6	-176	-178.6	174.7	1.6	114.5	R140	R136-R140 PolarHBondContact O-N 2.92Å
137	I	48	Very low	41.2	Very low	120 Å²	120	135.8 Å²	135.8	62%	0.615	75%	0.747	S	S	*	*	H	α-helix	trans	-79.9	-35.8	179.6	-64.4	169.1	0	0	0	110.4	R140 A141	I137-R140 PolarHBondContact O-N 3.1Å; I137-A141 PolarHBondContact O-N 3.5Å
138	A	45.2	Very low	41.2	Very low	70 Å²	70	132.1 Å²	132.1	58%	0.579	75%	0.746	S	S	*	*	H	α-helix	trans	-69.9	-31.9	176	0	0	0	0	0	113.2
139	E	45.5	Very low	41.2	Very low	136 Å²	136	136.1 Å²	136.1	64%	0.636	75%	0.751	S	S	*	*	H	α-helix	trans	-71.2	-35.8	173.8	-90.4	176.3	157.4	0	0	112.5	R135 A141 A142	R135-E139 PolarHBondContact O-N 3.23Å; E139-A141 VanDerWaalsContact C-N 3.32Å; E139-A141 PolarHBondContact O-N 3.1Å; E139-A142 PolarHBondContact O-N 3.4Å
140	R	49.6	Very low	41.2	Very low	220 Å²	220	140 Å²	140	83%	0.83	76%	0.759	S	S	*	*	H	α-helix	trans	-72	-24.3	179.4	-121.7	176.8	-176.2	175.3	-1.9	113.8	R136 I137 A142	R136-R140 PolarHBondContact O-N 2.92Å; I137-R140 PolarHBondContact O-N 3.1Å; R140-A142 VanDerWaalsContact C-N 3.32Å
141	A	48.4	Very low	41.3	Very low	89 Å²	89	142.5 Å²	142.5	74%	0.736	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-12.2	176.2	0	0	0	0	0	113.5	I137 E139	I137-A141 PolarHBondContact O-N 3.5Å; E139-A141 VanDerWaalsContact C-N 3.32Å; E139-A141 PolarHBondContact O-N 3.1Å
142	A	45.2	Very low	41.2	Very low	84 Å²	84	148 Å²	148	69%	0.694	77%	0.768	S	S	*	*	S	Bend	trans	-90.3	-15.6	-179.2	0	0	0	0	0	113.7	E139 R140	E139-A142 PolarHBondContact O-N 3.4Å; R140-A142 VanDerWaalsContact C-N 3.32Å
143	E	41.6	Very low	40.6	Very low	148 Å²	148	152 Å²	152	69%	0.692	77%	0.774	S	S	*	*	S	Bend	trans	-101.4	83.7	178.2	-68.1	-176	165.7	0	0	109.8	I145	E143-I145 PolarHBondContact O-N 3.1Å
144	G	40.9	Very low	40.5	Very low	81 Å²	81	148.9 Å²	148.9	84%	0.835	77%	0.772	S	S	*	*			trans	-61.2	92.7	-179.5	0	0	0	0	0	113.9
145	I	33.4	Very low	40	Very low	154 Å²	154	145.7 Å²	145.7	79%	0.79	77%	0.767	S	S	*	*			trans	-106.6	107.9	165.3	-63.5	172.8	0	0	0	107.3	E143	E143-I145 PolarHBondContact O-N 3.1Å
146	T	40	Very low	40	Very low	121 Å²	121	140 Å²	140	74%	0.742	76%	0.759	S	S	*	*			trans	-82.4	121.6	162.1	48.8	0	0	0	0	108
147	D	30.9	Very low	40.5	Very low	155 Å²	155	136.3 Å²	136.3	83%	0.829	75%	0.753	S	S	*	*			trans	-178.2	121.3	141.9	-91.2	-23.8	0	0	0	110.5	D149	D147-D149 PolarHBondContact O-N 3.37Å
148	G	32.5	Very low	40.7	Very low	76 Å²	76	133 Å²	133	78%	0.784	74%	0.735	S	S	*	*	S	Bend		97.8	-9.5	118.5	0	0	0	0	0	121.3
149	D	29.3	Very low	41.4	Very low	149 Å²	149	134.7 Å²	134.7	80%	0.797	73%	0.734	S	S	*	*			trans	-135.9	81.2	-176	-68.4	-41.1	0	0	0	112.2	D147	D147-D149 PolarHBondContact O-N 3.37Å
150	E	35.7	Very low	42.3	Very low	205 Å²	205	128.4 Å²	128.4	96%	0.958	71%	0.705	S	S	*	*			trans	-101.7	14.2	170.6	-81	-172.9	169.2	0	0	113.6
151	E	41.5	Very low	42.9	Very low	190 Å²	190	124.8 Å²	124.8	89%	0.888	70%	0.697	S	S	*	*	S	Bend	trans	-101.7	-2.1	173.5	-76.1	-171.2	163.3	0	0	114.8
152	E	38.3	Very low	43.9	Very low	178 Å²	178	125 Å²	125	83%	0.832	69%	0.686	S	S	*	*	S	Bend	trans	-133.4	62.3	178.5	-72.5	-168.9	165.2	0	0	113.7
153	M	32.1	Very low	44.8	Very low	166 Å²	166	123.7 Å²	123.7	82%	0.818	67%	0.666	S	S	*	*			trans	-145.6	78.5	149.8	-84.5	-151.3	-61.3	0	0	110.1	E155	M153-E155 PolarHBondContact O-N 3.01Å
154	I	39.8	Very low	46.1	Very low	153 Å²	153	122.2 Å²	122.2	79%	0.785	66%	0.658	S	S	*	*			trans	-70.3	89.7	157.4	-58.7	167.3	0	0	0	105.8	S156	I154-S156 PolarHBondContact O-N 3.37Å; I154-S156 VanDerWaalsContact O-N 3.12Å
155	E	36.1	Very low	47.8	Very low	161 Å²	161	122.3 Å²	122.3	75%	0.752	66%	0.659	S	S	*	*			trans	-58.2	113	154.5	-74.2	-170.3	153.7	0	0	106.5	M153	M153-E155 PolarHBondContact O-N 3.01Å
156	S	42.2	Very low	50.3	Low	86 Å²	86	118.6 Å²	118.6	60%	0.601	64%	0.638	S	S	*	*			trans	36.6	111.9	157.9	48.1	0	0	0	0	116.5	I154 E158	I154-S156 PolarHBondContact O-N 3.37Å; I154-S156 VanDerWaalsContact O-N 3.12Å; S156-E158 PolarHBondContact O-N 3.19Å
157	I	55	Low	52.5	Low	120 Å²	120	116.6 Å²	116.6	62%	0.615	63%	0.626	S	S	*	*			trans	-47.4	96.6	152.4	-60.5	158.8	0	0	0	106.7	N159	I157-N159 PolarHBondContact O-N 3.19Å
158	E	51.8	Low	55.2	Low	51 Å²	51	109.3 Å²	109.3	24%	0.238	59%	0.586	C	S	.	*			trans	-66.2	121	167.1	-77.1	-164.3	136.2	0	0	105.1	S156 L160 K164 A176	S156-E158 PolarHBondContact O-N 3.19Å; E158-L160 PolarHBondContact O-N 3.25Å; E158-K164 IonicContact OE1-NZ 3.38Å; E158-K164 PolarHBondContact OE1-NZ 3.2Å; E158-A176 WeakPolarHBondContact OE2-CB 3.45Å
159	N	59.8	Low	57.8	Low	105 Å²	105	111 Å²	111	56%	0.561	57%	0.569	S	S	*	*			trans	-60.8	108.1	168.8	-76.4	-12.4	0	0	0	106.7	I157 E161 D162	I157-N159 PolarHBondContact O-N 3.19Å; N159-E161 PolarHBondContact O-N 3.15Å; N159-D162 PolarHBondContact O-N 3.25Å
160	L	64.9	Low	60.6	Low	4 Å²	4	109.2 Å²	109.2	2%	0.021	56%	0.556	C	S	.	*	T	Hydrogen-bonded Turn	trans	-53.7	-20.2	173.1	-85.3	157	0	0	0	112.5	E158 P177 E180 I181 V229 F233	E158-L160 PolarHBondContact O-N 3.25Å; L160-P177 HydrophobicContact CD2-CB 4.28Å; L160-E180 HydrophobicContact CD1-CB 4.49Å; L160-E180 HydrophobicContact CD1-CG 3.61Å; L160-E180 HydrophobicContact CG-CG 4.07Å; L160-I181 HydrophobicContact CD2-CD1 4.34Å; L160-I181 HydrophobicContact CD2-CG1 4.04Å; L160-V229 HydrophobicContact CB-CG1 3.84Å; L160-V229 HydrophobicContact CD1-CG1 4.25Å; L160-F233 HydrophobicContact CB-CE2 4.38Å; L160-F233 HydrophobicContact CD2-CE2 4.24Å
161	E	61.7	Low	63.1	Low	144 Å²	144	99.6 Å²	99.6	67%	0.673	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-25.8	175.5	-62.4	174.5	-173.8	0	0	113.5	N159 M163	N159-E161 PolarHBondContact O-N 3.15Å; E161-M163 PolarHBondContact O-N 3.39Å
162	D	68.6	Low	65.3	Low	94 Å²	94	90.6 Å²	90.6	50%	0.503	47%	0.469	S	S	.	.			trans	-91.4	83.6	175.2	-172.8	5.3	0	0	0	109.7	N159 K164 W171	N159-D162 PolarHBondContact O-N 3.25Å; D162-K164 PolarHBondContact O-N 2.9Å; D162-K164 PolarHBondContact OD1-N 3.36Å; D162-W171 WeakPolarHBondContact O-CH2 3.38Å; D162-W171 WeakPolarHBondContact O-CZ2 3.34Å
163	M	65.1	Low	67.7	Low	56 Å²	56	85.8 Å²	85.8	28%	0.276	46%	0.455	S	S	.	.			trans	-66.1	1.9	179.2	-61.6	-145.1	-64.5	0	0	114	E161 G165 H166 V168 F233	E161-M163 PolarHBondContact O-N 3.39Å; M163-G165 PolarHBondContact O-N 2.9Å; M163-H166 PolarHBondContact O-N 2.9Å; M163-V168 HydrophobicContact CE-CG2 3.71Å; M163-V168 HydrophobicContact SD-CG2 3.63Å; M163-F233 HydrophobicContact CG-CZ 4.41Å; M163-F233 HydrophobicContact SD-CE1 3.52Å; M163-F233 VanDerWaalsContact SD-CE1 3.52Å; M163-F233 HydrophobicContact SD-CZ 3.96Å
164	K	69.3	Low	70.4	Confident	118 Å²	118	80.8 Å²	80.8	51%	0.513	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	24	178	-68.4	176.7	-175.9	167.7	0	114.3	E158 D162 W171	E158-K164 IonicContact OE1-NZ 3.38Å; E158-K164 PolarHBondContact OE1-NZ 3.2Å; D162-K164 PolarHBondContact O-N 2.9Å; D162-K164 PolarHBondContact OD1-N 3.36Å; K164-W171 HydrophobicContact CB-CZ3 4.21Å; K164-W171 HydrophobicContact CD-CH2 4.02Å; K164-W171 HydrophobicContact CD-CZ3 4.03Å; K164-W171 HydrophobicContact CG-CH2 4.3Å; K164-W171 HydrophobicContact CG-CZ3 4.33Å
165	G	76.5	Confident	72.7	Confident	83 Å²	83	77 Å²	77	86%	0.856	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	12.1	-177.5	0	0	0	0	0	116	M163	M163-G165 PolarHBondContact O-N 2.9Å
166	H	85.1	Confident	75.1	Confident	75 Å²	75	71.7 Å²	71.7	35%	0.347	41%	0.405	S	S	.	.			trans	-82	157	173.9	-68.9	-79.7	0	0	0	112	M163 E170 W171 M174	M163-H166 PolarHBondContact O-N 2.9Å; H166-E170 IonicContact ND1-OE2 3.83Å; H166-W171 HydrophobicContact CB-CB 4.33Å; H166-W171 HydrophobicContact CB-CE3 4.35Å; H166-M174 HydrophobicContact CB-CE 4.09Å; H166-M174 VanDerWaalsContact CD2-CE 3.47Å; H166-M174 WeakPolarHBondContact CD2-CE 3.43Å; H166-M174 WeakPolarHBondContact ND1-CE 3.46Å
167	T	87.1	Confident	77.3	Confident	80 Å²	80	67.7 Å²	67.7	49%	0.491	38%	0.378	S	S	.	.			trans	-68.8	149.1	167.4	63.8	0	0	0	0	109.4	R169 E170 W171	T167-R169 PolarHBondContact O-N 3.5Å; T167-E170 PolarHBondContact O-N 3.28Å; T167-E170 VanDerWaalsContact O-N 3.09Å; T167-E170 WeakPolarHBondContact OG1-CG 3.37Å; T167-E170 PolarHBondContact OG1-N 3.31Å; T167-W171 WeakPolarHBondContact O-CB 3.33Å; T167-W171 PolarHBondContact O-N 2.95Å
168	V	86.7	Confident	79	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.006	37%	0.367	C	S	.	.	H	α-helix	trans	-55.3	-39.4	-178.6	172.4	0	0	0	0	111.9	M163 W171 V172 F233 E236 A237	M163-V168 HydrophobicContact CE-CG2 3.71Å; M163-V168 HydrophobicContact SD-CG2 3.63Å; V168-W171 PolarHBondContact O-N 3.39Å; V168-V172 HydrophobicContact CG1-CG2 4.32Å; V168-V172 VanDerWaalsContact O-CG2 3.3Å; V168-V172 WeakPolarHBondContact O-CG2 3.27Å; V168-V172 PolarHBondContact O-N 3.3Å; V168-F233 HydrophobicContact CB-CD1 4.46Å; V168-F233 HydrophobicContact CG1-CB 4.4Å; V168-F233 HydrophobicContact CG1-CD1 3.52Å; V168-F233 HydrophobicContact CG1-CE1 4.19Å; V168-F233 HydrophobicContact CG1-CG 4.3Å; V168-F233 HydrophobicContact CG2-CD1 4.09Å; V168-F233 HydrophobicContact CG2-CE1 4.07Å; V168-E236 HydrophobicContact CB-CG 3.98Å; V168-E236 WeakPolarHBondContact CB-OE1 3.15Å; V168-E236 HydrophobicContact CG1-CB 4.16Å; V168-E236 HydrophobicContact CG1-CG 4.17Å; V168-E236 HydrophobicContact CG2-CG 4.28Å; V168-E236 VanDerWaalsContact CG2-OE1 3.24Å; V168-E236 WeakPolarHBondContact CG2-OE1 3.44Å; V168-E236 VanDerWaalsContact CG2-OE2 3.25Å; V168-E236 WeakPolarHBondContact CG2-OE2 3.34Å; V168-A237 HydrophobicContact CG1-CB 4.08Å
169	R	87.4	Confident	80.8	Confident	112 Å²	112	69.3 Å²	69.3	42%	0.423	38%	0.381	S	S	.	.	H	α-helix	trans	-60.3	-52.4	176.2	-174.9	178.7	-69.3	177	-3.2	112	T167 W171 V172 S173 A237 E240 N289	T167-R169 PolarHBondContact O-N 3.5Å; R169-W171 VanDerWaalsContact C-N 3.27Å; R169-W171 PolarHBondContact O-N 3.44Å; R169-V172 PolarHBondContact O-N 2.87Å; R169-S173 PolarHBondContact O-N 2.99Å; R169-A237 HydrophobicContact CB-CB 4.38Å; R169-E240 WeakPolarHBondContact CG-OE1 3.46Å; R169-N289 VanDerWaalsContact NH2-CB 3.31Å
170	E	88.8	Confident	82.2	Confident	112 Å²	112	66.5 Å²	66.5	52%	0.523	36%	0.364	S	S	.	.	H	α-helix	trans	-64.5	-35.5	179.4	-71.8	178.1	170.6	0	0	112.1	H166 T167 S173 M174	H166-E170 IonicContact ND1-OE2 3.83Å; T167-E170 PolarHBondContact O-N 3.28Å; T167-E170 VanDerWaalsContact O-N 3.09Å; T167-E170 WeakPolarHBondContact OG1-CG 3.37Å; T167-E170 PolarHBondContact OG1-N 3.31Å; E170-S173 WeakPolarHBondContact O-CB 3.35Å; E170-S173 PolarHBondContact O-N 3.37Å; E170-M174 WeakPolarHBondContact O-CG 3.49Å; E170-M174 PolarHBondContact O-N 2.97Å
171	W	87.9	Confident	83.4	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.008	36%	0.363	C	S	.	.	H	α-helix	trans	-62.1	-49.9	178.2	-175.3	-116.7	0	0	0	112.1	D162 K164 H166 T167 V168 R169 S173 M174 P177	D162-W171 WeakPolarHBondContact O-CH2 3.38Å; D162-W171 WeakPolarHBondContact O-CZ2 3.34Å; K164-W171 HydrophobicContact CB-CZ3 4.21Å; K164-W171 HydrophobicContact CD-CH2 4.02Å; K164-W171 HydrophobicContact CD-CZ3 4.03Å; K164-W171 HydrophobicContact CG-CH2 4.3Å; K164-W171 HydrophobicContact CG-CZ3 4.33Å; H166-W171 HydrophobicContact CB-CB 4.33Å; H166-W171 HydrophobicContact CB-CE3 4.35Å; T167-W171 WeakPolarHBondContact O-CB 3.33Å; T167-W171 PolarHBondContact O-N 2.95Å; V168-W171 PolarHBondContact O-N 3.39Å; R169-W171 VanDerWaalsContact C-N 3.27Å; R169-W171 PolarHBondContact O-N 3.44Å; W171-S173 PolarHBondContact O-N 3.18Å; W171-M174 HydrophobicContact CE3-CE 3.91Å; W171-M174 HydrophobicContact CE3-SD 4.02Å; W171-M174 HydrophobicContact CZ3-CE 4.38Å; W171-M174 HydrophobicContact CZ3-SD 4.11Å; W171-M174 WeakPolarHBondContact O-CB 3.49Å; W171-M174 PolarHBondContact O-N 3.1Å; W171-M174 VanDerWaalsContact O-N 3.13Å; W171-P177 HydrophobicContact CD2-CB 4.45Å; W171-P177 HydrophobicContact CD2-CG 3.82Å; W171-P177 HydrophobicContact CE3-CG 4.15Å; W171-P177 HydrophobicContact CG-CG 4.41Å; W171-P177 HydrophobicContact CH2-CG 3.98Å; W171-P177 HydrophobicContact CZ2-CG 3.66Å; W171-P177 HydrophobicContact CZ3-CG 4.21Å; W171-P177 WeakPolarHBondContact O-CB 3.34Å; W171-P177 WeakPolarHBondContact O-CG 3.35Å
172	V	87.6	Confident	84.8	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.006	34%	0.337	C	S	.	.	H	α-helix	trans	-64.1	-28.8	178.2	174.3	0	0	0	0	111.9	V168 R169 M174 I181 E240 M241 I244	V168-V172 HydrophobicContact CG1-CG2 4.32Å; V168-V172 VanDerWaalsContact O-CG2 3.3Å; V168-V172 WeakPolarHBondContact O-CG2 3.27Å; V168-V172 PolarHBondContact O-N 3.3Å; R169-V172 PolarHBondContact O-N 2.87Å; V172-M174 VanDerWaalsContact C-N 3.32Å; V172-M174 PolarHBondContact O-N 3.29Å; V172-I181 HydrophobicContact CB-CD1 4.43Å; V172-I181 HydrophobicContact CG1-CD1 4.03Å; V172-I181 HydrophobicContact CG2-CD1 4.03Å; V172-E240 HydrophobicContact CG1-CB 4.02Å; V172-M241 HydrophobicContact CG1-CG 4.27Å; V172-M241 HydrophobicContact CG1-SD 3.81Å; V172-M241 HydrophobicContact CG2-SD 4.11Å; V172-I244 HydrophobicContact CG1-CD1 3.73Å
173	S	88	Confident	85.9	Confident	77 Å²	77	60 Å²	60	54%	0.538	33%	0.332	S	S	.	.	H	α-helix	trans	-71.9	-23	176.9	-154	0	0	0	0	113.8	R169 E170 W171 E240	R169-S173 PolarHBondContact O-N 2.99Å; E170-S173 WeakPolarHBondContact O-CB 3.35Å; E170-S173 PolarHBondContact O-N 3.37Å; W171-S173 PolarHBondContact O-N 3.18Å; S173-E240 PolarHBondContact N-OE2 3.4Å
174	M	89.3	Confident	87	Confident	62 Å²	62	59.9 Å²	59.9	31%	0.305	33%	0.329	S	S	.	.	S	Bend	trans	-67.5	145.7	179.2	-65.4	-169.3	-150.6	0	0	111.8	H166 E170 W171 V172 A176 P177 R178	H166-M174 HydrophobicContact CB-CE 4.09Å; H166-M174 VanDerWaalsContact CD2-CE 3.47Å; H166-M174 WeakPolarHBondContact CD2-CE 3.43Å; H166-M174 WeakPolarHBondContact ND1-CE 3.46Å; E170-M174 WeakPolarHBondContact O-CG 3.49Å; E170-M174 PolarHBondContact O-N 2.97Å; W171-M174 HydrophobicContact CE3-CE 3.91Å; W171-M174 HydrophobicContact CE3-SD 4.02Å; W171-M174 HydrophobicContact CZ3-CE 4.38Å; W171-M174 HydrophobicContact CZ3-SD 4.11Å; W171-M174 WeakPolarHBondContact O-CB 3.49Å; W171-M174 PolarHBondContact O-N 3.1Å; W171-M174 VanDerWaalsContact O-N 3.13Å; V172-M174 VanDerWaalsContact C-N 3.32Å; V172-M174 PolarHBondContact O-N 3.29Å; M174-A176 PolarHBondContact O-N 3.3Å; M174-P177 HydrophobicContact CB-CG 4.09Å; M174-R178 WeakPolarHBondContact O-CB 3.19Å; M174-R178 PolarHBondContact O-N 3.36Å
175	A	88.1	Confident	88.1	Confident	72 Å²	72	54.2 Å²	54.2	60%	0.595	30%	0.304	S	S	*	.	H	α-helix	trans	-59.9	-43.3	-173.5	0	0	0	0	0	113.6	L179	A175-L179 WeakPolarHBondContact O-CB 3.48Å; A175-L179 VanDerWaalsContact O-CG 3.25Å; A175-L179 WeakPolarHBondContact O-CG 3.3Å; A175-L179 PolarHBondContact O-N 2.94Å
176	A	86.8	Confident	88.8	Confident	50 Å²	50	51.4 Å²	51.4	41%	0.413	27%	0.269	S	S	.	.	H	α-helix	trans	-68.8	-52.5	-177.6	0	0	0	0	0	112.8	E158 M174 R178 L179 E180	E158-A176 WeakPolarHBondContact OE2-CB 3.45Å; M174-A176 PolarHBondContact O-N 3.3Å; A176-R178 VanDerWaalsContact C-N 3.31Å; A176-R178 PolarHBondContact O-N 3.15Å; A176-L179 PolarHBondContact O-N 3.22Å; A176-E180 PolarHBondContact O-N 3.26Å
177	P	88.2	Confident	89	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.019	28%	0.276	C	S	.	.	H	α-helix	trans	-58.6	-39.7	172.5	-26.9	35.4	0	0	0	113.3	L160 W171 M174 L179 E180 I181	L160-P177 HydrophobicContact CD2-CB 4.28Å; W171-P177 HydrophobicContact CD2-CB 4.45Å; W171-P177 HydrophobicContact CD2-CG 3.82Å; W171-P177 HydrophobicContact CE3-CG 4.15Å; W171-P177 HydrophobicContact CG-CG 4.41Å; W171-P177 HydrophobicContact CH2-CG 3.98Å; W171-P177 HydrophobicContact CZ2-CG 3.66Å; W171-P177 HydrophobicContact CZ3-CG 4.21Å; W171-P177 WeakPolarHBondContact O-CB 3.34Å; W171-P177 WeakPolarHBondContact O-CG 3.35Å; M174-P177 HydrophobicContact CB-CG 4.09Å; P177-L179 PolarHBondContact O-N 2.78Å; P177-E180 PolarHBondContact O-N 3.44Å; P177-I181 WeakPolarHBondContact O-CB 3.36Å; P177-I181 WeakPolarHBondContact O-CD1 3.36Å; P177-I181 WeakPolarHBondContact O-CG1 3.41Å; P177-I181 PolarHBondContact O-N 3.3Å
178	R	89.6	Confident	89.1	Confident	101 Å²	101	48.7 Å²	48.7	38%	0.381	25%	0.253	S	S	.	.	H	α-helix	trans	-58.2	-47.6	176.4	177.8	173.6	173.6	170.8	0.2	112.1	M174 A176 E180 Y182 I244 E247	M174-R178 WeakPolarHBondContact O-CB 3.19Å; M174-R178 PolarHBondContact O-N 3.36Å; A176-R178 VanDerWaalsContact C-N 3.31Å; A176-R178 PolarHBondContact O-N 3.15Å; R178-E180 VanDerWaalsContact C-N 3.35Å; R178-Y182 VanDerWaalsContact O-CB 3.22Å; R178-Y182 WeakPolarHBondContact O-CB 3.46Å; R178-Y182 PolarHBondContact O-N 3.39Å; R178-I244 HydrophobicContact CB-CD1 4.41Å; R178-I244 HydrophobicContact CG-CD1 3.85Å; R178-I244 HydrophobicContact CG-CG1 4.03Å; R178-E247 IonicContact CZ-OE2 3.24Å; R178-E247 VanDerWaalsContact NH2-CD 3.28Å; R178-E247 IonicContact NH2-OE1 3.46Å; R178-E247 PolarHBondContact NH2-OE1 2.85Å; R178-E247 IonicContact NH2-OE2 3.51Å; R178-E247 PolarHBondContact NH2-OE2 3.2Å
179	L	89.8	Confident	89.3	Confident	104 Å²	104	48.7 Å²	48.7	55%	0.545	25%	0.253	S	S	.	.	H	α-helix	trans	-66.4	-37.2	178.6	-73.1	170.4	0	0	0	112	A175 A176 P177 Y182 N183	A175-L179 WeakPolarHBondContact O-CB 3.48Å; A175-L179 VanDerWaalsContact O-CG 3.25Å; A175-L179 WeakPolarHBondContact O-CG 3.3Å; A175-L179 PolarHBondContact O-N 2.94Å; A176-L179 PolarHBondContact O-N 3.22Å; P177-L179 PolarHBondContact O-N 2.78Å; L179-Y182 WeakPolarHBondContact O-CB 3.28Å; L179-Y182 PolarHBondContact O-N 3.01Å; L179-N183 WeakPolarHBondContact O-CB 3.46Å; L179-N183 VanDerWaalsContact O-CG 3.32Å; L179-N183 PolarHBondContact O-N 3.41Å; L179-N183 PolarHBondContact O-ND2 3.26Å
180	E	88.8	Confident	89.3	Confident	45 Å²	45	50 Å²	50	21%	0.21	26%	0.258	C	S	.	.	H	α-helix	trans	-67.1	-46.6	177.3	-178.8	63	-171.8	0	0	111.8	L160 A176 P177 R178 Y182 N183 R184	L160-E180 HydrophobicContact CD1-CB 4.49Å; L160-E180 HydrophobicContact CD1-CG 3.61Å; L160-E180 HydrophobicContact CG-CG 4.07Å; A176-E180 PolarHBondContact O-N 3.26Å; P177-E180 PolarHBondContact O-N 3.44Å; R178-E180 VanDerWaalsContact C-N 3.35Å; E180-Y182 VanDerWaalsContact C-N 3.26Å; E180-Y182 PolarHBondContact O-N 3.07Å; E180-N183 PolarHBondContact O-N 2.97Å; E180-R184 WeakPolarHBondContact O-CB 3.34Å; E180-R184 WeakPolarHBondContact O-CG 3.43Å; E180-R184 PolarHBondContact O-N 3.41Å; E180-R184 IonicContact OE1-CZ 2.87Å; E180-R184 IonicContact OE1-NE 3.28Å; E180-R184 PolarHBondContact OE1-NE 2.86Å; E180-R184 IonicContact OE1-NH2 2.72Å; E180-R184 PolarHBondContact OE1-NH2 3.42Å
181	I	90.4	Very high	89.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-56.6	-45.3	174.9	-70.4	162.4	0	0	0	110.3	L160 V172 P177 R184 F185 L230 M241 I244 F245	L160-I181 HydrophobicContact CD2-CD1 4.34Å; L160-I181 HydrophobicContact CD2-CG1 4.04Å; V172-I181 HydrophobicContact CB-CD1 4.43Å; V172-I181 HydrophobicContact CG1-CD1 4.03Å; V172-I181 HydrophobicContact CG2-CD1 4.03Å; P177-I181 WeakPolarHBondContact O-CB 3.36Å; P177-I181 WeakPolarHBondContact O-CD1 3.36Å; P177-I181 WeakPolarHBondContact O-CG1 3.41Å; P177-I181 PolarHBondContact O-N 3.3Å; I181-R184 PolarHBondContact O-N 2.95Å; I181-F185 WeakPolarHBondContact O-CB 3.28Å; I181-F185 PolarHBondContact O-N 3.03Å; I181-L230 HydrophobicContact CB-CD2 4.18Å; I181-L230 HydrophobicContact CG1-CD2 3.85Å; I181-L230 HydrophobicContact CG2-CD2 3.84Å; I181-M241 HydrophobicContact CD1-SD 3.89Å; I181-M241 HydrophobicContact CG2-CE 3.68Å; I181-M241 HydrophobicContact CG2-SD 4.03Å; I181-I244 HydrophobicContact CB-CG2 4.48Å; I181-I244 HydrophobicContact CG2-CD1 4.38Å; I181-I244 HydrophobicContact CG2-CG2 3.88Å; I181-F245 HydrophobicContact CG2-CE1 4.16Å
182	Y	92.6	Very high	88.9	Confident	29 Å²	29	49.2 Å²	49.2	11%	0.114	26%	0.26	C	S	.	.	H	α-helix	trans	-59.4	-47	178.2	177.9	-100.2	0	0	0	112.7	R178 L179 E180 K186 I244 E247 A248 E251	R178-Y182 VanDerWaalsContact O-CB 3.22Å; R178-Y182 WeakPolarHBondContact O-CB 3.46Å; R178-Y182 PolarHBondContact O-N 3.39Å; L179-Y182 WeakPolarHBondContact O-CB 3.28Å; L179-Y182 PolarHBondContact O-N 3.01Å; E180-Y182 VanDerWaalsContact C-N 3.26Å; E180-Y182 PolarHBondContact O-N 3.07Å; Y182-K186 HydrophobicContact CE1-CD 4.09Å; Y182-K186 WeakPolarHBondContact O-CG 3.38Å; Y182-K186 PolarHBondContact O-N 3.46Å; Y182-K186 VanDerWaalsContact O-N 3.14Å; Y182-K186 WeakPolarHBondContact OH-CE 3.43Å; Y182-K186 PolarHBondContact OH-NZ 2.97Å; Y182-I244 HydrophobicContact CD2-CG2 4.13Å; Y182-E247 HydrophobicContact CD2-CB 4.4Å; Y182-E247 HydrophobicContact CE2-CB 3.87Å; Y182-A248 HydrophobicContact CD2-CB 3.68Å; Y182-A248 VanDerWaalsContact CE2-CA 3.46Å; Y182-A248 HydrophobicContact CE2-CB 3.72Å; Y182-E251 WeakPolarHBondContact OH-CG 3.04Å; Y182-E251 PolarHBondContact OH-OE1 3.04Å; Y182-E251 PolarHBondContact OH-OE2 3.01Å; Y182-E251 VanDerWaalsContact OH-OE2 3.08Å
183	N	90.6	Very high	88.7	Confident	77 Å²	77	52.2 Å²	52.2	41%	0.412	28%	0.279	S	S	.	.	H	α-helix	trans	-68.4	-41.3	178.5	-73.4	-24.7	0	0	0	112.6	L179 E180 K186 N187	L179-N183 WeakPolarHBondContact O-CB 3.46Å; L179-N183 VanDerWaalsContact O-CG 3.32Å; L179-N183 PolarHBondContact O-N 3.41Å; L179-N183 PolarHBondContact O-ND2 3.26Å; E180-N183 PolarHBondContact O-N 2.97Å; N183-K186 PolarHBondContact O-N 3.04Å; N183-N187 PolarHBondContact O-N 3.32Å; N183-N187 PolarHBondContact O-ND2 3.2Å
184	R	89.2	Confident	88.2	Confident	53 Å²	53	52.6 Å²	52.6	20%	0.2	28%	0.275	C	S	.	.	H	α-helix	trans	-62	-43.8	176.3	-75.6	-177.5	177.5	-142.8	11.4	112.1	E180 I181 K186 N187 F188 E227 L230	E180-R184 WeakPolarHBondContact O-CB 3.34Å; E180-R184 WeakPolarHBondContact O-CG 3.43Å; E180-R184 PolarHBondContact O-N 3.41Å; E180-R184 IonicContact OE1-CZ 2.87Å; E180-R184 IonicContact OE1-NE 3.28Å; E180-R184 PolarHBondContact OE1-NE 2.86Å; E180-R184 IonicContact OE1-NH2 2.72Å; E180-R184 PolarHBondContact OE1-NH2 3.42Å; I181-R184 PolarHBondContact O-N 2.95Å; R184-K186 VanDerWaalsContact C-N 3.35Å; R184-K186 PolarHBondContact O-N 3.47Å; R184-N187 WeakPolarHBondContact O-CB 3.35Å; R184-N187 PolarHBondContact O-N 3.13Å; R184-F188 PolarHBondContact O-N 2.83Å; R184-E227 WeakPolarHBondContact CD-OE1 3.3Å; R184-E227 IonicContact CZ-OE1 3.3Å; R184-E227 IonicContact NE-OE1 3.91Å; R184-E227 IonicContact NH1-OE1 3.84Å; R184-E227 PolarHBondContact NH1-OE1 3.04Å; R184-L230 HydrophobicContact CB-CD1 4.23Å
185	F	91.5	Very high	87.3	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65.5	-37.8	178.2	-171.4	-107.2	0	0	0	112.3	I181 N187 F188 L189 V218 L223 L230 F245 A248 V269	I181-F185 WeakPolarHBondContact O-CB 3.28Å; I181-F185 PolarHBondContact O-N 3.03Å; F185-N187 PolarHBondContact O-N 3.2Å; F185-F188 HydrophobicContact CD2-CD1 4.17Å; F185-F188 HydrophobicContact CE2-CD1 4.08Å; F185-F188 HydrophobicContact CE2-CE1 4.44Å; F185-F188 WeakPolarHBondContact O-CB 3.4Å; F185-F188 PolarHBondContact O-N 2.82Å; F185-L189 HydrophobicContact CD1-CD1 4.03Å; F185-L189 HydrophobicContact CD1-CG 4.39Å; F185-L189 HydrophobicContact CE1-CD1 3.64Å; F185-L189 HydrophobicContact CE1-CD2 4.46Å; F185-L189 HydrophobicContact CE1-CG 4.07Å; F185-L189 HydrophobicContact CZ-CD1 4.25Å; F185-L189 HydrophobicContact CZ-CD2 4.25Å; F185-L189 HydrophobicContact CZ-CG 4.27Å; F185-L189 WeakPolarHBondContact O-CG 3.36Å; F185-L189 PolarHBondContact O-N 2.85Å; F185-V218 HydrophobicContact CZ-CG2 4.33Å; F185-L223 HydrophobicContact CE2-CD1 4.32Å; F185-L230 HydrophobicContact CB-CD1 4.4Å; F185-F245 HydrophobicContact CB-CD1 3.98Å; F185-F245 HydrophobicContact CB-CE1 3.94Å; F185-F245 HydrophobicContact CD1-CB 4.28Å; F185-F245 AromaticContact CD1-CD1 3.75Å; F185-F245 HydrophobicContact CD1-CD1 3.75Å; F185-F245 HydrophobicContact CD1-CE1 4.41Å; F185-F245 HydrophobicContact CD1-CG 4.23Å; F185-F245 AromaticContact CD2-CD1 3.63Å; F185-F245 HydrophobicContact CD2-CD1 3.63Å; F185-F245 AromaticContact CD2-CE1 3.51Å; F185-F245 HydrophobicContact CD2-CE1 3.51Å; F185-F245 HydrophobicContact CD2-CG 4.2Å; F185-F245 AromaticContact CD2-CZ 3.98Å; F185-F245 HydrophobicContact CD2-CZ 3.98Å; F185-F245 HydrophobicContact CE1-CB 3.87Å; F185-F245 HydrophobicContact CE1-CD1 4.07Å; F185-F245 HydrophobicContact CE1-CG 4.07Å; F185-F245 AromaticContact CE2-CD1 3.98Å; F185-F245 HydrophobicContact CE2-CD1 3.98Å; F185-F245 HydrophobicContact CE2-CD2 4.25Å; F185-F245 HydrophobicContact CE2-CE1 4.09Å; F185-F245 HydrophobicContact CE2-CE2 4.34Å; F185-F245 HydrophobicContact CE2-CG 4.06Å; F185-F245 HydrophobicContact CE2-CZ 4.26Å; F185-F245 AromaticContact CG-CD1 3.49Å; F185-F245 HydrophobicContact CG-CD1 3.49Å; F185-F245 VanDerWaalsContact CG-CD1 3.49Å; F185-F245 AromaticContact CG-CE1 3.7Å; F185-F245 HydrophobicContact CG-CE1 3.7Å; F185-F245 HydrophobicContact CG-CG 4.27Å; F185-F245 HydrophobicContact CZ-CB 4.08Å; F185-F245 HydrophobicContact CZ-CD1 4.18Å; F185-F245 HydrophobicContact CZ-CD2 4.38Å; F185-F245 AromaticContact CZ-CG 3.99Å; F185-F245 HydrophobicContact CZ-CG 3.99Å; F185-A248 HydrophobicContact CD1-CB 3.64Å; F185-A248 HydrophobicContact CE1-CB 4.38Å; F185-V269 HydrophobicContact CZ-CG1 4.34Å
186	K	90.9	Very high	86.6	Confident	24 Å²	24	61 Å²	61	10%	0.104	31%	0.305	C	S	.	.	H	α-helix	trans	-60.8	-43.4	171.3	-76.8	-176.1	179.7	176.6	0	112.8	Y182 N183 R184 F188 L189 R190 A248 E251 V252	Y182-K186 HydrophobicContact CE1-CD 4.09Å; Y182-K186 WeakPolarHBondContact O-CG 3.38Å; Y182-K186 PolarHBondContact O-N 3.46Å; Y182-K186 VanDerWaalsContact O-N 3.14Å; Y182-K186 WeakPolarHBondContact OH-CE 3.43Å; Y182-K186 PolarHBondContact OH-NZ 2.97Å; N183-K186 PolarHBondContact O-N 3.04Å; R184-K186 VanDerWaalsContact C-N 3.35Å; R184-K186 PolarHBondContact O-N 3.47Å; K186-F188 VanDerWaalsContact C-N 3.34Å; K186-L189 PolarHBondContact O-N 2.79Å; K186-R190 WeakPolarHBondContact O-CG 3.3Å; K186-R190 PolarHBondContact O-N 2.67Å; K186-A248 HydrophobicContact CG-CB 4.03Å; K186-E251 WeakPolarHBondContact CE-OE2 3.48Å; K186-E251 IonicContact NZ-OE2 2.89Å; K186-E251 PolarHBondContact NZ-OE2 3.18Å; K186-V252 HydrophobicContact CG-CG2 4.17Å
187	N	89.8	Confident	86.1	Confident	93 Å²	93	61.2 Å²	61.2	50%	0.497	31%	0.311	S	S	.	.	H	α-helix	trans	-61.7	-46.8	177.2	-71.6	-20.4	0	0	0	110	N183 R184 F185 L189 R190 T191	N183-N187 PolarHBondContact O-N 3.32Å; N183-N187 PolarHBondContact O-ND2 3.2Å; R184-N187 WeakPolarHBondContact O-CB 3.35Å; R184-N187 PolarHBondContact O-N 3.13Å; F185-N187 PolarHBondContact O-N 3.2Å; N187-L189 PolarHBondContact O-N 3.49Å; N187-R190 PolarHBondContact O-N 2.86Å; N187-T191 WeakPolarHBondContact O-CG2 3.49Å; N187-T191 PolarHBondContact O-N 3.31Å; N187-T191 PolarHBondContact O-OG1 2.82Å
188	F	90.1	Very high	85.6	Confident	4 Å²	4	67 Å²	67	2%	0.018	34%	0.338	C	S	.	.	H	α-helix	trans	-51.8	-51.2	174.6	172.2	-104.4	0	0	0	112.4	R184 F185 K186 R190 T191 H192 F201 V218 D222 L223 R226	R184-F188 PolarHBondContact O-N 2.83Å; F185-F188 HydrophobicContact CD2-CD1 4.17Å; F185-F188 HydrophobicContact CE2-CD1 4.08Å; F185-F188 HydrophobicContact CE2-CE1 4.44Å; F185-F188 WeakPolarHBondContact O-CB 3.4Å; F185-F188 PolarHBondContact O-N 2.82Å; K186-F188 VanDerWaalsContact C-N 3.34Å; F188-R190 PolarHBondContact O-N 3.35Å; F188-T191 PolarHBondContact O-N 2.9Å; F188-H192 HydrophobicContact CE2-CB 4.47Å; F188-H192 AromaticContact CE2-CD2 3.71Å; F188-H192 VanDerWaalsContact O-CB 3.31Å; F188-H192 WeakPolarHBondContact O-CB 3.27Å; F188-H192 PolarHBondContact O-N 3.42Å; F188-H192 VanDerWaalsContact O-N 3.09Å; F188-F201 HydrophobicContact CD1-CE2 4.26Å; F188-F201 HydrophobicContact CE1-CD2 4.37Å; F188-F201 AromaticContact CE1-CE2 3.46Å; F188-F201 HydrophobicContact CE1-CE2 3.46Å; F188-F201 VanDerWaalsContact CE1-CE2 3.46Å; F188-F201 AromaticContact CE1-CZ 3.61Å; F188-F201 HydrophobicContact CE1-CZ 3.61Å; F188-F201 HydrophobicContact CE2-CE2 4.26Å; F188-F201 AromaticContact CZ-CE2 3.46Å; F188-F201 HydrophobicContact CZ-CE2 3.46Å; F188-F201 VanDerWaalsContact CZ-CE2 3.46Å; F188-F201 AromaticContact CZ-CZ 3.71Å; F188-F201 HydrophobicContact CZ-CZ 3.71Å; F188-V218 HydrophobicContact CE1-CG1 4.18Å; F188-D222 HydrophobicContact CZ-CB 4.38Å; F188-L223 HydrophobicContact CZ-CB 4.13Å; F188-R226 HydrophobicContact CD2-CB 3.86Å; F188-R226 HydrophobicContact CD2-CG 4.06Å; F188-R226 HydrophobicContact CE2-CB 4.01Å; F188-R226 HydrophobicContact CE2-CG 3.98Å
189	L	88.9	Confident	85.2	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-61	-29.3	178.5	-70.8	177.9	0	0	0	113.6	F185 K186 N187 F201 L216 V252	F185-L189 HydrophobicContact CD1-CD1 4.03Å; F185-L189 HydrophobicContact CD1-CG 4.39Å; F185-L189 HydrophobicContact CE1-CD1 3.64Å; F185-L189 HydrophobicContact CE1-CD2 4.46Å; F185-L189 HydrophobicContact CE1-CG 4.07Å; F185-L189 HydrophobicContact CZ-CD1 4.25Å; F185-L189 HydrophobicContact CZ-CD2 4.25Å; F185-L189 HydrophobicContact CZ-CG 4.27Å; F185-L189 WeakPolarHBondContact O-CG 3.36Å; F185-L189 PolarHBondContact O-N 2.85Å; K186-L189 PolarHBondContact O-N 2.79Å; N187-L189 PolarHBondContact O-N 3.49Å; L189-F201 HydrophobicContact CD2-CB 4.28Å; L189-F201 HydrophobicContact CD2-CD1 4.04Å; L189-F201 HydrophobicContact CD2-CD2 4.23Å; L189-F201 HydrophobicContact CD2-CE1 4.49Å; L189-F201 HydrophobicContact CD2-CG 3.92Å; L189-L216 HydrophobicContact CD2-CD2 4.25Å; L189-V252 HydrophobicContact CD1-CB 4.39Å; L189-V252 HydrophobicContact CD1-CG2 4.1Å
190	R	87.6	Confident	84.9	Confident	140 Å²	140	60.2 Å²	60.2	53%	0.528	31%	0.311	S	S	.	.	H	α-helix	trans	-89.1	-33.3	-178.3	-70.1	178	178.8	-175.2	1.1	113.5	K186 N187 F188 N199	K186-R190 WeakPolarHBondContact O-CG 3.3Å; K186-R190 PolarHBondContact O-N 2.67Å; N187-R190 PolarHBondContact O-N 2.86Å; F188-R190 PolarHBondContact O-N 3.35Å; R190-N199 PolarHBondContact O-ND2 3.31Å
191	T	86.4	Confident	84.8	Confident	85 Å²	85	58.1 Å²	58.1	52%	0.521	30%	0.301	S	S	.	.	H	α-helix	trans	-103.6	-12.1	-169.7	61.7	0	0	0	0	114.1	N187 F188 V193	N187-T191 WeakPolarHBondContact O-CG2 3.49Å; N187-T191 PolarHBondContact O-N 3.31Å; N187-T191 PolarHBondContact O-OG1 2.82Å; F188-T191 PolarHBondContact O-N 2.9Å; T191-V193 PolarHBondContact O-N 3.26Å
192	H	82.6	Confident	84.6	Confident	12 Å²	12	64.2 Å²	64.2	6%	0.056	33%	0.327	C	S	.	.			trans	-63.4	121.3	-179.4	-170.3	-95	0	0	0	111	F188 N199 F201 D222	F188-H192 HydrophobicContact CE2-CB 4.47Å; F188-H192 AromaticContact CE2-CD2 3.71Å; F188-H192 VanDerWaalsContact O-CB 3.31Å; F188-H192 WeakPolarHBondContact O-CB 3.27Å; F188-H192 PolarHBondContact O-N 3.42Å; F188-H192 VanDerWaalsContact O-N 3.09Å; H192-N199 WeakPolarHBondContact O-CA 3.48Å; H192-N199 PolarHBondContact O-OD1 2.95Å; H192-F201 HydrophobicContact CB-CD2 3.66Å; H192-F201 HydrophobicContact CB-CE2 3.74Å; H192-F201 AromaticContact CG-CE2 3.68Å; H192-F201 AromaticContact ND1-CE2 3.77Å; H192-D222 IonicContact CE1-OD2 2.73Å
193	V	82.9	Confident	84.3	Confident	64 Å²	64	68.4 Å²	68.4	39%	0.388	35%	0.348	S	S	.	.			trans	-120.8	140.2	172.7	-66.7	0	0	0	0	108.9	T191 H198 R226	T191-V193 PolarHBondContact O-N 3.26Å; V193-H198 WeakPolarHBondContact CA-O 3.38Å; V193-R226 PolarHBondContact O-NH2 3.32Å
194	D	77.8	Confident	84.1	Confident	85 Å²	85	68.6 Å²	68.6	46%	0.455	35%	0.345	S	S	.	.			trans	-76.4	176.7	174.5	-144.4	-19.3	0	0	0	112	N196 G197 H198 V200	D194-N196 PolarHBondContact O-N 2.91Å; D194-N196 VanDerWaalsContact O-N 3.09Å; D194-G197 PolarHBondContact O-N 3.27Å; D194-H198 PolarHBondContact N-O 3.4Å; D194-V200 HydrophobicContact CB-CG2 3.59Å
195	E	71.1	Confident	84.1	Confident	192 Å²	192	66.1 Å²	66.1	90%	0.897	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-28.3	173.7	-63	-170.5	165.4	0	0	112.8
196	N	72.6	Confident	84	Confident	120 Å²	120	67.1 Å²	67.1	64%	0.642	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	4.3	178.4	-68.7	-22.7	0	0	0	114.5	D194 H198	D194-N196 PolarHBondContact O-N 2.91Å; D194-N196 VanDerWaalsContact O-N 3.09Å; N196-H198 PolarHBondContact O-N 3.11Å
197	G	76.5	Confident	83.9	Confident	53 Å²	53	69.2 Å²	69.2	55%	0.546	36%	0.355	S	S	.	.	S	Bend	trans	74	7.5	178.7	0	0	0	0	0	115.1	D194	D194-G197 PolarHBondContact O-N 3.27Å
198	H	78.4	Confident	83.8	Confident	126 Å²	126	65.4 Å²	65.4	58%	0.583	33%	0.334	S	S	*	.			trans	-86.7	142.6	173.3	-61.2	146.1	0	0	0	111.1	V193 D194 N196 V200	V193-H198 WeakPolarHBondContact CA-O 3.38Å; D194-H198 PolarHBondContact N-O 3.4Å; N196-H198 PolarHBondContact O-N 3.11Å; H198-V200 PolarHBondContact O-N 2.84Å
199	N	81.6	Confident	83.8	Confident	40 Å²	40	65.9 Å²	65.9	21%	0.214	34%	0.338	C	S	.	.			trans	-81.6	101	171.8	-177.6	-26.3	0	0	0	109.6	R190 H192 F201 K202 E203	R190-N199 PolarHBondContact O-ND2 3.31Å; H192-N199 WeakPolarHBondContact O-CA 3.48Å; H192-N199 PolarHBondContact O-OD1 2.95Å; N199-F201 PolarHBondContact O-N 2.99Å; N199-F201 PolarHBondContact OD1-N 2.98Å; N199-F201 VanDerWaalsContact OD1-N 3.13Å; N199-K202 HydrophobicContact CB-CB 4.08Å; N199-K202 PolarHBondContact O-N 3.49Å; N199-K202 PolarHBondContact OD1-N 3.48Å; N199-E203 PolarHBondContact O-N 3.35Å
200	V	83.5	Confident	83.8	Confident	22 Å²	22	72.3 Å²	72.3	13%	0.133	37%	0.366	C	S	.	.	H	α-helix	trans	-60.4	-43.4	-177.4	-175.5	0	0	0	0	111.9	D194 H198 K202 E203 K204	D194-V200 HydrophobicContact CB-CG2 3.59Å; H198-V200 PolarHBondContact O-N 2.84Å; V200-K202 VanDerWaalsContact C-N 3.34Å; V200-K202 PolarHBondContact O-N 3.13Å; V200-E203 PolarHBondContact O-N 3.39Å; V200-K204 HydrophobicContact CG1-CD 3.79Å; V200-K204 HydrophobicContact CG1-CG 4.16Å; V200-K204 WeakPolarHBondContact O-CB 3.32Å; V200-K204 WeakPolarHBondContact O-CG 3.49Å; V200-K204 PolarHBondContact O-N 3.12Å
201	F	85.2	Confident	83.8	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-71.2	-31.2	-176.6	-68.9	-62.3	0	0	0	112.4	F188 L189 H192 N199 I205 V218	F188-F201 HydrophobicContact CD1-CE2 4.26Å; F188-F201 HydrophobicContact CE1-CD2 4.37Å; F188-F201 AromaticContact CE1-CE2 3.46Å; F188-F201 HydrophobicContact CE1-CE2 3.46Å; F188-F201 VanDerWaalsContact CE1-CE2 3.46Å; F188-F201 AromaticContact CE1-CZ 3.61Å; F188-F201 HydrophobicContact CE1-CZ 3.61Å; F188-F201 HydrophobicContact CE2-CE2 4.26Å; F188-F201 AromaticContact CZ-CE2 3.46Å; F188-F201 HydrophobicContact CZ-CE2 3.46Å; F188-F201 VanDerWaalsContact CZ-CE2 3.46Å; F188-F201 AromaticContact CZ-CZ 3.71Å; F188-F201 HydrophobicContact CZ-CZ 3.71Å; L189-F201 HydrophobicContact CD2-CB 4.28Å; L189-F201 HydrophobicContact CD2-CD1 4.04Å; L189-F201 HydrophobicContact CD2-CD2 4.23Å; L189-F201 HydrophobicContact CD2-CE1 4.49Å; L189-F201 HydrophobicContact CD2-CG 3.92Å; H192-F201 HydrophobicContact CB-CD2 3.66Å; H192-F201 HydrophobicContact CB-CE2 3.74Å; H192-F201 AromaticContact CG-CE2 3.68Å; H192-F201 AromaticContact ND1-CE2 3.77Å; N199-F201 PolarHBondContact O-N 2.99Å; N199-F201 PolarHBondContact OD1-N 2.98Å; N199-F201 VanDerWaalsContact OD1-N 3.13Å; F201-I205 WeakPolarHBondContact O-CB 3.46Å; F201-I205 WeakPolarHBondContact O-CD1 3.48Å; F201-I205 WeakPolarHBondContact O-CG1 3.48Å; F201-I205 PolarHBondContact O-N 3.28Å; F201-V218 HydrophobicContact CE1-CG2 4.19Å; F201-V218 HydrophobicContact CZ-CG1 4.4Å
202	K	86.6	Confident	83.9	Confident	128 Å²	128	72.1 Å²	72.1	56%	0.557	37%	0.368	S	S	*	.	H	α-helix	trans	-63.1	-43.4	173.8	-175.5	179.6	178.7	-177.1	0	111.7	N199 V200 S206 M256	N199-K202 HydrophobicContact CB-CB 4.08Å; N199-K202 PolarHBondContact O-N 3.49Å; N199-K202 PolarHBondContact OD1-N 3.48Å; V200-K202 VanDerWaalsContact C-N 3.34Å; V200-K202 PolarHBondContact O-N 3.13Å; K202-S206 WeakPolarHBondContact O-CB 3.44Å; K202-S206 PolarHBondContact O-N 3.49Å; K202-S206 VanDerWaalsContact O-N 3.08Å; K202-M256 HydrophobicContact CB-CE 4.34Å; K202-M256 HydrophobicContact CG-CE 4.03Å; K202-M256 HydrophobicContact CG-SD 4.32Å
203	E	86.6	Confident	84.1	Confident	118 Å²	118	79 Å²	79	55%	0.551	39%	0.394	S	S	*	.	H	α-helix	trans	-69.3	-48.3	176.7	-173.8	172.7	-166.9	0	0	111.4	N199 V200 I205 S206 D207	N199-E203 PolarHBondContact O-N 3.35Å; V200-E203 PolarHBondContact O-N 3.39Å; E203-I205 VanDerWaalsContact C-N 3.33Å; E203-I205 PolarHBondContact O-N 3.45Å; E203-S206 CarbonylContact O-C 3.58Å; E203-S206 WeakPolarHBondContact O-CA 3.38Å; E203-S206 VanDerWaalsContact O-CB 3.32Å; E203-S206 WeakPolarHBondContact O-CB 3.34Å; E203-S206 PolarHBondContact O-N 2.97Å; E203-D207 PolarHBondContact O-N 2.97Å
204	K	86.6	Confident	84.3	Confident	81 Å²	81	78.8 Å²	78.8	35%	0.352	39%	0.389	S	S	.	.	H	α-helix	trans	-56.6	-43.4	176.4	-75.9	-178.2	178.7	172.1	0	112.7	V200 D207 M208	V200-K204 HydrophobicContact CG1-CD 3.79Å; V200-K204 HydrophobicContact CG1-CG 4.16Å; V200-K204 WeakPolarHBondContact O-CB 3.32Å; V200-K204 WeakPolarHBondContact O-CG 3.49Å; V200-K204 PolarHBondContact O-N 3.12Å; K204-D207 PolarHBondContact O-N 3.42Å; K204-M208 VanDerWaalsContact O-CB 3.29Å; K204-M208 WeakPolarHBondContact O-CB 3.4Å; K204-M208 PolarHBondContact O-N 3.1Å
205	I	89.9	Confident	84.8	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-65.3	-41.8	175.7	-71.5	166.5	0	0	0	110.6	F201 E203 D207 M208 C209 L216 V252 V253 M256	F201-I205 WeakPolarHBondContact O-CB 3.46Å; F201-I205 WeakPolarHBondContact O-CD1 3.48Å; F201-I205 WeakPolarHBondContact O-CG1 3.48Å; F201-I205 PolarHBondContact O-N 3.28Å; E203-I205 VanDerWaalsContact C-N 3.33Å; E203-I205 PolarHBondContact O-N 3.45Å; I205-D207 VanDerWaalsContact C-N 3.34Å; I205-D207 PolarHBondContact O-N 3.21Å; I205-M208 PolarHBondContact O-N 3.3Å; I205-C209 WeakPolarHBondContact O-CB 3.33Å; I205-C209 PolarHBondContact O-N 3.27Å; I205-C209 PolarHBondContact O-SG 3.36Å; I205-L216 HydrophobicContact CG1-CD1 3.8Å; I205-L216 HydrophobicContact CG1-CD2 4.39Å; I205-V252 HydrophobicContact CD1-CG1 4.02Å; I205-V253 HydrophobicContact CG2-CG2 3.85Å; I205-M256 HydrophobicContact CG2-SD 4.19Å
206	S	89.3	Confident	85.8	Confident	22 Å²	22	67.2 Å²	67.2	15%	0.154	34%	0.335	C	S	.	.	H	α-helix	trans	-59.1	-45.7	175.3	153.3	0	0	0	0	111.4	K202 E203 C209 K210	K202-S206 WeakPolarHBondContact O-CB 3.44Å; K202-S206 PolarHBondContact O-N 3.49Å; K202-S206 VanDerWaalsContact O-N 3.08Å; E203-S206 CarbonylContact O-C 3.58Å; E203-S206 WeakPolarHBondContact O-CA 3.38Å; E203-S206 VanDerWaalsContact O-CB 3.32Å; E203-S206 WeakPolarHBondContact O-CB 3.34Å; E203-S206 PolarHBondContact O-N 2.97Å; S206-C209 PolarHBondContact O-N 3.5Å; S206-K210 WeakPolarHBondContact O-CG 3.39Å; S206-K210 PolarHBondContact O-N 2.86Å; S206-K210 WeakPolarHBondContact OG-CE 3.06Å
207	D	88.6	Confident	86.6	Confident	68 Å²	68	64.1 Å²	64.1	36%	0.364	32%	0.321	S	S	.	.	H	α-helix	trans	-70.1	-38.7	-179.6	-70.8	-11.8	0	0	0	112.3	E203 K204 I205 C209 K210 E211	E203-D207 PolarHBondContact O-N 2.97Å; K204-D207 PolarHBondContact O-N 3.42Å; I205-D207 VanDerWaalsContact C-N 3.34Å; I205-D207 PolarHBondContact O-N 3.21Å; D207-C209 VanDerWaalsContact C-N 3.3Å; D207-C209 PolarHBondContact O-N 3.33Å; D207-K210 PolarHBondContact O-N 3.46Å; D207-K210 IonicContact OD1-NZ 3.33Å; D207-K210 PolarHBondContact OD1-NZ 3.46Å; D207-E211 PolarHBondContact O-N 2.95Å; D207-E211 VanDerWaalsContact O-N 3.09Å
208	M	87.8	Confident	87.3	Confident	12 Å²	12	61.8 Å²	61.8	6%	0.059	30%	0.296	C	S	.	.	H	α-helix	trans	-55	-46.6	169.7	-177.2	-162.9	79.2	0	0	111.2	K204 I205 E211 N212 R213 L216 V253 I267	K204-M208 VanDerWaalsContact O-CB 3.29Å; K204-M208 WeakPolarHBondContact O-CB 3.4Å; K204-M208 PolarHBondContact O-N 3.1Å; I205-M208 PolarHBondContact O-N 3.3Å; M208-E211 PolarHBondContact O-N 3.21Å; M208-N212 PolarHBondContact O-N 3.27Å; M208-R213 HydrophobicContact CG-CB 3.97Å; M208-R213 WeakPolarHBondContact CG-O 3.31Å; M208-R213 PolarHBondContact O-N 3.21Å; M208-L216 HydrophobicContact SD-CB 4.1Å; M208-L216 HydrophobicContact SD-CD1 4.42Å; M208-V253 HydrophobicContact CE-CG1 4.21Å; M208-V253 HydrophobicContact CE-CG2 3.91Å; M208-I267 HydrophobicContact CE-CD1 4.37Å
209	C	88.8	Confident	87.9	Confident	14 Å²	14	57 Å²	57	10%	0.095	27%	0.274	C	S	.	.	H	α-helix	trans	-69.2	-32.5	178.8	-71.5	0	0	0	0	113.4	I205 S206 D207 E211 N212 Y257 Y260	I205-C209 WeakPolarHBondContact O-CB 3.33Å; I205-C209 PolarHBondContact O-N 3.27Å; I205-C209 PolarHBondContact O-SG 3.36Å; S206-C209 PolarHBondContact O-N 3.5Å; D207-C209 VanDerWaalsContact C-N 3.3Å; D207-C209 PolarHBondContact O-N 3.33Å; C209-E211 VanDerWaalsContact C-N 3.35Å; C209-N212 PolarHBondContact O-N 3.41Å; C209-N212 PolarHBondContact O-OD1 3.44Å; C209-Y257 HydrophobicContact CB-CD2 4.14Å; C209-Y257 HydrophobicContact CB-CE2 4.07Å; C209-Y260 HydrophobicContact CB-CD2 4.5Å; C209-Y260 HydrophobicContact CB-CE2 4.23Å
210	K	89.3	Confident	88.4	Confident	136 Å²	136	56.5 Å²	56.5	59%	0.591	27%	0.27	S	S	*	.	H	α-helix	trans	-66.1	-40	175.4	-72.8	170.3	-164.4	159.5	0	111.5	S206 D207 N212	S206-K210 WeakPolarHBondContact O-CG 3.39Å; S206-K210 PolarHBondContact O-N 2.86Å; S206-K210 WeakPolarHBondContact OG-CE 3.06Å; D207-K210 PolarHBondContact O-N 3.46Å; D207-K210 IonicContact OD1-NZ 3.33Å; D207-K210 PolarHBondContact OD1-NZ 3.46Å; K210-N212 VanDerWaalsContact C-N 3.3Å
211	E	87.1	Confident	88.7	Confident	127 Å²	127	60.8 Å²	60.8	59%	0.593	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-0.7	179.4	-65	-62.2	142.2	0	0	113.1	D207 M208 C209 R213	D207-E211 PolarHBondContact O-N 2.95Å; D207-E211 VanDerWaalsContact O-N 3.09Å; M208-E211 PolarHBondContact O-N 3.21Å; C209-E211 VanDerWaalsContact C-N 3.35Å; E211-R213 VanDerWaalsContact C-N 3.26Å; E211-R213 HydrophobicContact CB-CG 4Å; E211-R213 PolarHBondContact O-N 2.9Å
212	N	89.3	Confident	88.8	Confident	95 Å²	95	62.6 Å²	62.6	51%	0.508	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	38	-175.8	-53.6	-51.4	0	0	0	113.6	M208 C209 K210 I263	M208-N212 PolarHBondContact O-N 3.27Å; C209-N212 PolarHBondContact O-N 3.41Å; C209-N212 PolarHBondContact O-OD1 3.44Å; K210-N212 VanDerWaalsContact C-N 3.3Å; N212-I263 HydrophobicContact CB-CG2 4.07Å
213	R	86.1	Confident	89	Confident	155 Å²	155	56.7 Å²	56.7	59%	0.585	27%	0.272	S	S	*	.			trans	-86.9	144.8	177.3	-65.7	-177.1	-175.1	-179.5	2.9	110.8	M208 E211 Y260	M208-R213 HydrophobicContact CG-CB 3.97Å; M208-R213 WeakPolarHBondContact CG-O 3.31Å; M208-R213 PolarHBondContact O-N 3.21Å; E211-R213 VanDerWaalsContact C-N 3.26Å; E211-R213 HydrophobicContact CB-CG 4Å; E211-R213 PolarHBondContact O-N 2.9Å; R213-Y260 PolarHBondContact O-OH 2.86Å
214	E	87.8	Confident	89.1	Confident	60 Å²	60	52.9 Å²	52.9	28%	0.28	26%	0.261	S	S	.	.			trans	-96.6	2.4	176.9	65	-172.4	174	0	0	113.6	A264 I267 H268 D387	E214-A264 HydrophobicContact CB-CB 4.13Å; E214-I267 CarbonylContact O-C 3.43Å; E214-I267 VanDerWaalsContact O-CA 3.32Å; E214-I267 WeakPolarHBondContact O-CA 3.38Å; E214-I267 WeakPolarHBondContact O-CG2 3.43Å; E214-H268 PolarHBondContact O-N 2.94Å; E214-D387 HydrophobicContact CG-CB 4.35Å
215	S	88.9	Confident	89.2	Confident	31 Å²	31	53.1 Å²	53.1	22%	0.217	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125	-178.7	45.4	0	0	0	0	113.4	H268 D387	S215-H268 WeakPolarHBondContact CA-O 3.48Å; S215-D387 WeakPolarHBondContact CB-OD2 3.47Å; S215-D387 PolarHBondContact OG-OD2 2.67Å
216	L	91.1	Very high	89	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.016	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	121	175.3	-179.4	63.3	0	0	0	110	L189 I205 M208 A249 I267 H268 V269 R270	L189-L216 HydrophobicContact CD2-CD2 4.25Å; I205-L216 HydrophobicContact CG1-CD1 3.8Å; I205-L216 HydrophobicContact CG1-CD2 4.39Å; M208-L216 HydrophobicContact SD-CB 4.1Å; M208-L216 HydrophobicContact SD-CD1 4.42Å; L216-A249 HydrophobicContact CD2-CB 4.06Å; L216-I267 HydrophobicContact CB-CG2 4.41Å; L216-H268 PolarHBondContact N-O 2.93Å; L216-V269 CarbonylContact O-C 3.53Å; L216-V269 WeakPolarHBondContact O-CA 3.34Å; L216-R270 PolarHBondContact O-N 3.25Å
217	V	90.4	Very high	88.9	Confident	56 Å²	56	59.7 Å²	59.7	34%	0.339	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	124.5	-179.4	177.7	0	0	0	0	111.4	R270 C272	V217-R270 HydrophobicContact CG2-CB 4.2Å; V217-C272 HydrophobicContact CG1-CB 4.27Å; V217-C272 WeakPolarHBondContact CG1-SG 3.47Å
218	V	90.9	Very high	88.9	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.018	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	124.6	178.2	178.4	0	0	0	0	109.7	F185 F188 F201 L223 V269 R270 I271 C272	F185-V218 HydrophobicContact CZ-CG2 4.33Å; F188-V218 HydrophobicContact CE1-CG1 4.18Å; F201-V218 HydrophobicContact CE1-CG2 4.19Å; F201-V218 HydrophobicContact CZ-CG1 4.4Å; V218-L223 HydrophobicContact CG1-CD1 4.14Å; V218-V269 HydrophobicContact CB-CG1 4.15Å; V218-V269 HydrophobicContact CG2-CG1 3.57Å; V218-R270 PolarHBondContact N-O 3.03Å; V218-I271 WeakPolarHBondContact O-CA 3.45Å; V218-C272 PolarHBondContact O-N 3.21Å
219	N	90.8	Very high	88.9	Confident	25 Å²	25	62.1 Å²	62.1	13%	0.134	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	130.4	173.5	-171.3	13.9	0	0	0	109.6	E221 D222 L223	N219-E221 VanDerWaalsContact C-N 3.33Å; N219-D222 HydrophobicContact CB-CB 4.25Å; N219-D222 WeakPolarHBondContact CB-OD2 3.37Å; N219-D222 PolarHBondContact ND2-OD1 3.5Å; N219-L223 PolarHBondContact O-N 3.47Å
220	Y	91.1	Very high	88.9	Confident	31 Å²	31	61.5 Å²	61.5	12%	0.122	31%	0.307	C	S	.	.	H	α-helix	trans	-67.5	-34.2	179.8	-177.7	-91	0	0	0	112.3	L223 A224 A231 L234 I271 C272 L274 P275	Y220-L223 PolarHBondContact O-N 3.11Å; Y220-A224 HydrophobicContact CE1-CB 4.45Å; Y220-A224 WeakPolarHBondContact O-CB 3.42Å; Y220-A224 PolarHBondContact O-N 3.49Å; Y220-A231 HydrophobicContact CE2-CB 4.22Å; Y220-A231 PolarHBondContact OH-O 2.85Å; Y220-L234 HydrophobicContact CD2-CD2 4.07Å; Y220-L234 HydrophobicContact CE2-CD2 4.13Å; Y220-I271 HydrophobicContact CD2-CG2 4.33Å; Y220-C272 VanDerWaalsContact CB-O 3.28Å; Y220-C272 WeakPolarHBondContact CB-O 3.36Å; Y220-C272 PolarHBondContact N-O 3.23Å; Y220-L274 HydrophobicContact CD2-CD1 3.75Å; Y220-L274 HydrophobicContact CE2-CD1 4.33Å; Y220-L274 HydrophobicContact CG-CD1 4Å; Y220-P275 HydrophobicContact CD1-CG 4.29Å; Y220-P275 HydrophobicContact CE1-CG 4Å
221	E	90.1	Very high	88.9	Confident	112 Å²	112	55.2 Å²	55.2	52%	0.523	28%	0.28	S	S	.	.	H	α-helix	trans	-63.8	-45.5	-180	-63	172.4	168.3	0	0	111.5	N219 L223 A224 A225	N219-E221 VanDerWaalsContact C-N 3.33Å; E221-L223 VanDerWaalsContact C-N 3.3Å; E221-L223 PolarHBondContact O-N 3.49Å; E221-A224 PolarHBondContact O-N 2.91Å; E221-A225 WeakPolarHBondContact O-CB 3.42Å; E221-A225 PolarHBondContact O-N 3.26Å
222	D	88.4	Confident	89	Confident	38 Å²	38	56.3 Å²	56.3	20%	0.203	28%	0.28	C	S	.	.	H	α-helix	trans	-60.4	-41.3	176	-58.3	3.1	0	0	0	111.4	F188 H192 N219 A225 R226	F188-D222 HydrophobicContact CZ-CB 4.38Å; H192-D222 IonicContact CE1-OD2 2.73Å; N219-D222 HydrophobicContact CB-CB 4.25Å; N219-D222 WeakPolarHBondContact CB-OD2 3.37Å; N219-D222 PolarHBondContact ND2-OD1 3.5Å; D222-A225 PolarHBondContact O-N 2.99Å; D222-R226 PolarHBondContact O-N 2.88Å
223	L	89.5	Confident	89	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.016	26%	0.257	C	S	.	.	H	α-helix	trans	-66	-43	177.6	-170	153.4	0	0	0	110.8	F185 F188 V218 N219 Y220 E221 A225 E227 L230 A231 F245	F185-L223 HydrophobicContact CE2-CD1 4.32Å; F188-L223 HydrophobicContact CZ-CB 4.13Å; V218-L223 HydrophobicContact CG1-CD1 4.14Å; N219-L223 PolarHBondContact O-N 3.47Å; Y220-L223 PolarHBondContact O-N 3.11Å; E221-L223 VanDerWaalsContact C-N 3.3Å; E221-L223 PolarHBondContact O-N 3.49Å; L223-A225 PolarHBondContact O-N 3.42Å; L223-E227 CarbonylContact O-C 3.56Å; L223-E227 VanDerWaalsContact O-C 3.32Å; L223-E227 WeakPolarHBondContact O-CA 3.43Å; L223-E227 PolarHBondContact O-N 3.49Å; L223-L230 HydrophobicContact CD2-CB 3.95Å; L223-A231 HydrophobicContact CD2-CB 3.66Å; L223-F245 HydrophobicContact CD1-CE2 4.43Å; L223-F245 HydrophobicContact CD1-CZ 4.42Å
224	A	89.9	Confident	89.2	Confident	38 Å²	38	44.8 Å²	44.8	31%	0.314	23%	0.23	S	C	.	.	H	α-helix	trans	-65.9	-35.7	176.8	0	0	0	0	0	112.9	Y220 E221 A231	Y220-A224 HydrophobicContact CE1-CB 4.45Å; Y220-A224 WeakPolarHBondContact O-CB 3.42Å; Y220-A224 PolarHBondContact O-N 3.49Å; E221-A224 PolarHBondContact O-N 2.91Å; A224-A231 HydrophobicContact CB-CB 3.88Å
225	A	88.7	Confident	89.3	Confident	87 Å²	87	43.7 Å²	43.7	72%	0.719	23%	0.228	S	C	*	.	H	α-helix	trans	-68.4	-38.1	-179.6	0	0	0	0	0	113	E221 D222 L223	E221-A225 WeakPolarHBondContact O-CB 3.42Å; E221-A225 PolarHBondContact O-N 3.26Å; D222-A225 PolarHBondContact O-N 2.99Å; L223-A225 PolarHBondContact O-N 3.42Å
226	R	85.4	Confident	89.3	Confident	119 Å²	119	46 Å²	46	45%	0.449	24%	0.235	S	C	.	.	H	α-helix	trans	-86.7	-49.8	176.8	-67.3	-65.3	-176.8	155.8	-2.5	112.3	F188 V193 D222	F188-R226 HydrophobicContact CD2-CB 3.86Å; F188-R226 HydrophobicContact CD2-CG 4.06Å; F188-R226 HydrophobicContact CE2-CB 4.01Å; F188-R226 HydrophobicContact CE2-CG 3.98Å; V193-R226 PolarHBondContact O-NH2 3.32Å; D222-R226 PolarHBondContact O-N 2.88Å
227	E	86.9	Confident	89.3	Confident	40 Å²	40	46 Å²	46	19%	0.187	24%	0.235	C	C	.	.			trans	-129.5	74.8	-165.5	-150.7	72.4	-150.4	0	0	110.9	R184 L223 V229 L230 A231	R184-E227 WeakPolarHBondContact CD-OE1 3.3Å; R184-E227 IonicContact CZ-OE1 3.3Å; R184-E227 IonicContact NE-OE1 3.91Å; R184-E227 IonicContact NH1-OE1 3.84Å; R184-E227 PolarHBondContact NH1-OE1 3.04Å; L223-E227 CarbonylContact O-C 3.56Å; L223-E227 VanDerWaalsContact O-C 3.32Å; L223-E227 WeakPolarHBondContact O-CA 3.43Å; L223-E227 PolarHBondContact O-N 3.49Å; E227-V229 PolarHBondContact O-N 3.31Å; E227-L230 HydrophobicContact CB-CB 4.47Å; E227-L230 HydrophobicContact CB-CD1 4.37Å; E227-L230 HydrophobicContact CB-CG 4.39Å; E227-L230 HydrophobicContact CG-CB 4.2Å; E227-L230 HydrophobicContact CG-CD1 3.77Å; E227-L230 HydrophobicContact CG-CG 3.65Å; E227-L230 PolarHBondContact O-N 3.04Å; E227-A231 PolarHBondContact O-N 3.23Å
228	H	88.2	Confident	89.4	Confident	121 Å²	121	43.3 Å²	43.3	56%	0.56	22%	0.219	S	C	*	.	H	α-helix	trans	-56.1	-33.2	-178.5	69.2	-80.7	0	0	0	113.9	A231 Y232	H228-A231 PolarHBondContact O-N 3.46Å; H228-Y232 PolarHBondContact O-N 3.41Å
229	V	88.9	Confident	89.3	Confident	11 Å²	11	46.2 Å²	46.2	7%	0.067	24%	0.237	C	C	.	.	H	α-helix	trans	-64.6	-46.1	-179.6	179.9	0	0	0	0	111.5	L160 E227 A231 Y232 F233	L160-V229 HydrophobicContact CB-CG1 3.84Å; L160-V229 HydrophobicContact CD1-CG1 4.25Å; E227-V229 PolarHBondContact O-N 3.31Å; V229-A231 VanDerWaalsContact C-N 3.32Å; V229-A231 PolarHBondContact O-N 2.89Å; V229-Y232 PolarHBondContact O-N 3.03Å; V229-F233 HydrophobicContact CG1-CD2 3.77Å; V229-F233 HydrophobicContact CG1-CE2 3.37Å; V229-F233 HydrophobicContact CG1-CZ 4.33Å; V229-F233 VanDerWaalsContact O-CD2 3.29Å; V229-F233 WeakPolarHBondContact O-CD2 3.39Å; V229-F233 PolarHBondContact O-N 3.41Å; V229-F233 VanDerWaalsContact O-N 3.16Å
230	L	88.4	Confident	89.3	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-67.3	-37.5	178.8	-63.5	-172.8	0	0	0	111.1	I181 R184 F185 L223 E227 Y232 F233 L234 M241 F245	I181-L230 HydrophobicContact CB-CD2 4.18Å; I181-L230 HydrophobicContact CG1-CD2 3.85Å; I181-L230 HydrophobicContact CG2-CD2 3.84Å; R184-L230 HydrophobicContact CB-CD1 4.23Å; F185-L230 HydrophobicContact CB-CD1 4.4Å; L223-L230 HydrophobicContact CD2-CB 3.95Å; E227-L230 HydrophobicContact CB-CB 4.47Å; E227-L230 HydrophobicContact CB-CD1 4.37Å; E227-L230 HydrophobicContact CB-CG 4.39Å; E227-L230 HydrophobicContact CG-CB 4.2Å; E227-L230 HydrophobicContact CG-CD1 3.77Å; E227-L230 HydrophobicContact CG-CG 3.65Å; E227-L230 PolarHBondContact O-N 3.04Å; L230-Y232 VanDerWaalsContact C-N 3.29Å; L230-Y232 PolarHBondContact O-N 2.89Å; L230-F233 PolarHBondContact O-N 3.46Å; L230-L234 VanDerWaalsContact O-CB 3.3Å; L230-L234 WeakPolarHBondContact O-CB 3.24Å; L230-L234 PolarHBondContact O-N 2.91Å; L230-L234 VanDerWaalsContact O-N 3.09Å; L230-M241 HydrophobicContact CD2-CE 4.23Å; L230-F245 HydrophobicContact CD1-CE1 4.36Å
231	A	88.8	Confident	89.4	Confident	4 Å²	4	46 Å²	46	3%	0.033	24%	0.236	C	C	.	.	H	α-helix	trans	-61	-39.3	175	0	0	0	0	0	111.6	Y220 L223 A224 E227 H228 V229 P235	Y220-A231 HydrophobicContact CE2-CB 4.22Å; Y220-A231 PolarHBondContact OH-O 2.85Å; L223-A231 HydrophobicContact CD2-CB 3.66Å; A224-A231 HydrophobicContact CB-CB 3.88Å; E227-A231 PolarHBondContact O-N 3.23Å; H228-A231 PolarHBondContact O-N 3.46Å; V229-A231 VanDerWaalsContact C-N 3.32Å; V229-A231 PolarHBondContact O-N 2.89Å; A231-P235 WeakPolarHBondContact O-CD 3.31Å
232	Y	88.9	Confident	89.5	Confident	150 Å²	150	41.4 Å²	41.4	59%	0.588	22%	0.216	S	C	*	.	H	α-helix	trans	-66.9	-43.4	177	179.8	-95.3	0	0	0	113	H228 V229 L230 L234 P235	H228-Y232 PolarHBondContact O-N 3.41Å; V229-Y232 PolarHBondContact O-N 3.03Å; L230-Y232 VanDerWaalsContact C-N 3.29Å; L230-Y232 PolarHBondContact O-N 2.89Å; Y232-L234 VanDerWaalsContact C-N 3.35Å; Y232-L234 PolarHBondContact O-N 3.25Å; Y232-P235 WeakPolarHBondContact O-CD 3.13Å
233	F	89.1	Confident	89.6	Confident	6 Å²	6	45.7 Å²	45.7	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-74.2	-24	-178	-68.6	-45.9	0	0	0	114.3	L160 M163 V168 V229 L230 E236 A237 M241	L160-F233 HydrophobicContact CB-CE2 4.38Å; L160-F233 HydrophobicContact CD2-CE2 4.24Å; M163-F233 HydrophobicContact CG-CZ 4.41Å; M163-F233 HydrophobicContact SD-CE1 3.52Å; M163-F233 VanDerWaalsContact SD-CE1 3.52Å; M163-F233 HydrophobicContact SD-CZ 3.96Å; V168-F233 HydrophobicContact CB-CD1 4.46Å; V168-F233 HydrophobicContact CG1-CB 4.4Å; V168-F233 HydrophobicContact CG1-CD1 3.52Å; V168-F233 HydrophobicContact CG1-CE1 4.19Å; V168-F233 HydrophobicContact CG1-CG 4.3Å; V168-F233 HydrophobicContact CG2-CD1 4.09Å; V168-F233 HydrophobicContact CG2-CE1 4.07Å; V229-F233 HydrophobicContact CG1-CD2 3.77Å; V229-F233 HydrophobicContact CG1-CE2 3.37Å; V229-F233 HydrophobicContact CG1-CZ 4.33Å; V229-F233 VanDerWaalsContact O-CD2 3.29Å; V229-F233 WeakPolarHBondContact O-CD2 3.39Å; V229-F233 PolarHBondContact O-N 3.41Å; V229-F233 VanDerWaalsContact O-N 3.16Å; L230-F233 PolarHBondContact O-N 3.46Å; F233-E236 PolarHBondContact O-N 2.84Å; F233-A237 PolarHBondContact O-N 3.15Å; F233-A237 VanDerWaalsContact O-N 3.16Å; F233-M241 HydrophobicContact CB-SD 4.45Å
234	L	90.3	Very high	89.8	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-44.8	-172.2	-174.9	64.2	0	0	0	114.2	Y220 L230 Y232 E236 P238 M241 F245 I271 L291	Y220-L234 HydrophobicContact CD2-CD2 4.07Å; Y220-L234 HydrophobicContact CE2-CD2 4.13Å; L230-L234 VanDerWaalsContact O-CB 3.3Å; L230-L234 WeakPolarHBondContact O-CB 3.24Å; L230-L234 PolarHBondContact O-N 2.91Å; L230-L234 VanDerWaalsContact O-N 3.09Å; Y232-L234 VanDerWaalsContact C-N 3.35Å; Y232-L234 PolarHBondContact O-N 3.25Å; L234-E236 VanDerWaalsContact C-N 3.34Å; L234-E236 PolarHBondContact O-N 2.89Å; L234-P238 WeakPolarHBondContact O-CA 3.46Å; L234-P238 WeakPolarHBondContact O-CB 3.49Å; L234-M241 HydrophobicContact CD1-CB 3.76Å; L234-M241 HydrophobicContact CD1-CG 4.45Å; L234-F245 HydrophobicContact CD1-CD2 4.38Å; L234-F245 HydrophobicContact CD1-CE2 3.67Å; L234-F245 HydrophobicContact CD1-CZ 4.42Å; L234-F245 HydrophobicContact CD2-CE2 4.31Å; L234-I271 HydrophobicContact CD1-CD1 3.95Å; L234-I271 HydrophobicContact CD2-CD1 3.57Å; L234-I271 HydrophobicContact CD2-CG1 4.28Å; L234-I271 HydrophobicContact CG-CD1 3.91Å; L234-L291 HydrophobicContact CG-CD2 4.48Å
235	P	90.8	Very high	90	Very high	38 Å²	38	44 Å²	44	25%	0.247	22%	0.218	C	C	.	.	H	α-helix	trans	-68.7	-28	176.8	-22.4	34.7	0	0	0	114.5	A231 Y232 Q290 L291	A231-P235 WeakPolarHBondContact O-CD 3.31Å; Y232-P235 WeakPolarHBondContact O-CD 3.13Å; P235-Q290 WeakPolarHBondContact O-CA 3.39Å; P235-Q290 WeakPolarHBondContact O-CB 3.42Å; P235-L291 PolarHBondContact O-N 3.22Å; P235-L291 VanDerWaalsContact O-N 3.14Å
236	E	89.6	Confident	90.1	Very high	78 Å²	78	41.5 Å²	41.5	36%	0.364	19%	0.193	S	C	.	.	H	α-helix	trans	-83.1	-40.5	-173.5	-168.7	171.4	167.3	0	0	112.9	V168 F233 L234 P238	V168-E236 HydrophobicContact CB-CG 3.98Å; V168-E236 WeakPolarHBondContact CB-OE1 3.15Å; V168-E236 HydrophobicContact CG1-CB 4.16Å; V168-E236 HydrophobicContact CG1-CG 4.17Å; V168-E236 HydrophobicContact CG2-CG 4.28Å; V168-E236 VanDerWaalsContact CG2-OE1 3.24Å; V168-E236 WeakPolarHBondContact CG2-OE1 3.44Å; V168-E236 VanDerWaalsContact CG2-OE2 3.25Å; V168-E236 WeakPolarHBondContact CG2-OE2 3.34Å; F233-E236 PolarHBondContact O-N 2.84Å; L234-E236 VanDerWaalsContact C-N 3.34Å; L234-E236 PolarHBondContact O-N 2.89Å; E236-P238 VanDerWaalsContact C-CD 3.49Å
237	A	89.8	Confident	90.4	Very high	3 Å²	3	39.9 Å²	39.9	3%	0.025	19%	0.19	C	C	.	.	S	Bend	trans	-129.9	61.9	177.5	0	0	0	0	0	112.7	V168 R169 F233 T239 M241	V168-A237 HydrophobicContact CG1-CB 4.08Å; R169-A237 HydrophobicContact CB-CB 4.38Å; F233-A237 PolarHBondContact O-N 3.15Å; F233-A237 VanDerWaalsContact O-N 3.16Å; A237-T239 PolarHBondContact O-N 3.31Å; A237-M241 WeakPolarHBondContact O-CB 3.4Å; A237-M241 VanDerWaalsContact O-CG 3.26Å; A237-M241 WeakPolarHBondContact O-CG 3.17Å; A237-M241 PolarHBondContact O-N 3.44Å
238	P	92.8	Very high	90.7	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.6	-34.1	-171.4	25.2	-34.9	0	0	0	113.9	L234 E236 E240 M241 L242 L291 I403	L234-P238 WeakPolarHBondContact O-CA 3.46Å; L234-P238 WeakPolarHBondContact O-CB 3.49Å; E236-P238 VanDerWaalsContact C-CD 3.49Å; P238-E240 VanDerWaalsContact C-N 3.31Å; P238-E240 PolarHBondContact O-N 3.04Å; P238-M241 PolarHBondContact O-N 2.55Å; P238-L242 VanDerWaalsContact O-CB 3.29Å; P238-L242 WeakPolarHBondContact O-CB 3.42Å; P238-L242 VanDerWaalsContact O-CG 3.23Å; P238-L242 WeakPolarHBondContact O-CG 3.47Å; P238-L242 PolarHBondContact O-N 3.06Å; P238-L291 HydrophobicContact CB-CB 4.08Å; P238-L291 HydrophobicContact CB-CD1 4.27Å; P238-L291 HydrophobicContact CG-CB 4.2Å; P238-I403 HydrophobicContact CB-CD1 4.02Å; P238-I403 HydrophobicContact CB-CG1 4.1Å; P238-I403 HydrophobicContact CG-CD1 3.98Å; P238-I403 HydrophobicContact CG-CG1 3.9Å; P238-I403 HydrophobicContact CG-CG2 4.24Å
239	T	90.1	Very high	90.8	Very high	64 Å²	64	32.2 Å²	32.2	39%	0.393	15%	0.154	S	C	.	.	H	α-helix	trans	-64.5	-35.2	-174.3	-48.4	0	0	0	0	113.1	A237 K243	A237-T239 PolarHBondContact O-N 3.31Å; T239-K243 WeakPolarHBondContact O-CD 3.19Å; T239-K243 WeakPolarHBondContact O-CG 3.27Å
240	E	90.8	Very high	90.9	Very high	51 Å²	51	35.1 Å²	35.1	24%	0.238	17%	0.166	C	C	.	.	H	α-helix	trans	-85.1	-43.2	179.6	-64.7	177.6	-163.8	0	0	110.3	R169 V172 S173 P238 L242 K243 I244	R169-E240 WeakPolarHBondContact CG-OE1 3.46Å; V172-E240 HydrophobicContact CG1-CB 4.02Å; S173-E240 PolarHBondContact N-OE2 3.4Å; P238-E240 VanDerWaalsContact C-N 3.31Å; P238-E240 PolarHBondContact O-N 3.04Å; E240-L242 PolarHBondContact O-N 3.19Å; E240-K243 PolarHBondContact O-N 3.38Å; E240-I244 WeakPolarHBondContact O-CG1 3.45Å; E240-I244 PolarHBondContact O-N 3.49Å; E240-I244 VanDerWaalsContact O-N 3.15Å
241	M	91.8	Very high	91	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-56.4	-47.5	176.3	-74.4	-63	-53.6	0	0	112.8	V172 I181 L230 F233 L234 A237 P238 K243 I244 F245	V172-M241 HydrophobicContact CG1-CG 4.27Å; V172-M241 HydrophobicContact CG1-SD 3.81Å; V172-M241 HydrophobicContact CG2-SD 4.11Å; I181-M241 HydrophobicContact CD1-SD 3.89Å; I181-M241 HydrophobicContact CG2-CE 3.68Å; I181-M241 HydrophobicContact CG2-SD 4.03Å; L230-M241 HydrophobicContact CD2-CE 4.23Å; F233-M241 HydrophobicContact CB-SD 4.45Å; L234-M241 HydrophobicContact CD1-CB 3.76Å; L234-M241 HydrophobicContact CD1-CG 4.45Å; A237-M241 WeakPolarHBondContact O-CB 3.4Å; A237-M241 VanDerWaalsContact O-CG 3.26Å; A237-M241 WeakPolarHBondContact O-CG 3.17Å; A237-M241 PolarHBondContact O-N 3.44Å; P238-M241 PolarHBondContact O-N 2.55Å; M241-K243 VanDerWaalsContact C-N 3.31Å; M241-K243 PolarHBondContact O-N 3.06Å; M241-I244 PolarHBondContact O-N 2.78Å; M241-I244 VanDerWaalsContact O-N 3.16Å; M241-F245 HydrophobicContact CE-CE1 3.58Å; M241-F245 HydrophobicContact CE-CE2 4.13Å; M241-F245 HydrophobicContact CE-CZ 3.34Å; M241-F245 WeakPolarHBondContact O-CG 3.31Å; M241-F245 PolarHBondContact O-N 3.04Å
242	L	92.1	Very high	91.1	Very high	17 Å²	17	39.7 Å²	39.7	9%	0.089	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-37.9	179.5	-73.7	171.7	0	0	0	112.1	P238 E240 I244 F245 D246 I271 I403	P238-L242 VanDerWaalsContact O-CB 3.29Å; P238-L242 WeakPolarHBondContact O-CB 3.42Å; P238-L242 VanDerWaalsContact O-CG 3.23Å; P238-L242 WeakPolarHBondContact O-CG 3.47Å; P238-L242 PolarHBondContact O-N 3.06Å; E240-L242 PolarHBondContact O-N 3.19Å; L242-I244 VanDerWaalsContact C-N 3.33Å; L242-I244 PolarHBondContact O-N 3.25Å; L242-F245 PolarHBondContact O-N 3.2Å; L242-D246 PolarHBondContact O-N 3.01Å; L242-I271 HydrophobicContact CD2-CD1 3.74Å; L242-I271 HydrophobicContact CD2-CG1 4.24Å; L242-I403 HydrophobicContact CD1-CD1 4.36Å
243	K	90.9	Very high	91.2	Very high	128 Å²	128	32.6 Å²	32.6	56%	0.557	16%	0.159	S	C	*	.	H	α-helix	trans	-63.6	-39.8	175.3	-69.1	174.4	-176.7	-177	0	112.2	T239 E240 M241 F245 D246 E247	T239-K243 WeakPolarHBondContact O-CD 3.19Å; T239-K243 WeakPolarHBondContact O-CG 3.27Å; E240-K243 PolarHBondContact O-N 3.38Å; M241-K243 VanDerWaalsContact C-N 3.31Å; M241-K243 PolarHBondContact O-N 3.06Å; K243-F245 VanDerWaalsContact C-N 3.33Å; K243-D246 PolarHBondContact O-N 3.28Å; K243-E247 WeakPolarHBondContact O-CG 3.48Å; K243-E247 PolarHBondContact O-N 3.3Å; K243-E247 VanDerWaalsContact O-N 3.13Å
244	I	93.5	Very high	91.2	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-66	-40	176.7	-61.2	165.1	0	0	0	110.3	V172 R178 I181 Y182 E240 M241 L242 E247 A248	V172-I244 HydrophobicContact CG1-CD1 3.73Å; R178-I244 HydrophobicContact CB-CD1 4.41Å; R178-I244 HydrophobicContact CG-CD1 3.85Å; R178-I244 HydrophobicContact CG-CG1 4.03Å; I181-I244 HydrophobicContact CB-CG2 4.48Å; I181-I244 HydrophobicContact CG2-CD1 4.38Å; I181-I244 HydrophobicContact CG2-CG2 3.88Å; Y182-I244 HydrophobicContact CD2-CG2 4.13Å; E240-I244 WeakPolarHBondContact O-CG1 3.45Å; E240-I244 PolarHBondContact O-N 3.49Å; E240-I244 VanDerWaalsContact O-N 3.15Å; M241-I244 PolarHBondContact O-N 2.78Å; M241-I244 VanDerWaalsContact O-N 3.16Å; L242-I244 VanDerWaalsContact C-N 3.33Å; L242-I244 PolarHBondContact O-N 3.25Å; I244-E247 PolarHBondContact O-N 3.32Å; I244-A248 WeakPolarHBondContact O-CB 3.37Å; I244-A248 PolarHBondContact O-N 3.23Å
245	F	93.4	Very high	91.2	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.009	20%	0.196	C	C	.	.	H	α-helix	trans	-65.4	-39.7	176.4	-67.9	-13.3	0	0	0	112.6	I181 F185 L223 L230 L234 M241 L242 K243 A248 A249 V269	I181-F245 HydrophobicContact CG2-CE1 4.16Å; F185-F245 HydrophobicContact CB-CD1 3.98Å; F185-F245 HydrophobicContact CB-CE1 3.94Å; F185-F245 HydrophobicContact CD1-CB 4.28Å; F185-F245 AromaticContact CD1-CD1 3.75Å; F185-F245 HydrophobicContact CD1-CD1 3.75Å; F185-F245 HydrophobicContact CD1-CE1 4.41Å; F185-F245 HydrophobicContact CD1-CG 4.23Å; F185-F245 AromaticContact CD2-CD1 3.63Å; F185-F245 HydrophobicContact CD2-CD1 3.63Å; F185-F245 AromaticContact CD2-CE1 3.51Å; F185-F245 HydrophobicContact CD2-CE1 3.51Å; F185-F245 HydrophobicContact CD2-CG 4.2Å; F185-F245 AromaticContact CD2-CZ 3.98Å; F185-F245 HydrophobicContact CD2-CZ 3.98Å; F185-F245 HydrophobicContact CE1-CB 3.87Å; F185-F245 HydrophobicContact CE1-CD1 4.07Å; F185-F245 HydrophobicContact CE1-CG 4.07Å; F185-F245 AromaticContact CE2-CD1 3.98Å; F185-F245 HydrophobicContact CE2-CD1 3.98Å; F185-F245 HydrophobicContact CE2-CD2 4.25Å; F185-F245 HydrophobicContact CE2-CE1 4.09Å; F185-F245 HydrophobicContact CE2-CE2 4.34Å; F185-F245 HydrophobicContact CE2-CG 4.06Å; F185-F245 HydrophobicContact CE2-CZ 4.26Å; F185-F245 AromaticContact CG-CD1 3.49Å; F185-F245 HydrophobicContact CG-CD1 3.49Å; F185-F245 VanDerWaalsContact CG-CD1 3.49Å; F185-F245 AromaticContact CG-CE1 3.7Å; F185-F245 HydrophobicContact CG-CE1 3.7Å; F185-F245 HydrophobicContact CG-CG 4.27Å; F185-F245 HydrophobicContact CZ-CB 4.08Å; F185-F245 HydrophobicContact CZ-CD1 4.18Å; F185-F245 HydrophobicContact CZ-CD2 4.38Å; F185-F245 AromaticContact CZ-CG 3.99Å; F185-F245 HydrophobicContact CZ-CG 3.99Å; L223-F245 HydrophobicContact CD1-CE2 4.43Å; L223-F245 HydrophobicContact CD1-CZ 4.42Å; L230-F245 HydrophobicContact CD1-CE1 4.36Å; L234-F245 HydrophobicContact CD1-CD2 4.38Å; L234-F245 HydrophobicContact CD1-CE2 3.67Å; L234-F245 HydrophobicContact CD1-CZ 4.42Å; L234-F245 HydrophobicContact CD2-CE2 4.31Å; M241-F245 HydrophobicContact CE-CE1 3.58Å; M241-F245 HydrophobicContact CE-CE2 4.13Å; M241-F245 HydrophobicContact CE-CZ 3.34Å; M241-F245 WeakPolarHBondContact O-CG 3.31Å; M241-F245 PolarHBondContact O-N 3.04Å; L242-F245 PolarHBondContact O-N 3.2Å; K243-F245 VanDerWaalsContact C-N 3.33Å; F245-A248 PolarHBondContact O-N 3.24Å; F245-A249 VanDerWaalsContact O-CB 3.27Å; F245-A249 WeakPolarHBondContact O-CB 3.15Å; F245-A249 PolarHBondContact O-N 2.95Å; F245-V269 HydrophobicContact CB-CB 4.11Å; F245-V269 HydrophobicContact CB-CG1 4.43Å; F245-V269 HydrophobicContact CB-CG2 3.97Å
246	D	92.5	Very high	91	Very high	34 Å²	34	39.2 Å²	39.2	18%	0.182	20%	0.2	C	C	.	.	H	α-helix	trans	-60.4	-47.1	175.4	-71.5	0.5	0	0	0	111.1	L242 K243 A248 A249 K250 I267 H268 V269	L242-D246 PolarHBondContact O-N 3.01Å; K243-D246 PolarHBondContact O-N 3.28Å; D246-A248 PolarHBondContact O-N 3.09Å; D246-A249 PolarHBondContact O-N 3.2Å; D246-K250 WeakPolarHBondContact O-CB 3.33Å; D246-K250 PolarHBondContact O-N 3.19Å; D246-I267 WeakPolarHBondContact CA-O 3.39Å; D246-I267 WeakPolarHBondContact CB-O 3.22Å; D246-H268 WeakPolarHBondContact OD1-CA 3.33Å; D246-H268 IonicContact OD2-CE1 2.86Å; D246-H268 IonicContact OD2-ND1 3.2Å; D246-H268 PolarHBondContact OD2-ND1 3.39Å; D246-V269 PolarHBondContact OD1-N 2.98Å
247	E	91.8	Very high	90.9	Very high	84 Å²	84	40.2 Å²	40.2	39%	0.393	20%	0.201	S	C	.	.	H	α-helix	trans	-60.6	-43.6	175.9	-71	173.5	-179.6	0	0	111.8	R178 Y182 K243 I244 E251	R178-E247 IonicContact CZ-OE2 3.24Å; R178-E247 VanDerWaalsContact NH2-CD 3.28Å; R178-E247 IonicContact NH2-OE1 3.46Å; R178-E247 PolarHBondContact NH2-OE1 2.85Å; R178-E247 IonicContact NH2-OE2 3.51Å; R178-E247 PolarHBondContact NH2-OE2 3.2Å; Y182-E247 HydrophobicContact CD2-CB 4.4Å; Y182-E247 HydrophobicContact CE2-CB 3.87Å; K243-E247 WeakPolarHBondContact O-CG 3.48Å; K243-E247 PolarHBondContact O-N 3.3Å; K243-E247 VanDerWaalsContact O-N 3.13Å; I244-E247 PolarHBondContact O-N 3.32Å; E247-E251 PolarHBondContact O-N 3.26Å
248	A	92.2	Very high	90.9	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-69.8	-41.9	-178.6	0	0	0	0	0	112.1	Y182 F185 K186 I244 F245 D246 E251 V252	Y182-A248 HydrophobicContact CD2-CB 3.68Å; Y182-A248 VanDerWaalsContact CE2-CA 3.46Å; Y182-A248 HydrophobicContact CE2-CB 3.72Å; F185-A248 HydrophobicContact CD1-CB 3.64Å; F185-A248 HydrophobicContact CE1-CB 4.38Å; K186-A248 HydrophobicContact CG-CB 4.03Å; I244-A248 WeakPolarHBondContact O-CB 3.37Å; I244-A248 PolarHBondContact O-N 3.23Å; F245-A248 PolarHBondContact O-N 3.24Å; D246-A248 PolarHBondContact O-N 3.09Å; A248-E251 PolarHBondContact O-N 3.44Å; A248-V252 WeakPolarHBondContact O-CG2 3.09Å; A248-V252 PolarHBondContact O-N 3.27Å
249	A	91.1	Very high	90.6	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-43.8	175.7	0	0	0	0	0	111	L216 F245 D246 E251 V252 V253 I267 V269	L216-A249 HydrophobicContact CD2-CB 4.06Å; F245-A249 VanDerWaalsContact O-CB 3.27Å; F245-A249 WeakPolarHBondContact O-CB 3.15Å; F245-A249 PolarHBondContact O-N 2.95Å; D246-A249 PolarHBondContact O-N 3.2Å; A249-E251 VanDerWaalsContact C-N 3.33Å; A249-E251 PolarHBondContact O-N 3.47Å; A249-V252 PolarHBondContact O-N 3.1Å; A249-V253 VanDerWaalsContact O-CG2 3.26Å; A249-V253 WeakPolarHBondContact O-CG2 3.4Å; A249-V253 PolarHBondContact O-N 3.49Å; A249-I267 HydrophobicContact CB-CG2 4.27Å; A249-V269 HydrophobicContact CB-CG2 3.82Å
250	K	90.7	Very high	90.5	Very high	72 Å²	72	50.6 Å²	50.6	31%	0.313	25%	0.251	S	S	.	.	H	α-helix	trans	-53.9	-47.9	176.5	-179.4	173.6	176.2	171.6	0	112.2	D246 V253 L254 H265	D246-K250 WeakPolarHBondContact O-CB 3.33Å; D246-K250 PolarHBondContact O-N 3.19Å; K250-V253 PolarHBondContact O-N 3.3Å; K250-L254 HydrophobicContact CG-CD1 3.89Å; K250-L254 HydrophobicContact CG-CG 4.43Å; K250-L254 WeakPolarHBondContact O-CB 3.41Å; K250-L254 VanDerWaalsContact O-CG 3.27Å; K250-L254 WeakPolarHBondContact O-CG 3.49Å; K250-L254 PolarHBondContact O-N 2.78Å; K250-H265 VanDerWaalsContact CE-O 3.22Å; K250-H265 WeakPolarHBondContact CE-O 3.3Å; K250-H265 PolarHBondContact NZ-O 3.46Å
251	E	90.8	Very high	90.3	Very high	99 Å²	99	51.6 Å²	51.6	46%	0.463	26%	0.258	S	S	.	.	H	α-helix	trans	-66.8	-39	178.7	-77.6	-160.2	-165.5	0	0	113.7	Y182 K186 E247 A248 A249 V253 L254 A255	Y182-E251 WeakPolarHBondContact OH-CG 3.04Å; Y182-E251 PolarHBondContact OH-OE1 3.04Å; Y182-E251 PolarHBondContact OH-OE2 3.01Å; Y182-E251 VanDerWaalsContact OH-OE2 3.08Å; K186-E251 WeakPolarHBondContact CE-OE2 3.48Å; K186-E251 IonicContact NZ-OE2 2.89Å; K186-E251 PolarHBondContact NZ-OE2 3.18Å; E247-E251 PolarHBondContact O-N 3.26Å; A248-E251 PolarHBondContact O-N 3.44Å; A249-E251 VanDerWaalsContact C-N 3.33Å; A249-E251 PolarHBondContact O-N 3.47Å; E251-V253 VanDerWaalsContact C-N 3.31Å; E251-V253 PolarHBondContact O-N 3.06Å; E251-L254 PolarHBondContact O-N 3.39Å; E251-A255 VanDerWaalsContact O-CB 3.26Å; E251-A255 WeakPolarHBondContact O-CB 3.41Å; E251-A255 PolarHBondContact O-N 3.35Å
252	V	90.8	Very high	90.1	Very high	3 Å²	3	61.9 Å²	61.9	2%	0.018	30%	0.297	C	S	.	.	H	α-helix	trans	-63.2	-41.8	177	173.7	0	0	0	0	110.6	K186 L189 I205 A248 A249 A255 M256	K186-V252 HydrophobicContact CG-CG2 4.17Å; L189-V252 HydrophobicContact CD1-CB 4.39Å; L189-V252 HydrophobicContact CD1-CG2 4.1Å; I205-V252 HydrophobicContact CD1-CG1 4.02Å; A248-V252 WeakPolarHBondContact O-CG2 3.09Å; A248-V252 PolarHBondContact O-N 3.27Å; A249-V252 PolarHBondContact O-N 3.1Å; V252-A255 PolarHBondContact O-N 2.95Å; V252-M256 HydrophobicContact CG1-CE 4.25Å; V252-M256 PolarHBondContact O-N 3.11Å; V252-M256 VanDerWaalsContact O-N 3.14Å
253	V	90.4	Very high	89.7	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-67.2	-45.1	178.3	174.5	0	0	0	0	111	I205 M208 A249 K250 E251 A255 M256 Y257 Y260 I267	I205-V253 HydrophobicContact CG2-CG2 3.85Å; M208-V253 HydrophobicContact CE-CG1 4.21Å; M208-V253 HydrophobicContact CE-CG2 3.91Å; A249-V253 VanDerWaalsContact O-CG2 3.26Å; A249-V253 WeakPolarHBondContact O-CG2 3.4Å; A249-V253 PolarHBondContact O-N 3.49Å; K250-V253 PolarHBondContact O-N 3.3Å; E251-V253 VanDerWaalsContact C-N 3.31Å; E251-V253 PolarHBondContact O-N 3.06Å; V253-A255 VanDerWaalsContact C-N 3.3Å; V253-A255 PolarHBondContact O-N 3.38Å; V253-M256 PolarHBondContact O-N 3.25Å; V253-Y257 PolarHBondContact O-N 3.38Å; V253-Y260 HydrophobicContact CG1-CD1 3.73Å; V253-Y260 HydrophobicContact CG1-CE1 4.21Å; V253-Y260 HydrophobicContact CG1-CG 4.07Å; V253-I267 HydrophobicContact CB-CD1 3.61Å; V253-I267 HydrophobicContact CG1-CD1 3.72Å; V253-I267 HydrophobicContact CG2-CD1 3.61Å
254	L	89.7	Confident	88.9	Confident	48 Å²	48	60.4 Å²	60.4	25%	0.251	30%	0.296	S	S	.	.	H	α-helix	trans	-65.7	-32.6	177	-70.5	174.9	0	0	0	112.6	K250 E251 Y257 P258 D261	K250-L254 HydrophobicContact CG-CD1 3.89Å; K250-L254 HydrophobicContact CG-CG 4.43Å; K250-L254 WeakPolarHBondContact O-CB 3.41Å; K250-L254 VanDerWaalsContact O-CG 3.27Å; K250-L254 WeakPolarHBondContact O-CG 3.49Å; K250-L254 PolarHBondContact O-N 2.78Å; E251-L254 PolarHBondContact O-N 3.39Å; L254-Y257 CarbonylContact O-C 3.58Å; L254-Y257 VanDerWaalsContact O-C 3.26Å; L254-P258 VanDerWaalsContact O-CA 3.25Å; L254-P258 WeakPolarHBondContact O-CA 3.19Å; L254-P258 VanDerWaalsContact O-N 3.13Å; L254-D261 HydrophobicContact CD2-CB 3.85Å
255	A	90.3	Very high	88.1	Confident	66 Å²	66	65.8 Å²	65.8	55%	0.545	32%	0.321	S	S	.	.	H	α-helix	trans	-66.5	-37.7	173.9	0	0	0	0	0	112.2	E251 V252 V253	E251-A255 VanDerWaalsContact O-CB 3.26Å; E251-A255 WeakPolarHBondContact O-CB 3.41Å; E251-A255 PolarHBondContact O-N 3.35Å; V252-A255 PolarHBondContact O-N 2.95Å; V253-A255 VanDerWaalsContact C-N 3.3Å; V253-A255 PolarHBondContact O-N 3.38Å
256	M	87	Confident	87.6	Confident	71 Å²	71	71.4 Å²	71.4	35%	0.35	35%	0.347	S	S	.	.	H	α-helix	trans	-75.7	-41.4	174	-69.3	-166	-168.2	0	0	112.3	K202 I205 V252 V253	K202-M256 HydrophobicContact CB-CE 4.34Å; K202-M256 HydrophobicContact CG-CE 4.03Å; K202-M256 HydrophobicContact CG-SD 4.32Å; I205-M256 HydrophobicContact CG2-SD 4.19Å; V252-M256 HydrophobicContact CG1-CE 4.25Å; V252-M256 PolarHBondContact O-N 3.11Å; V252-M256 VanDerWaalsContact O-N 3.14Å; V253-M256 PolarHBondContact O-N 3.25Å
257	Y	87.4	Confident	87.5	Confident	98 Å²	98	70 Å²	70	38%	0.384	34%	0.34	S	S	.	.			trans	-131.4	86.7	-175.5	-64.1	-77.8	0	0	0	111.1	C209 V253 L254 K259 Y260	C209-Y257 HydrophobicContact CB-CD2 4.14Å; C209-Y257 HydrophobicContact CB-CE2 4.07Å; V253-Y257 PolarHBondContact O-N 3.38Å; L254-Y257 CarbonylContact O-C 3.58Å; L254-Y257 VanDerWaalsContact O-C 3.26Å; Y257-K259 PolarHBondContact O-N 3.03Å; Y257-Y260 VanDerWaalsContact O-CB 3.3Å; Y257-Y260 WeakPolarHBondContact O-CB 3.43Å; Y257-Y260 PolarHBondContact O-N 2.92Å
258	P	88.3	Confident	87.5	Confident	104 Å²	104	67.8 Å²	67.8	68%	0.675	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.3	-176.8	-25.6	34.3	0	0	0	114.9	L254	L254-P258 VanDerWaalsContact O-CA 3.25Å; L254-P258 WeakPolarHBondContact O-CA 3.19Å; L254-P258 VanDerWaalsContact O-N 3.13Å
259	K	88.1	Confident	87.5	Confident	170 Å²	170	67.9 Å²	67.9	74%	0.739	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-6.2	179.9	-66.6	-176.2	-179.6	176.4	0	113.6	Y257 D261 R262	Y257-K259 PolarHBondContact O-N 3.03Å; K259-D261 PolarHBondContact O-N 3.33Å; K259-R262 PolarHBondContact O-N 2.59Å
260	Y	87.7	Confident	87.5	Confident	11 Å²	11	68.9 Å²	68.9	4%	0.043	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-66.4	-24.3	-173.8	-160.7	-104.9	0	0	0	113.3	C209 R213 V253 Y257 R262 I263 A264 I267	C209-Y260 HydrophobicContact CB-CD2 4.5Å; C209-Y260 HydrophobicContact CB-CE2 4.23Å; R213-Y260 PolarHBondContact O-OH 2.86Å; V253-Y260 HydrophobicContact CG1-CD1 3.73Å; V253-Y260 HydrophobicContact CG1-CE1 4.21Å; V253-Y260 HydrophobicContact CG1-CG 4.07Å; Y257-Y260 VanDerWaalsContact O-CB 3.3Å; Y257-Y260 WeakPolarHBondContact O-CB 3.43Å; Y257-Y260 PolarHBondContact O-N 2.92Å; Y260-R262 PolarHBondContact O-N 3.15Å; Y260-I263 HydrophobicContact CD2-CD1 4.11Å; Y260-I263 HydrophobicContact CE2-CD1 4.19Å; Y260-I263 PolarHBondContact O-N 3.12Å; Y260-A264 HydrophobicContact CE1-CB 4.24Å; Y260-A264 PolarHBondContact O-N 3.2Å; Y260-I267 HydrophobicContact CD1-CD1 4.44Å; Y260-I267 HydrophobicContact CE1-CD1 4.24Å
261	D	85.9	Confident	87.6	Confident	72 Å²	72	65.6 Å²	65.6	39%	0.385	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-56.7	-19.4	176.9	-172.1	52	0	0	0	114.1	L254 K259 H265	L254-D261 HydrophobicContact CD2-CB 3.85Å; K259-D261 PolarHBondContact O-N 3.33Å; D261-H265 PolarHBondContact O-CE1 3.19Å; D261-H265 PolarHBondContact O-ND1 3.43Å; D261-H265 IonicContact OD1-CE1 3.78Å; D261-H265 IonicContact OD1-ND1 3.55Å; D261-H265 PolarHBondContact OD1-ND1 2.82Å; D261-H265 VanDerWaalsContact OD1-ND1 3.13Å
262	R	86.7	Confident	87.5	Confident	217 Å²	217	61.7 Å²	61.7	82%	0.819	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-80	-17.7	176.1	-62.8	-177.6	-175.9	-178.5	-1	114.2	K259 Y260	K259-R262 PolarHBondContact O-N 2.59Å; Y260-R262 PolarHBondContact O-N 3.15Å
263	I	84.1	Confident	87.2	Confident	98 Å²	98	64.6 Å²	64.6	50%	0.503	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-57.7	-172.1	-58.7	177	0	0	0	108.9	N212 Y260	N212-I263 HydrophobicContact CB-CG2 4.07Å; Y260-I263 HydrophobicContact CD2-CD1 4.11Å; Y260-I263 HydrophobicContact CE2-CD1 4.19Å; Y260-I263 PolarHBondContact O-N 3.12Å
264	A	74.5	Confident	87.1	Confident	15 Å²	15	65 Å²	65	12%	0.124	32%	0.321	C	S	.	.			trans	-134.8	129.1	178	0	0	0	0	0	109	E214 Y260	E214-A264 HydrophobicContact CB-CB 4.13Å; Y260-A264 HydrophobicContact CE1-CB 4.24Å; Y260-A264 PolarHBondContact O-N 3.2Å
265	H	77.1	Confident	87.1	Confident	117 Å²	117	67.4 Å²	67.4	54%	0.542	34%	0.339	S	S	.	.	S	Bend	trans	-85.8	-18.4	177.7	-69.5	-61	0	0	0	112.5	K250 D261	K250-H265 VanDerWaalsContact CE-O 3.22Å; K250-H265 WeakPolarHBondContact CE-O 3.3Å; K250-H265 PolarHBondContact NZ-O 3.46Å; D261-H265 PolarHBondContact O-CE1 3.19Å; D261-H265 PolarHBondContact O-ND1 3.43Å; D261-H265 IonicContact OD1-CE1 3.78Å; D261-H265 IonicContact OD1-ND1 3.55Å; D261-H265 PolarHBondContact OD1-ND1 2.82Å; D261-H265 VanDerWaalsContact OD1-ND1 3.13Å
266	E	83.1	Confident	87	Confident	120 Å²	120	69.5 Å²	69.5	56%	0.561	34%	0.34	S	S	*	.			trans	-123.7	147.3	-178.4	-62.7	-174.5	-179.9	0	0	109.4	H268	E266-H268 IonicContact OE2-CE1 3.39Å
267	I	89.9	Confident	87.1	Confident	6 Å²	6	69.1 Å²	69.1	3%	0.031	34%	0.342	C	S	.	.			trans	-131	129.3	175.3	-59	-172	0	0	0	106.3	M208 E214 L216 D246 A249 V253 Y260	M208-I267 HydrophobicContact CE-CD1 4.37Å; E214-I267 CarbonylContact O-C 3.43Å; E214-I267 VanDerWaalsContact O-CA 3.32Å; E214-I267 WeakPolarHBondContact O-CA 3.38Å; E214-I267 WeakPolarHBondContact O-CG2 3.43Å; L216-I267 HydrophobicContact CB-CG2 4.41Å; D246-I267 WeakPolarHBondContact CA-O 3.39Å; D246-I267 WeakPolarHBondContact CB-O 3.22Å; A249-I267 HydrophobicContact CB-CG2 4.27Å; V253-I267 HydrophobicContact CB-CD1 3.61Å; V253-I267 HydrophobicContact CG1-CD1 3.72Å; V253-I267 HydrophobicContact CG2-CD1 3.61Å; Y260-I267 HydrophobicContact CD1-CD1 4.44Å; Y260-I267 HydrophobicContact CE1-CD1 4.24Å
268	H	90.9	Very high	87.2	Confident	37 Å²	37	65.9 Å²	65.9	17%	0.171	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	129.8	-179.6	-63.4	-52.4	0	0	0	111.4	E214 S215 L216 D246 E266	E214-H268 PolarHBondContact O-N 2.94Å; S215-H268 WeakPolarHBondContact CA-O 3.48Å; L216-H268 PolarHBondContact N-O 2.93Å; D246-H268 WeakPolarHBondContact OD1-CA 3.33Å; D246-H268 IonicContact OD2-CE1 2.86Å; D246-H268 IonicContact OD2-ND1 3.2Å; D246-H268 PolarHBondContact OD2-ND1 3.39Å; E266-H268 IonicContact OE2-CE1 3.39Å
269	V	92.4	Very high	87.3	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.012	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	120.9	176	-179	0	0	0	0	110.5	F185 L216 V218 F245 D246 A249 N428	F185-V269 HydrophobicContact CZ-CG1 4.34Å; L216-V269 CarbonylContact O-C 3.53Å; L216-V269 WeakPolarHBondContact O-CA 3.34Å; V218-V269 HydrophobicContact CB-CG1 4.15Å; V218-V269 HydrophobicContact CG2-CG1 3.57Å; F245-V269 HydrophobicContact CB-CB 4.11Å; F245-V269 HydrophobicContact CB-CG1 4.43Å; F245-V269 HydrophobicContact CB-CG2 3.97Å; D246-V269 PolarHBondContact OD1-N 2.98Å; A249-V269 HydrophobicContact CB-CG2 3.82Å; V269-N428 PolarHBondContact O-OD1 3.36Å
270	R	92.6	Very high	87.4	Confident	20 Å²	20	57.7 Å²	57.7	8%	0.075	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	130.5	-179.7	-56.2	-68.7	174.2	-144.4	-1.4	109.1	L216 V217 V218 D387 N428 H429	L216-R270 PolarHBondContact O-N 3.25Å; V217-R270 HydrophobicContact CG2-CB 4.2Å; V218-R270 PolarHBondContact N-O 3.03Å; R270-D387 IonicContact CZ-OD1 2.58Å; R270-D387 IonicContact CZ-OD2 3.79Å; R270-D387 IonicContact NE-OD1 3.85Å; R270-D387 IonicContact NE-OD2 3.36Å; R270-D387 PolarHBondContact NE-OD2 3.44Å; R270-D387 IonicContact NH2-OD1 3.45Å; R270-D387 PolarHBondContact NH2-OD1 3.41Å; R270-D387 IonicContact NH2-OD2 3.91Å; R270-D387 PolarHBondContact NH2-OD2 2.81Å; R270-N428 WeakPolarHBondContact CD-O 3.44Å; R270-N428 PolarHBondContact NE-O 2.88Å; R270-N428 PolarHBondContact NH1-O 3.4Å; R270-N428 PolarHBondContact NH1-OD1 3.25Å; R270-H429 HydrophobicContact CB-CB 4.28Å
271	I	91.6	Very high	87.5	Confident	4 Å²	4	59.8 Å²	59.8	2%	0.021	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	124.1	-179.9	-57.1	160.5	0	0	0	109.6	V218 Y220 L234 L242 L274 L291 H429	V218-I271 WeakPolarHBondContact O-CA 3.45Å; Y220-I271 HydrophobicContact CD2-CG2 4.33Å; L234-I271 HydrophobicContact CD1-CD1 3.95Å; L234-I271 HydrophobicContact CD2-CD1 3.57Å; L234-I271 HydrophobicContact CD2-CG1 4.28Å; L234-I271 HydrophobicContact CG-CD1 3.91Å; L242-I271 HydrophobicContact CD2-CD1 3.74Å; L242-I271 HydrophobicContact CD2-CG1 4.24Å; I271-L274 HydrophobicContact CG2-CD1 3.52Å; I271-L291 HydrophobicContact CD1-CD2 3.62Å; I271-H429 WeakPolarHBondContact O-CB 3.43Å; I271-H429 PolarHBondContact O-CD2 3.48Å
272	C	88.6	Confident	87.7	Confident	17 Å²	17	58.7 Å²	58.7	12%	0.115	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	156.1	171.8	-69.5	0	0	0	0	112	V217 V218 Y220 L274 H429	V217-C272 HydrophobicContact CG1-CB 4.27Å; V217-C272 WeakPolarHBondContact CG1-SG 3.47Å; V218-C272 PolarHBondContact O-N 3.21Å; Y220-C272 VanDerWaalsContact CB-O 3.28Å; Y220-C272 WeakPolarHBondContact CB-O 3.36Å; Y220-C272 PolarHBondContact N-O 3.23Å; C272-L274 PolarHBondContact O-N 3.47Å; C272-H429 VanDerWaalsContact SG-CD2 3.52Å; C272-H429 PolarHBondContact SG-NE2 3.14Å
273	N	84.9	Confident	87.9	Confident	64 Å²	64	48.7 Å²	48.7	34%	0.342	26%	0.257	S	S	.	.			trans	53.5	55.2	166.7	-62.5	-22.9	0	0	0	115.6
274	L	89.1	Confident	88.3	Confident	9 Å²	9	51.3 Å²	51.3	5%	0.047	26%	0.261	C	S	.	.			trans	-62.8	130.3	163.7	-113.4	72	0	0	0	109.8	Y220 I271 C272 L276 L291 R293 T401	Y220-L274 HydrophobicContact CD2-CD1 3.75Å; Y220-L274 HydrophobicContact CE2-CD1 4.33Å; Y220-L274 HydrophobicContact CG-CD1 4Å; I271-L274 HydrophobicContact CG2-CD1 3.52Å; C272-L274 PolarHBondContact O-N 3.47Å; L274-L276 PolarHBondContact O-N 2.99Å; L274-L291 HydrophobicContact CD1-CD2 3.89Å; L274-L291 HydrophobicContact CD2-CB 4.5Å; L274-L291 HydrophobicContact CD2-CD2 3.92Å; L274-L291 HydrophobicContact CD2-CG 4.08Å; L274-R293 HydrophobicContact CB-CB 3.98Å; L274-R293 VanDerWaalsContact O-CD 3.25Å; L274-R293 WeakPolarHBondContact O-CD 3.42Å; L274-R293 PolarHBondContact O-NH1 2.91Å; L274-T401 HydrophobicContact CD1-CG2 4.48Å
275	P	88.8	Confident	89.1	Confident	97 Å²	97	58.6 Å²	58.6	63%	0.63	29%	0.292	S	S	*	.	S	Bend	trans	-67.1	-26.1	-174.8	25.3	-34.7	0	0	0	112.8	Y220 V277	Y220-P275 HydrophobicContact CD1-CG 4.29Å; Y220-P275 HydrophobicContact CE1-CG 4Å; P275-V277 PolarHBondContact O-N 3.43Å
276	L	89.1	Confident	89.8	Confident	110 Å²	110	58.9 Å²	58.9	58%	0.576	30%	0.297	S	S	*	.			trans	-86.5	109.7	177.8	-170.4	70.6	0	0	0	110	L274 E278 R293	L274-L276 PolarHBondContact O-N 2.99Å; L276-E278 HydrophobicContact CD2-CG 4.15Å; L276-E278 WeakPolarHBondContact CD2-OE1 3.34Å; L276-E278 HydrophobicContact CG-CG 4.09Å; L276-R293 WeakPolarHBondContact O-CB 3.28Å
277	V	88.7	Confident	90.2	Very high	63 Å²	63	54.2 Å²	54.2	38%	0.382	28%	0.275	S	S	.	.			trans	-100.8	114.3	170.6	-179.6	0	0	0	0	108.7	P275	P275-V277 PolarHBondContact O-N 3.43Å
278	E	90	Very high	90.3	Very high	30 Å²	30	57 Å²	57	14%	0.14	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-99	151.5	178	-67.9	-169.6	175.4	0	0	112.4	L276 L283 H287 R293 T294	L276-E278 HydrophobicContact CD2-CG 4.15Å; L276-E278 WeakPolarHBondContact CD2-OE1 3.34Å; L276-E278 HydrophobicContact CG-CG 4.09Å; E278-L283 WeakPolarHBondContact OE2-CD2 3.33Å; E278-H287 IonicContact OE1-CD2 3.92Å; E278-H287 PolarHBondContact OE1-CD2 2.9Å; E278-H287 VanDerWaalsContact OE1-CD2 3.24Å; E278-H287 IonicContact OE1-NE2 3.32Å; E278-H287 PolarHBondContact OE1-NE2 3.3Å; E278-H287 IonicContact OE2-CD2 3.54Å; E278-H287 PolarHBondContact OE2-CD2 3.47Å; E278-H287 VanDerWaalsContact OE2-CD2 3.32Å; E278-H287 IonicContact OE2-CG 2.83Å; E278-H287 IonicContact OE2-NE2 3.64Å; E278-R293 PolarHBondContact N-O 2.64Å; E278-T294 HydrophobicContact CB-CG2 4.22Å; E278-T294 WeakPolarHBondContact O-CA 3.29Å
279	E	89.1	Confident	90.3	Very high	98 Å²	98	56.9 Å²	56.9	46%	0.458	29%	0.29	S	S	.	.			trans	-86.6	144.2	170.7	-61.3	-173.3	165.2	0	0	110.4	R281 A282	E279-R281 PolarHBondContact O-N 3.07Å; E279-R281 VanDerWaalsContact O-N 3.14Å; E279-A282 HydrophobicContact CB-CB 4.4Å; E279-A282 WeakPolarHBondContact O-CB 3.5Å; E279-A282 PolarHBondContact O-N 3.37Å
280	I	89.8	Confident	90.3	Very high	4 Å²	4	59.8 Å²	59.8	2%	0.021	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-56.9	-36.1	-177.2	-63.7	171.3	0	0	0	111.5	L283 I364 E366 K380	I280-L283 WeakPolarHBondContact O-CB 3.48Å; I280-L283 PolarHBondContact O-N 2.94Å; I280-I364 HydrophobicContact CD1-CD1 4.32Å; I280-I364 HydrophobicContact CD1-CG1 4.06Å; I280-I364 HydrophobicContact CD1-CG2 4.13Å; I280-E366 HydrophobicContact CB-CG 3.85Å; I280-E366 HydrophobicContact CD1-CG 4.23Å; I280-E366 HydrophobicContact CG1-CG 4.45Å; I280-E366 HydrophobicContact CG2-CG 4.49Å; I280-K380 HydrophobicContact CG2-CB 4.22Å; I280-K380 HydrophobicContact CG2-CG 3.58Å
281	R	89.6	Confident	90.3	Very high	55 Å²	55	59.3 Å²	59.3	21%	0.208	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-71.1	-24	175.5	174.1	-176.2	-49.6	-166.2	-4.4	115	E279 L283 R284 E366 L376	E279-R281 PolarHBondContact O-N 3.07Å; E279-R281 VanDerWaalsContact O-N 3.14Å; R281-L283 PolarHBondContact O-N 3.29Å; R281-R284 PolarHBondContact O-NH1 3.41Å; R281-E366 WeakPolarHBondContact CB-OE1 3.28Å; R281-E366 IonicContact CZ-OE2 3.46Å; R281-E366 PolarHBondContact N-OE1 3.42Å; R281-E366 IonicContact NE-OE1 3.48Å; R281-E366 IonicContact NE-OE2 3.96Å; R281-E366 PolarHBondContact NE-OE2 2.98Å; R281-E366 IonicContact NH2-OE2 2.68Å; R281-E366 PolarHBondContact NH2-OE2 3.24Å; R281-L376 PolarHBondContact NH2-O 2.98Å; R281-L376 VanDerWaalsContact NH2-O 3.08Å
282	A	90.6	Very high	90.4	Very high	49 Å²	49	59.4 Å²	59.4	41%	0.405	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-74.7	-16.2	178.7	0	0	0	0	0	112.2	E279 R284	E279-A282 HydrophobicContact CB-CB 4.4Å; E279-A282 WeakPolarHBondContact O-CB 3.5Å; E279-A282 PolarHBondContact O-N 3.37Å; A282-R284 WeakPolarHBondContact O-CG 3.32Å; A282-R284 PolarHBondContact O-N 3.35Å; A282-R284 VanDerWaalsContact O-N 3.12Å
283	L	91.4	Very high	90.7	Very high	7 Å²	7	60.2 Å²	60.2	4%	0.037	30%	0.304	C	S	.	.			trans	-59.5	117.6	177.4	-63.7	174.7	0	0	0	111.5	E278 I280 R281 H287 I292 T294 Y404 I425	E278-L283 WeakPolarHBondContact OE2-CD2 3.33Å; I280-L283 WeakPolarHBondContact O-CB 3.48Å; I280-L283 PolarHBondContact O-N 2.94Å; R281-L283 PolarHBondContact O-N 3.29Å; L283-H287 HydrophobicContact CD2-CB 4.46Å; L283-I292 HydrophobicContact CD1-CD1 4.09Å; L283-I292 HydrophobicContact CD2-CD1 3.7Å; L283-I292 HydrophobicContact CD2-CG2 4.27Å; L283-T294 HydrophobicContact CD1-CG2 4.35Å; L283-T294 HydrophobicContact CD2-CG2 4.44Å; L283-Y404 HydrophobicContact CB-CE2 4.4Å; L283-Y404 HydrophobicContact CD1-CD2 4.23Å; L283-Y404 HydrophobicContact CD1-CE2 4.06Å; L283-I425 HydrophobicContact CD1-CD1 4.34Å
284	R	92.6	Very high	91	Very high	153 Å²	153	57.1 Å²	57.1	58%	0.577	29%	0.288	S	S	*	.			trans	-130.2	177.5	177.7	-66.7	-67	-179.7	-86.1	-6.3	110.7	R281 A282 L286 H287	R281-R284 PolarHBondContact O-NH1 3.41Å; A282-R284 WeakPolarHBondContact O-CG 3.32Å; A282-R284 PolarHBondContact O-N 3.35Å; A282-R284 VanDerWaalsContact O-N 3.12Å; R284-L286 PolarHBondContact O-N 2.94Å; R284-H287 PolarHBondContact N-ND1 3.01Å; R284-H287 VanDerWaalsContact N-ND1 3.15Å; R284-H287 PolarHBondContact O-N 3.5Å; R284-H287 VanDerWaalsContact O-N 3.17Å; R284-H287 PolarHBondContact O-ND1 3.48Å
285	Q	90.6	Very high	91.1	Very high	168 Å²	168	57.7 Å²	57.7	79%	0.785	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-54.9	-24	178.9	69.6	177	26	0	0	114.8	H287 L288	Q285-H287 PolarHBondContact O-N 3.29Å; Q285-L288 HydrophobicContact CB-CD1 4.27Å; Q285-L288 WeakPolarHBondContact O-CB 3.49Å; Q285-L288 WeakPolarHBondContact O-CD1 3.34Å; Q285-L288 VanDerWaalsContact O-CG 3.23Å; Q285-L288 WeakPolarHBondContact O-CG 3.13Å; Q285-L288 PolarHBondContact O-N 2.94Å
286	L	92	Very high	91.2	Very high	124 Å²	124	53.1 Å²	53.1	65%	0.649	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-61.1	-33.7	179.9	-175.5	145.1	0	0	0	112.1	R284 L288 Q290	R284-L286 PolarHBondContact O-N 2.94Å; L286-L288 PolarHBondContact O-N 3.46Å; L286-Q290 PolarHBondContact O-OE1 2.59Å
287	H	91.3	Very high	91.3	Very high	22 Å²	22	49.2 Å²	49.2	10%	0.102	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-84.6	7.2	-175.3	-42	87.6	0	0	0	112.9	E278 L283 R284 Q285 N289 Q290 I292 Y404	E278-H287 IonicContact OE1-CD2 3.92Å; E278-H287 PolarHBondContact OE1-CD2 2.9Å; E278-H287 VanDerWaalsContact OE1-CD2 3.24Å; E278-H287 IonicContact OE1-NE2 3.32Å; E278-H287 PolarHBondContact OE1-NE2 3.3Å; E278-H287 IonicContact OE2-CD2 3.54Å; E278-H287 PolarHBondContact OE2-CD2 3.47Å; E278-H287 VanDerWaalsContact OE2-CD2 3.32Å; E278-H287 IonicContact OE2-CG 2.83Å; E278-H287 IonicContact OE2-NE2 3.64Å; L283-H287 HydrophobicContact CD2-CB 4.46Å; R284-H287 PolarHBondContact N-ND1 3.01Å; R284-H287 VanDerWaalsContact N-ND1 3.15Å; R284-H287 PolarHBondContact O-N 3.5Å; R284-H287 VanDerWaalsContact O-N 3.17Å; R284-H287 PolarHBondContact O-ND1 3.48Å; Q285-H287 PolarHBondContact O-N 3.29Å; H287-N289 PolarHBondContact O-N 3.32Å; H287-Q290 PolarHBondContact O-N 3.14Å; H287-I292 HydrophobicContact CB-CG2 4.08Å; H287-Y404 HydrophobicContact CB-CD1 4.32Å; H287-Y404 WeakPolarHBondContact O-CB 3.15Å
288	L	92.6	Very high	91.4	Very high	63 Å²	63	46.2 Å²	46.2	33%	0.33	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	125.7	-177.7	-77	171.5	0	0	0	111.5	Q285 L286 Q290 Y404 N406	Q285-L288 HydrophobicContact CB-CD1 4.27Å; Q285-L288 WeakPolarHBondContact O-CB 3.49Å; Q285-L288 WeakPolarHBondContact O-CD1 3.34Å; Q285-L288 VanDerWaalsContact O-CG 3.23Å; Q285-L288 WeakPolarHBondContact O-CG 3.13Å; Q285-L288 PolarHBondContact O-N 2.94Å; L286-L288 PolarHBondContact O-N 3.46Å; L288-Q290 PolarHBondContact O-N 3.24Å; L288-Y404 HydrophobicContact CD2-CD1 3.99Å; L288-Y404 HydrophobicContact CD2-CE1 3.92Å; L288-N406 HydrophobicContact CD2-CB 3.88Å
289	N	91.6	Very high	91.3	Very high	35 Å²	35	46.8 Å²	46.8	19%	0.187	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	21.3	-177.8	-52.1	-58.5	0	0	0	114.8	R169 H287 Y404 H405	R169-N289 VanDerWaalsContact NH2-CB 3.31Å; H287-N289 PolarHBondContact O-N 3.32Å; N289-Y404 WeakPolarHBondContact CA-O 3.5Å; N289-Y404 PolarHBondContact N-O 3.23Å; N289-H405 PolarHBondContact OD1-ND1 3.27Å
290	Q	91.5	Very high	91.1	Very high	63 Å²	63	42.6 Å²	42.6	29%	0.294	21%	0.214	S	C	.	.	S	Bend	trans	-100.2	159.7	172.8	-66.7	-178.1	-18.3	0	0	110.9	P235 L286 H287 L288 I403 Y404	P235-Q290 WeakPolarHBondContact O-CA 3.39Å; P235-Q290 WeakPolarHBondContact O-CB 3.42Å; L286-Q290 PolarHBondContact O-OE1 2.59Å; H287-Q290 PolarHBondContact O-N 3.14Å; L288-Q290 PolarHBondContact O-N 3.24Å; Q290-I403 WeakPolarHBondContact O-CA 3.47Å; Q290-Y404 PolarHBondContact O-N 2.86Å; Q290-Y404 VanDerWaalsContact O-N 3.15Å
291	L	93.3	Very high	91	Very high	11 Å²	11	43.8 Å²	43.8	6%	0.058	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	121.8	174.3	-165.4	70	0	0	0	109.6	L234 P235 P238 I271 L274 T401 I403	L234-L291 HydrophobicContact CG-CD2 4.48Å; P235-L291 PolarHBondContact O-N 3.22Å; P235-L291 VanDerWaalsContact O-N 3.14Å; P238-L291 HydrophobicContact CB-CB 4.08Å; P238-L291 HydrophobicContact CB-CD1 4.27Å; P238-L291 HydrophobicContact CG-CB 4.2Å; I271-L291 HydrophobicContact CD1-CD2 3.62Å; L274-L291 HydrophobicContact CD1-CD2 3.89Å; L274-L291 HydrophobicContact CD2-CB 4.5Å; L274-L291 HydrophobicContact CD2-CD2 3.92Å; L274-L291 HydrophobicContact CD2-CG 4.08Å; L291-T401 HydrophobicContact CD1-CG2 4.2Å; L291-T401 HydrophobicContact CD2-CG2 4.36Å; L291-T401 HydrophobicContact CG-CG2 4.18Å; L291-I403 HydrophobicContact CD1-CG1 4.08Å
292	I	94.1	Very high	91.1	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.026	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	149.4	-179.7	56.2	163	0	0	0	110.5	L283 H287 T294 T401 G402 Y404 I425	L283-I292 HydrophobicContact CD1-CD1 4.09Å; L283-I292 HydrophobicContact CD2-CD1 3.7Å; L283-I292 HydrophobicContact CD2-CG2 4.27Å; H287-I292 HydrophobicContact CB-CG2 4.08Å; I292-T294 HydrophobicContact CD1-CG2 4.11Å; I292-T401 CarbonylContact O-C 3.59Å; I292-T401 VanDerWaalsContact O-CA 3.3Å; I292-T401 WeakPolarHBondContact O-CA 3.41Å; I292-G402 WeakPolarHBondContact CG1-O 3.44Å; I292-G402 PolarHBondContact N-O 3.15Å; I292-G402 PolarHBondContact O-N 3.5Å; I292-Y404 HydrophobicContact CD1-CD2 4.13Å; I292-Y404 HydrophobicContact CD1-CG 4.35Å; I292-I425 HydrophobicContact CD1-CD1 4.07Å; I292-I425 HydrophobicContact CD1-CG1 4.29Å; I292-I425 HydrophobicContact CD1-CG2 4.19Å; I292-I425 HydrophobicContact CG1-CG2 4.49Å
293	R	93.7	Very high	90.9	Very high	34 Å²	34	41.8 Å²	41.8	13%	0.128	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	121.2	166.7	177	-175.1	-178.8	-177.7	7.5	108.2	L274 L276 E278 E399 L400	L274-R293 HydrophobicContact CB-CB 3.98Å; L274-R293 VanDerWaalsContact O-CD 3.25Å; L274-R293 WeakPolarHBondContact O-CD 3.42Å; L274-R293 PolarHBondContact O-NH1 2.91Å; L276-R293 WeakPolarHBondContact O-CB 3.28Å; E278-R293 PolarHBondContact N-O 2.64Å; R293-E399 IonicContact CZ-OE2 3.54Å; R293-E399 IonicContact NE-OE2 2.94Å; R293-E399 PolarHBondContact NE-OE2 2.76Å; R293-E399 IonicContact NH2-OE2 3.52Å; R293-E399 PolarHBondContact NH2-OE2 3.46Å; R293-L400 WeakPolarHBondContact CA-O 3.43Å
294	T	91.8	Very high	91	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	155.9	-179.8	56.7	0	0	0	0	110.4	E278 L283 I292 E399 L400	E278-T294 HydrophobicContact CB-CG2 4.22Å; E278-T294 WeakPolarHBondContact O-CA 3.29Å; L283-T294 HydrophobicContact CD1-CG2 4.35Å; L283-T294 HydrophobicContact CD2-CG2 4.44Å; I292-T294 HydrophobicContact CD1-CG2 4.11Å; T294-E399 CarbonylContact O-C 3.41Å; T294-E399 WeakPolarHBondContact O-CA 3.47Å; T294-L400 PolarHBondContact N-O 3.31Å; T294-L400 PolarHBondContact O-N 3.3Å
295	S	91.3	Very high	91	Very high	21 Å²	21	42.2 Å²	42.2	15%	0.147	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	140.8	177.7	175.8	0	0	0	0	110.4	I398	S295-I398 WeakPolarHBondContact CA-O 3.47Å
296	G	90.8	Very high	91	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.3	174.1	179.8	0	0	0	0	0	113.1	Q365 I398	G296-Q365 CarbonylContact C-O 3.51Å; G296-Q365 WeakPolarHBondContact CA-O 3.22Å; G296-I398 PolarHBondContact N-O 3.45Å; G296-I398 PolarHBondContact O-N 3.03Å; G296-I398 VanDerWaalsContact O-O 3.07Å
297	V	91.4	Very high	90.9	Very high	27 Å²	27	34.7 Å²	34.7	16%	0.164	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	134.3	178.1	-173.6	0	0	0	0	108.7	S299 Q365 D396 E397	V297-S299 PolarHBondContact O-N 3.4Å; V297-Q365 PolarHBondContact N-O 3.33Å; V297-Q365 PolarHBondContact O-N 2.82Å; V297-D396 WeakPolarHBondContact CA-O 3.3Å; V297-E397 HydrophobicContact CG2-CG 4.23Å
298	V	90.7	Very high	90.8	Very high	1 Å²	1	36 Å²	36	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	119.3	173.5	-176.9	0	0	0	0	108.9	I362 C392 P394 G395 D396 I398	V298-I362 HydrophobicContact CG1-CB 4.33Å; V298-C392 HydrophobicContact CG2-CB 4.08Å; V298-P394 CarbonylContact O-C 3.58Å; V298-P394 WeakPolarHBondContact O-CA 3.37Å; V298-G395 PolarHBondContact O-N 3.45Å; V298-D396 PolarHBondContact N-O 3.37Å; V298-I398 HydrophobicContact CG2-CD1 3.41Å; V298-I398 VanDerWaalsContact CG2-CD1 3.41Å; V298-I398 HydrophobicContact CG2-CG1 3.73Å; V298-I398 HydrophobicContact CG2-CG2 4.02Å
299	S	86.7	Confident	90.5	Very high	42 Å²	42	34.5 Å²	34.5	29%	0.294	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	-36.5	179.3	58.1	0	0	0	0	112.4	V297 T363	V297-S299 PolarHBondContact O-N 3.4Å; S299-T363 PolarHBondContact N-O 3.08Å; S299-T363 WeakPolarHBondContact OG-CB 3.27Å; S299-T363 PolarHBondContact OG-O 2.92Å; S299-T363 PolarHBondContact OG-OG1 3.5Å
300	S	85.8	Confident	90.3	Very high	10 Å²	10	34.9 Å²	34.9	7%	0.07	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	152	179.1	-47	0	0	0	0	110.7	I362 T363 P550	S300-I362 CarbonylContact O-C 3.5Å; S300-I362 VanDerWaalsContact O-CA 3.31Å; S300-I362 WeakPolarHBondContact O-CA 3.27Å; S300-T363 VanDerWaalsContact CB-OG1 3.24Å; S300-T363 WeakPolarHBondContact CB-OG1 3.49Å; S300-T363 PolarHBondContact N-OG1 2.82Å; S300-T363 VanDerWaalsContact N-OG1 3.08Å; S300-T363 PolarHBondContact O-N 3.4Å; S300-T363 PolarHBondContact O-OG1 2.94Å; S300-P550 WeakPolarHBondContact OG-CG 3.47Å
301	C	88.3	Confident	90.2	Very high	29 Å²	29	31.9 Å²	31.9	20%	0.196	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	133.4	175	62.7	0	0	0	0	109.5	I362 P394 H549	C301-I362 HydrophobicContact CB-CG2 3.87Å; C301-P394 WeakPolarHBondContact SG-CD 3.36Å; C301-P394 WeakPolarHBondContact SG-CG 3.29Å; C301-H549 PolarHBondContact O-NE2 2.88Å
302	T	90.5	Very high	90	Very high	14 Å²	14	33.5 Å²	33.5	9%	0.086	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-72	162.7	169.6	66.2	0	0	0	0	110.5	Q360 R361 V551	T302-Q360 WeakPolarHBondContact O-CG 3.36Å; T302-Q360 PolarHBondContact O-NE2 3.36Å; T302-R361 HydrophobicContact CG2-CB 4.14Å; T302-R361 PolarHBondContact N-O 2.95Å; T302-R361 PolarHBondContact OG1-N 3.11Å; T302-R361 PolarHBondContact OG1-O 3.23Å; T302-V551 HydrophobicContact CG2-CB 4.22Å; T302-V551 HydrophobicContact CG2-CG1 3.73Å
303	G	87.9	Confident	89.8	Confident	48 Å²	48	34.5 Å²	34.5	50%	0.495	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-59.2	164.2	162.4	0	0	0	0	0	111.8	L305	G303-L305 PolarHBondContact O-N 3.35Å
304	V	92.9	Very high	89.5	Confident	69 Å²	69	35.3 Å²	35.3	42%	0.418	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-74.6	119.3	174.6	-175.8	0	0	0	0	108.7	N358 V389	V304-N358 HydrophobicContact CG1-CB 4.02Å; V304-V389 HydrophobicContact CG1-CB 4.33Å; V304-V389 HydrophobicContact CG1-CG2 4.08Å; V304-V389 HydrophobicContact CG2-CB 4.17Å; V304-V389 HydrophobicContact CG2-CG2 4.24Å
305	L	91.4	Very high	89.3	Confident	99 Å²	99	35.4 Å²	35.4	52%	0.518	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	140.4	179	-61.7	175.5	0	0	0	109.2	G303 Y359	G303-L305 PolarHBondContact O-N 3.35Å; L305-Y359 PolarHBondContact N-O 2.97Å; L305-Y359 WeakPolarHBondContact O-CA 3.14Å; L305-Y359 WeakPolarHBondContact O-CB 3.4Å; L305-Y359 PolarHBondContact O-N 3.1Å; L305-Y359 VanDerWaalsContact O-O 3.12Å
306	P	91.4	Very high	89	Confident	91 Å²	91	37.9 Å²	37.9	59%	0.591	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	127.4	171.5	30	-32.2	0	0	0	110.2	Y356	P306-Y356 HydrophobicContact CB-CD1 4.38Å
307	Q	89.1	Confident	88.7	Confident	43 Å²	43	45.3 Å²	45.3	20%	0.201	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	150.7	170.1	-172.9	178.4	26.7	0	0	109.9	Y356 Q357 Y359	Q307-Y356 CarbonylContact O-C 3.51Å; Q307-Y356 VanDerWaalsContact O-CA 3.32Å; Q307-Y356 WeakPolarHBondContact O-CA 3.19Å; Q307-Q357 HydrophobicContact CB-CG 4.16Å; Q307-Q357 PolarHBondContact N-O 3.24Å; Q307-Q357 PolarHBondContact O-N 3.15Å; Q307-Y359 HydrophobicContact CB-CG 4.35Å
308	L	89.4	Confident	88.4	Confident	51 Å²	51	45.9 Å²	45.9	27%	0.267	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	128.1	173.8	-65.4	157.6	0	0	0	110.1	V311 Q327 Y356	L308-V311 HydrophobicContact CB-CG2 3.63Å; L308-V311 HydrophobicContact CD1-CG2 4.04Å; L308-V311 HydrophobicContact CD2-CG2 4.06Å; L308-V311 HydrophobicContact CG-CG2 4.11Å; L308-Q327 WeakPolarHBondContact O-CB 3.31Å; L308-Y356 HydrophobicContact CD2-CD1 3.93Å; L308-Y356 HydrophobicContact CD2-CE1 3.44Å; L308-Y356 VanDerWaalsContact CD2-CE1 3.44Å; L308-Y356 HydrophobicContact CG-CE1 4.28Å
309	S	86.6	Confident	88	Confident	31 Å²	31	50.8 Å²	50.8	22%	0.217	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	-56.4	171.7	176.8	0	0	0	0	110.5	Q327 V355	S309-Q327 PolarHBondContact O-N 3.42Å; S309-V355 PolarHBondContact N-O 2.72Å
310	M	88.3	Confident	87.9	Confident	42 Å²	42	52.7 Å²	52.7	21%	0.207	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	116.3	174.6	-174.8	178.6	65	0	0	109.3	P324 F326 T354 V355	M310-P324 HydrophobicContact CG-CB 3.69Å; M310-P324 HydrophobicContact SD-CB 3.43Å; M310-P324 WeakPolarHBondContact SD-CB 3.34Å; M310-P324 HydrophobicContact SD-CG 4.42Å; M310-F326 HydrophobicContact CB-CD1 4.39Å; M310-F326 HydrophobicContact CB-CE1 4.33Å; M310-F326 HydrophobicContact CG-CD1 4.48Å; M310-F326 HydrophobicContact CG-CE1 4.23Å; M310-F326 HydrophobicContact SD-CE1 4.24Å; M310-F326 HydrophobicContact SD-CZ 4.33Å; M310-T354 CarbonylContact O-C 3.59Å; M310-T354 WeakPolarHBondContact O-CA 3.4Å; M310-V355 HydrophobicContact CB-CB 4.15Å; M310-V355 HydrophobicContact CE-CB 4.46Å; M310-V355 HydrophobicContact CE-CG2 3.67Å; M310-V355 PolarHBondContact N-O 3Å; M310-V355 PolarHBondContact O-N 3.42Å
311	V	89	Confident	88	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	131.5	-178.9	-169.2	0	0	0	0	110.4	L308 Y313 F325 Q327 V349 T354	L308-V311 HydrophobicContact CB-CG2 3.63Å; L308-V311 HydrophobicContact CD1-CG2 4.04Å; L308-V311 HydrophobicContact CD2-CG2 4.06Å; L308-V311 HydrophobicContact CG-CG2 4.11Å; V311-Y313 HydrophobicContact CB-CE2 4.09Å; V311-Y313 HydrophobicContact CG1-CD1 4.5Å; V311-Y313 HydrophobicContact CG1-CD2 3.98Å; V311-Y313 HydrophobicContact CG1-CE1 4.04Å; V311-Y313 HydrophobicContact CG1-CE2 3.44Å; V311-Y313 VanDerWaalsContact CG1-CE2 3.44Å; V311-Y313 HydrophobicContact CG1-CG 4.47Å; V311-Y313 VanDerWaalsContact CG1-CZ 3.47Å; V311-F325 PolarHBondContact N-O 3.34Å; V311-F325 PolarHBondContact O-N 2.88Å; V311-Q327 HydrophobicContact CG2-CB 4.4Å; V311-V349 HydrophobicContact CG1-CG1 4.1Å; V311-V349 HydrophobicContact CG1-CG2 4.28Å; V311-T354 HydrophobicContact CG1-CG2 4.21Å
312	K	89.8	Confident	87.8	Confident	45 Å²	45	53.3 Å²	53.3	20%	0.196	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.7	165.2	-58.5	-160.7	-164.5	174.9	0	109.1	V321 G323 N350 E353 T354	K312-V321 HydrophobicContact CB-CG1 3.91Å; K312-V321 HydrophobicContact CD-CG1 3.95Å; K312-G323 WeakPolarHBondContact CD-O 3.39Å; K312-G323 WeakPolarHBondContact CG-O 3.41Å; K312-N350 PolarHBondContact O-N 3.43Å; K312-E353 HydrophobicContact CD-CB 3.75Å; K312-E353 WeakPolarHBondContact CD-OE2 3.36Å; K312-E353 WeakPolarHBondContact CE-OE2 3.33Å; K312-E353 HydrophobicContact CG-CB 4.43Å; K312-E353 IonicContact NZ-OE2 3.95Å; K312-E353 PolarHBondContact NZ-OE2 3.35Å; K312-T354 HydrophobicContact CB-CG2 4.48Å; K312-T354 VanDerWaalsContact N-CG2 3.35Å
313	Y	88.3	Confident	86.7	Confident	27 Å²	27	54.2 Å²	54.2	11%	0.106	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	145.5	-178.4	-67.7	-87.1	0	0	0	110.9	V311 V321 L322 F325 V333 P335 F347 E348 V349	V311-Y313 HydrophobicContact CB-CE2 4.09Å; V311-Y313 HydrophobicContact CG1-CD1 4.5Å; V311-Y313 HydrophobicContact CG1-CD2 3.98Å; V311-Y313 HydrophobicContact CG1-CE1 4.04Å; V311-Y313 HydrophobicContact CG1-CE2 3.44Å; V311-Y313 VanDerWaalsContact CG1-CE2 3.44Å; V311-Y313 HydrophobicContact CG1-CG 4.47Å; V311-Y313 VanDerWaalsContact CG1-CZ 3.47Å; Y313-V321 CarbonylContact O-C 3.47Å; Y313-V321 WeakPolarHBondContact O-CA 3.48Å; Y313-L322 PolarHBondContact N-O 3.06Å; Y313-L322 PolarHBondContact O-N 3.45Å; Y313-F325 AromaticContact CD2-CD2 3.72Å; Y313-F325 HydrophobicContact CD2-CD2 3.72Å; Y313-F325 HydrophobicContact CD2-CE2 4.01Å; Y313-F325 AromaticContact CE2-CD2 3.95Å; Y313-F325 HydrophobicContact CE2-CD2 3.95Å; Y313-V333 PolarHBondContact OH-O 3.19Å; Y313-V333 VanDerWaalsContact OH-O 3.09Å; Y313-P335 HydrophobicContact CD1-CG 4.24Å; Y313-P335 HydrophobicContact CD2-CB 3.98Å; Y313-P335 HydrophobicContact CD2-CG 3.74Å; Y313-P335 HydrophobicContact CE1-CG 4.37Å; Y313-P335 HydrophobicContact CE2-CB 4.3Å; Y313-P335 HydrophobicContact CE2-CG 3.89Å; Y313-P335 HydrophobicContact CG-CB 4.48Å; Y313-P335 HydrophobicContact CG-CG 3.93Å; Y313-F347 HydrophobicContact CD1-CB 3.93Å; Y313-F347 HydrophobicContact CG-CB 4.15Å; Y313-E348 CarbonylContact C-O 3.59Å; Y313-E348 VanDerWaalsContact CA-O 3.29Å; Y313-E348 WeakPolarHBondContact CA-O 3.47Å; Y313-V349 HydrophobicContact CD1-CG2 3.95Å; Y313-V349 HydrophobicContact CE1-CG2 3.57Å
314	N	88.8	Confident	86.4	Confident	51 Å²	51	55.5 Å²	55.5	27%	0.273	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	129.4	171.4	-70.4	-12.7	0	0	0	109.7	S316 V321 E348 N350	N314-S316 PolarHBondContact O-N 3.31Å; N314-V321 WeakPolarHBondContact OD1-CG2 3.32Å; N314-E348 PolarHBondContact N-O 3.1Å; N314-E348 PolarHBondContact O-N 2.78Å; N314-N350 PolarHBondContact ND2-ND2 2.85Å; N314-N350 WeakPolarHBondContact OD1-CB 3.37Å; N314-N350 PolarHBondContact OD1-ND2 2.78Å
315	C	87.4	Confident	86.1	Confident	2 Å²	2	55 Å²	55	1%	0.014	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	121.5	171.9	-174.6	0	0	0	0	110.6	K317 C318 S319 F320 C338 C341 S343 F347	C315-K317 PolarHBondContact O-N 2.88Å; C315-C318 VanDerWaalsContact SG-SG 3.65Å; C315-S319 VanDerWaalsContact O-CA 3.24Å; C315-S319 WeakPolarHBondContact O-CA 3.21Å; C315-S319 PolarHBondContact O-N 3.37Å; C315-F320 PolarHBondContact N-O 2.92Å; C315-C338 HydrophobicContact CB-CB 4.49Å; C315-C341 VanDerWaalsContact SG-SG 3.6Å; C315-S343 PolarHBondContact SG-OG 3.3Å; C315-S343 VanDerWaalsContact SG-OG 3.36Å; C315-F347 HydrophobicContact CB-CD1 4.23Å; C315-F347 HydrophobicContact CB-CE1 4.23Å
316	S	85	Confident	85.8	Confident	73 Å²	73	57.3 Å²	57.3	51%	0.51	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.5	-179.8	49.5	0	0	0	0	114.5	N314 P346	N314-S316 PolarHBondContact O-N 3.31Å; S316-P346 PolarHBondContact OG-O 2.9Å
317	K	84.4	Confident	85.2	Confident	156 Å²	156	54.9 Å²	54.9	68%	0.678	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-35.9	-177.2	-66	-170.3	-177.2	-178	0	114.9	C315	C315-K317 PolarHBondContact O-N 2.88Å
318	C	84.3	Confident	84.5	Confident	40 Å²	40	56 Å²	56	27%	0.27	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-0.5	-178.5	60.3	0	0	0	0	114	C315 F320 C341	C315-C318 VanDerWaalsContact SG-SG 3.65Å; C318-F320 PolarHBondContact O-N 2.89Å; C318-F320 VanDerWaalsContact SG-CB 3.53Å; C318-C341 HydrophobicContact CB-CB 4.06Å; C318-C341 PolarHBondContact SG-SG 2.78Å
319	S	81.9	Confident	83.7	Confident	103 Å²	103	56.7 Å²	56.7	72%	0.72	31%	0.312	S	S	*	.			trans	58.2	16.7	-178.1	-53.5	0	0	0	0	114.4	C315	C315-S319 VanDerWaalsContact O-CA 3.24Å; C315-S319 WeakPolarHBondContact O-CA 3.21Å; C315-S319 PolarHBondContact O-N 3.37Å
320	F	85.4	Confident	83.1	Confident	82 Å²	82	59.2 Å²	59.2	36%	0.36	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-77.9	139.1	175.9	-171.6	-101.8	0	0	0	111.1	C315 C318 L322 E340	C315-F320 PolarHBondContact N-O 2.92Å; C318-F320 PolarHBondContact O-N 2.89Å; C318-F320 VanDerWaalsContact SG-CB 3.53Å; F320-L322 HydrophobicContact CD1-CD2 3.91Å; F320-L322 HydrophobicContact CE1-CD2 4.24Å; F320-E340 VanDerWaalsContact CB-OE2 3.28Å; F320-E340 WeakPolarHBondContact CB-OE2 3.43Å; F320-E340 WeakPolarHBondContact CD2-OE2 3.3Å; F320-E340 HydrophobicContact CG-CB 4.43Å
321	V	87.2	Confident	82.6	Confident	45 Å²	45	64.5 Å²	64.5	27%	0.273	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	119.6	175.6	-169.9	0	0	0	0	109.2	K312 Y313 N314	K312-V321 HydrophobicContact CB-CG1 3.91Å; K312-V321 HydrophobicContact CD-CG1 3.95Å; Y313-V321 CarbonylContact O-C 3.47Å; Y313-V321 WeakPolarHBondContact O-CA 3.48Å; N314-V321 WeakPolarHBondContact OD1-CG2 3.32Å
322	L	84	Confident	82	Confident	8 Å²	8	71.7 Å²	71.7	4%	0.042	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	131.1	178.7	-65.3	177.8	0	0	0	112.1	Y313 F320 F325 P335 C338 P339 F347	Y313-L322 PolarHBondContact N-O 3.06Å; Y313-L322 PolarHBondContact O-N 3.45Å; F320-L322 HydrophobicContact CD1-CD2 3.91Å; F320-L322 HydrophobicContact CE1-CD2 4.24Å; L322-F325 HydrophobicContact CB-CE2 4.14Å; L322-P335 HydrophobicContact CD1-CB 4.46Å; L322-C338 HydrophobicContact CD1-CB 4.41Å; L322-C338 HydrophobicContact CD2-CB 4.15Å; L322-P339 HydrophobicContact CD2-CG 4.26Å; L322-F347 HydrophobicContact CD1-CD1 3.35Å; L322-F347 HydrophobicContact CD1-CE1 3.23Å; L322-F347 HydrophobicContact CD1-CE2 4.35Å; L322-F347 HydrophobicContact CD1-CG 4.02Å; L322-F347 HydrophobicContact CD1-CZ 3.74Å
323	G	68.1	Low	81.4	Confident	32 Å²	32	71.4 Å²	71.4	33%	0.33	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	65	166.5	170	0	0	0	0	0	113.1	K312	K312-G323 WeakPolarHBondContact CD-O 3.39Å; K312-G323 WeakPolarHBondContact CG-O 3.41Å
324	P	82.2	Confident	81	Confident	76 Å²	76	78.2 Å²	78.2	49%	0.494	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)		-100.7	127.9	109.4	26.5	-33.3	0	0	0	110.4	M310	M310-P324 HydrophobicContact CG-CB 3.69Å; M310-P324 HydrophobicContact SD-CB 3.43Å; M310-P324 WeakPolarHBondContact SD-CB 3.34Å; M310-P324 HydrophobicContact SD-CG 4.42Å
325	F	87.1	Confident	80.6	Confident	58 Å²	58	76.8 Å²	76.8	25%	0.254	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	125.1	172.5	-63.8	-76.4	0	0	0	109.3	V311 Y313 L322 V333 P335	V311-F325 PolarHBondContact N-O 3.34Å; V311-F325 PolarHBondContact O-N 2.88Å; Y313-F325 AromaticContact CD2-CD2 3.72Å; Y313-F325 HydrophobicContact CD2-CD2 3.72Å; Y313-F325 HydrophobicContact CD2-CE2 4.01Å; Y313-F325 AromaticContact CE2-CD2 3.95Å; Y313-F325 HydrophobicContact CE2-CD2 3.95Å; L322-F325 HydrophobicContact CB-CE2 4.14Å; F325-V333 HydrophobicContact CB-CG1 3.86Å; F325-V333 HydrophobicContact CD1-CG1 3.96Å; F325-V333 HydrophobicContact CG-CG1 4.05Å; F325-P335 HydrophobicContact CD2-CB 4.46Å; F325-P335 HydrophobicContact CE2-CB 3.73Å; F325-P335 HydrophobicContact CZ-CB 3.88Å
326	F	83.9	Confident	80.4	Confident	147 Å²	147	79 Å²	79	65%	0.645	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	124.8	174.6	-65.5	-79.5	0	0	0	109.9	M310 S328 V333	M310-F326 HydrophobicContact CB-CD1 4.39Å; M310-F326 HydrophobicContact CB-CE1 4.33Å; M310-F326 HydrophobicContact CG-CD1 4.48Å; M310-F326 HydrophobicContact CG-CE1 4.23Å; M310-F326 HydrophobicContact SD-CE1 4.24Å; M310-F326 HydrophobicContact SD-CZ 4.33Å; F326-S328 PolarHBondContact O-N 3.34Å; F326-V333 WeakPolarHBondContact O-CG2 3.5Å
327	Q	78.5	Confident	80.4	Confident	40 Å²	40	78.2 Å²	78.2	19%	0.187	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-80.5	119.8	-178	-177.6	57.7	48	0	0	109.9	L308 S309 V311 Q331 V333	L308-Q327 WeakPolarHBondContact O-CB 3.31Å; S309-Q327 PolarHBondContact O-N 3.42Å; V311-Q327 HydrophobicContact CG2-CB 4.4Å; Q327-Q331 PolarHBondContact NE2-O 3.25Å; Q327-V333 VanDerWaalsContact OE1-N 3.16Å
328	S	75.6	Confident	80.3	Confident	66 Å²	66	70.8 Å²	70.8	46%	0.462	39%	0.392	S	S	.	.	B	Isolated β-bridge	trans	-84.3	142.8	167	-177	0	0	0	0	109.7	F326 N330	F326-S328 PolarHBondContact O-N 3.34Å; S328-N330 PolarHBondContact O-N 3.14Å; S328-N330 VanDerWaalsContact O-N 3.09Å
329	Q	71.2	Confident	80.4	Confident	66 Å²	66	73.8 Å²	73.8	31%	0.308	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.1	-176.3	-65	-177	5	0	0	113.7	L385	Q329-L385 VanDerWaalsContact NE2-CD1 3.3Å
330	N	74.1	Confident	80.5	Confident	84 Å²	84	74.8 Å²	74.8	45%	0.449	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-25.8	-169.6	-57.2	-15	0	0	0	113.4	S328 H405	S328-N330 PolarHBondContact O-N 3.14Å; S328-N330 VanDerWaalsContact O-N 3.09Å; N330-H405 PolarHBondContact ND2-NE2 3.03Å; N330-H405 PolarHBondContact OD1-NE2 3.39Å
331	Q	79.3	Confident	80.4	Confident	153 Å²	153	73.2 Å²	73.2	72%	0.715	40%	0.402	S	S	*	.	B	Isolated β-bridge	trans	-149.2	128.9	-172	-172.5	176.1	19.2	0	0	110.8	Q327 V333	Q327-Q331 PolarHBondContact NE2-O 3.25Å; Q331-V333 PolarHBondContact O-N 2.7Å
332	E	74.8	Confident	80.3	Confident	151 Å²	151	78.8 Å²	78.8	71%	0.706	43%	0.425	S	S	*	.			trans	-56.7	124.7	170.6	-65.7	179.2	171	0	0	110.5	K334	E332-K334 PolarHBondContact O-N 2.99Å
333	V	78.8	Confident	80.2	Confident	40 Å²	40	78.9 Å²	78.9	24%	0.242	43%	0.427	C	S	.	.			trans	-76.4	114.4	176.6	179.5	0	0	0	0	108.5	Y313 F325 F326 Q327 Q331	Y313-V333 PolarHBondContact OH-O 3.19Å; Y313-V333 VanDerWaalsContact OH-O 3.09Å; F325-V333 HydrophobicContact CB-CG1 3.86Å; F325-V333 HydrophobicContact CD1-CG1 3.96Å; F325-V333 HydrophobicContact CG-CG1 4.05Å; F326-V333 WeakPolarHBondContact O-CG2 3.5Å; Q327-V333 VanDerWaalsContact OE1-N 3.16Å; Q331-V333 PolarHBondContact O-N 2.7Å
334	K	78.2	Confident	80.7	Confident	169 Å²	169	85.5 Å²	85.5	74%	0.735	45%	0.449	S	S	*	.			trans	-92.8	116.5	173.9	-64.9	-177.1	-178.8	-179.3	0	108.3	E332	E332-K334 PolarHBondContact O-N 2.99Å
335	P	81.1	Confident	80.3	Confident	22 Å²	22	82.7 Å²	82.7	14%	0.143	44%	0.435	C	S	.	.			trans	-61.2	144	174.5	27.1	-35.6	0	0	0	109.8	Y313 L322 F325 F347	Y313-P335 HydrophobicContact CD1-CG 4.24Å; Y313-P335 HydrophobicContact CD2-CB 3.98Å; Y313-P335 HydrophobicContact CD2-CG 3.74Å; Y313-P335 HydrophobicContact CE1-CG 4.37Å; Y313-P335 HydrophobicContact CE2-CB 4.3Å; Y313-P335 HydrophobicContact CE2-CG 3.89Å; Y313-P335 HydrophobicContact CG-CB 4.48Å; Y313-P335 HydrophobicContact CG-CG 3.93Å; L322-P335 HydrophobicContact CD1-CB 4.46Å; F325-P335 HydrophobicContact CD2-CB 4.46Å; F325-P335 HydrophobicContact CE2-CB 3.73Å; F325-P335 HydrophobicContact CZ-CB 3.88Å; P335-F347 HydrophobicContact CB-CD2 4.14Å; P335-F347 HydrophobicContact CB-CE2 4.3Å; P335-F347 HydrophobicContact CG-CB 4.12Å; P335-F347 HydrophobicContact CG-CD2 3.37Å; P335-F347 HydrophobicContact CG-CE2 3.96Å; P335-F347 HydrophobicContact CG-CG 3.94Å
336	G	82.8	Confident	80	Confident	49 Å²	49	85.2 Å²	85.2	51%	0.505	46%	0.457	S	S	.	.			trans	-74.1	-156.1	175.1	0	0	0	0	0	112.7	F347	G336-F347 WeakPolarHBondContact O-CE2 3.48Å; G336-F347 WeakPolarHBondContact O-CZ 3.47Å
337	S	86.4	Confident	80.1	Confident	55 Å²	55	79.9 Å²	79.9	39%	0.385	43%	0.433	S	S	.	.	S	Bend	trans	-67.3	141.8	174.5	-170.4	0	0	0	0	111.5	Q342	S337-Q342 WeakPolarHBondContact OG-CA 3.44Å; S337-Q342 PolarHBondContact OG-O 3.04Å; S337-Q342 VanDerWaalsContact OG-O 3.07Å
338	C	82.4	Confident	80.4	Confident	1 Å²	1	84.8 Å²	84.8	1%	0.007	46%	0.456	C	S	.	.			trans	-63.5	127.5	175.4	-178.6	0	0	0	0	111.1	C315 L322 E340 C341 Q342 S343 F347	C315-C338 HydrophobicContact CB-CB 4.49Å; L322-C338 HydrophobicContact CD1-CB 4.41Å; L322-C338 HydrophobicContact CD2-CB 4.15Å; C338-E340 PolarHBondContact O-N 2.92Å; C338-C341 VanDerWaalsContact SG-SG 3.67Å; C338-Q342 WeakPolarHBondContact O-CA 3.44Å; C338-Q342 PolarHBondContact O-N 3.34Å; C338-S343 PolarHBondContact N-O 3.43Å; C338-S343 VanDerWaalsContact N-O 3.1Å; C338-F347 HydrophobicContact CB-CE1 4.1Å; C338-F347 HydrophobicContact CB-CZ 4.43Å
339	P	85	Confident	81	Confident	102 Å²	102	84.4 Å²	84.4	66%	0.662	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-33.5	179.7	-26.4	35.2	0	0	0	114	L322	L322-P339 HydrophobicContact CD2-CG 4.26Å
340	E	85	Confident	81.8	Confident	125 Å²	125	82 Å²	82	58%	0.584	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-38.7	-171.2	-152.9	174.1	-145	0	0	114	F320 C338	F320-E340 VanDerWaalsContact CB-OE2 3.28Å; F320-E340 WeakPolarHBondContact CB-OE2 3.43Å; F320-E340 WeakPolarHBondContact CD2-OE2 3.3Å; F320-E340 HydrophobicContact CG-CB 4.43Å; C338-E340 PolarHBondContact O-N 2.92Å
341	C	82.9	Confident	82.4	Confident	48 Å²	48	85.1 Å²	85.1	32%	0.324	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	2.2	-175.3	70.2	0	0	0	0	114.3	C315 C318 C338 S343	C315-C341 VanDerWaalsContact SG-SG 3.6Å; C318-C341 HydrophobicContact CB-CB 4.06Å; C318-C341 PolarHBondContact SG-SG 2.78Å; C338-C341 VanDerWaalsContact SG-SG 3.67Å; C341-S343 PolarHBondContact O-N 2.83Å; C341-S343 VanDerWaalsContact SG-CB 3.58Å; C341-S343 PolarHBondContact SG-OG 2.61Å
342	Q	84.7	Confident	82.8	Confident	162 Å²	162	86.4 Å²	86.4	76%	0.757	46%	0.46	S	S	*	.			trans	51.8	18.7	-177	-60.5	-178.3	-3	0	0	114.7	S337 C338	S337-Q342 WeakPolarHBondContact OG-CA 3.44Å; S337-Q342 PolarHBondContact OG-O 3.04Å; S337-Q342 VanDerWaalsContact OG-O 3.07Å; C338-Q342 WeakPolarHBondContact O-CA 3.44Å; C338-Q342 PolarHBondContact O-N 3.34Å
343	S	82.2	Confident	83.4	Confident	11 Å²	11	83.1 Å²	83.1	8%	0.077	45%	0.445	C	S	.	.			trans	-80.2	134.1	179.4	81	0	0	0	0	110.2	C315 C338 C341 G345 F347	C315-S343 PolarHBondContact SG-OG 3.3Å; C315-S343 VanDerWaalsContact SG-OG 3.36Å; C338-S343 PolarHBondContact N-O 3.43Å; C338-S343 VanDerWaalsContact N-O 3.1Å; C341-S343 PolarHBondContact O-N 2.83Å; C341-S343 VanDerWaalsContact SG-CB 3.58Å; C341-S343 PolarHBondContact SG-OG 2.61Å; S343-G345 VanDerWaalsContact C-N 3.26Å; S343-F347 WeakPolarHBondContact O-CZ 3.38Å
344	Q	79.2	Confident	83.9	Confident	170 Å²	170	81.7 Å²	81.7	79%	0.794	44%	0.436	S	S	*	.			trans	-95.1	21	172	-62.7	179.7	-9.5	0	0	111.2
345	G	73.9	Confident	84.4	Confident	18 Å²	18	77.1 Å²	77.1	19%	0.186	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-62.8	171.6	-173.4	0	0	0	0	0	112.8	S343 F347	S343-G345 VanDerWaalsContact C-N 3.26Å; G345-F347 WeakPolarHBondContact O-CD2 3.38Å; G345-F347 WeakPolarHBondContact O-CE2 3.47Å; G345-F347 PolarHBondContact O-N 2.84Å
346	P	79.9	Confident	84.8	Confident	110 Å²	110	81 Å²	81	71%	0.714	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-61.9	123.8	171	27.7	-32.7	0	0	0	108.7	S316	S316-P346 PolarHBondContact OG-O 2.9Å
347	F	85.4	Confident	85.1	Confident	35 Å²	35	81 Å²	81	15%	0.154	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	133.5	175.3	-54.7	-76.5	0	0	0	109	Y313 C315 L322 P335 G336 C338 S343 G345	Y313-F347 HydrophobicContact CD1-CB 3.93Å; Y313-F347 HydrophobicContact CG-CB 4.15Å; C315-F347 HydrophobicContact CB-CD1 4.23Å; C315-F347 HydrophobicContact CB-CE1 4.23Å; L322-F347 HydrophobicContact CD1-CD1 3.35Å; L322-F347 HydrophobicContact CD1-CE1 3.23Å; L322-F347 HydrophobicContact CD1-CE2 4.35Å; L322-F347 HydrophobicContact CD1-CG 4.02Å; L322-F347 HydrophobicContact CD1-CZ 3.74Å; P335-F347 HydrophobicContact CB-CD2 4.14Å; P335-F347 HydrophobicContact CB-CE2 4.3Å; P335-F347 HydrophobicContact CG-CB 4.12Å; P335-F347 HydrophobicContact CG-CD2 3.37Å; P335-F347 HydrophobicContact CG-CE2 3.96Å; P335-F347 HydrophobicContact CG-CG 3.94Å; G336-F347 WeakPolarHBondContact O-CE2 3.48Å; G336-F347 WeakPolarHBondContact O-CZ 3.47Å; C338-F347 HydrophobicContact CB-CE1 4.1Å; C338-F347 HydrophobicContact CB-CZ 4.43Å; S343-F347 WeakPolarHBondContact O-CZ 3.38Å; G345-F347 WeakPolarHBondContact O-CD2 3.38Å; G345-F347 WeakPolarHBondContact O-CE2 3.47Å; G345-F347 PolarHBondContact O-N 2.84Å
348	E	85.8	Confident	85.4	Confident	144 Å²	144	82 Å²	82	67%	0.673	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	146.3	176.4	-67.4	-176.5	176.5	0	0	109.6	Y313 N314	Y313-E348 CarbonylContact C-O 3.59Å; Y313-E348 VanDerWaalsContact CA-O 3.29Å; Y313-E348 WeakPolarHBondContact CA-O 3.47Å; N314-E348 PolarHBondContact N-O 3.1Å; N314-E348 PolarHBondContact O-N 2.78Å
349	V	88	Confident	85.9	Confident	57 Å²	57	84.4 Å²	84.4	35%	0.345	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	130.3	179	177.4	0	0	0	0	109.2	V311 Y313 M351 T354	V311-V349 HydrophobicContact CG1-CG1 4.1Å; V311-V349 HydrophobicContact CG1-CG2 4.28Å; Y313-V349 HydrophobicContact CD1-CG2 3.95Å; Y313-V349 HydrophobicContact CE1-CG2 3.57Å; V349-M351 PolarHBondContact O-N 2.86Å; V349-T354 HydrophobicContact CG1-CG2 3.55Å
350	N	87.8	Confident	86.3	Confident	17 Å²	17	79.8 Å²	79.8	9%	0.091	40%	0.401	C	S	.	.			trans	-83.2	97.6	175.1	-172.9	-10.8	0	0	0	110.6	K312 N314 E352 E353 T354	K312-N350 PolarHBondContact O-N 3.43Å; N314-N350 PolarHBondContact ND2-ND2 2.85Å; N314-N350 WeakPolarHBondContact OD1-CB 3.37Å; N314-N350 PolarHBondContact OD1-ND2 2.78Å; N350-E352 PolarHBondContact O-N 3.19Å; N350-E352 VanDerWaalsContact O-N 3.11Å; N350-E352 PolarHBondContact OD1-N 3.37Å; N350-E353 PolarHBondContact O-N 3.48Å; N350-T354 WeakPolarHBondContact O-CB 3.46Å; N350-T354 WeakPolarHBondContact O-CG2 3.44Å; N350-T354 PolarHBondContact O-N 3.42Å; N350-T354 PolarHBondContact O-OG1 2.75Å; N350-T354 VanDerWaalsContact O-OG1 3.07Å
351	M	87.2	Confident	86.6	Confident	149 Å²	149	77.8 Å²	77.8	73%	0.734	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-23.3	-176	-62.3	-175.6	-179.3	0	0	114.5	V349 T354	V349-M351 PolarHBondContact O-N 2.86Å; M351-T354 WeakPolarHBondContact CA-OG1 3.34Å; M351-T354 PolarHBondContact O-OG1 3.36Å
352	E	87.8	Confident	87.2	Confident	180 Å²	180	75.5 Å²	75.5	84%	0.841	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-37.9	-174.9	-62.5	-179.4	176.2	0	0	112.9	N350	N350-E352 PolarHBondContact O-N 3.19Å; N350-E352 VanDerWaalsContact O-N 3.11Å; N350-E352 PolarHBondContact OD1-N 3.37Å
353	E	87.1	Confident	87.5	Confident	82 Å²	82	68.4 Å²	68.4	38%	0.383	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-8	-176.3	-61.6	-172.1	-167.9	0	0	113.4	K312 N350	K312-E353 HydrophobicContact CD-CB 3.75Å; K312-E353 WeakPolarHBondContact CD-OE2 3.36Å; K312-E353 WeakPolarHBondContact CE-OE2 3.33Å; K312-E353 HydrophobicContact CG-CB 4.43Å; K312-E353 IonicContact NZ-OE2 3.95Å; K312-E353 PolarHBondContact NZ-OE2 3.35Å; N350-E353 PolarHBondContact O-N 3.48Å
354	T	88.7	Confident	88.1	Confident	9 Å²	9	67.9 Å²	67.9	6%	0.055	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-75.8	133.8	174.6	51.9	0	0	0	0	111	M310 V311 K312 V349 N350 M351 Y356	M310-T354 CarbonylContact O-C 3.59Å; M310-T354 WeakPolarHBondContact O-CA 3.4Å; V311-T354 HydrophobicContact CG1-CG2 4.21Å; K312-T354 HydrophobicContact CB-CG2 4.48Å; K312-T354 VanDerWaalsContact N-CG2 3.35Å; V349-T354 HydrophobicContact CG1-CG2 3.55Å; N350-T354 WeakPolarHBondContact O-CB 3.46Å; N350-T354 WeakPolarHBondContact O-CG2 3.44Å; N350-T354 PolarHBondContact O-N 3.42Å; N350-T354 PolarHBondContact O-OG1 2.75Å; N350-T354 VanDerWaalsContact O-OG1 3.07Å; M351-T354 WeakPolarHBondContact CA-OG1 3.34Å; M351-T354 PolarHBondContact O-OG1 3.36Å; T354-Y356 VanDerWaalsContact OG1-CE2 3.29Å; T354-Y356 WeakPolarHBondContact OG1-CE2 3.34Å; T354-Y356 PolarHBondContact OG1-OH 3.35Å
355	V	89.3	Confident	88.6	Confident	74 Å²	74	63 Å²	63	45%	0.448	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	125.7	174.9	178.5	0	0	0	0	109.1	S309 M310	S309-V355 PolarHBondContact N-O 2.72Å; M310-V355 HydrophobicContact CB-CB 4.15Å; M310-V355 HydrophobicContact CE-CB 4.46Å; M310-V355 HydrophobicContact CE-CG2 3.67Å; M310-V355 PolarHBondContact N-O 3Å; M310-V355 PolarHBondContact O-N 3.42Å
356	Y	89.6	Confident	89.5	Confident	103 Å²	103	62.9 Å²	62.9	40%	0.404	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	149.8	175.8	-60.7	-87.6	0	0	0	110.3	P306 Q307 L308 T354	P306-Y356 HydrophobicContact CB-CD1 4.38Å; Q307-Y356 CarbonylContact O-C 3.51Å; Q307-Y356 VanDerWaalsContact O-CA 3.32Å; Q307-Y356 WeakPolarHBondContact O-CA 3.19Å; L308-Y356 HydrophobicContact CD2-CD1 3.93Å; L308-Y356 HydrophobicContact CD2-CE1 3.44Å; L308-Y356 VanDerWaalsContact CD2-CE1 3.44Å; L308-Y356 HydrophobicContact CG-CE1 4.28Å; T354-Y356 VanDerWaalsContact OG1-CE2 3.29Å; T354-Y356 WeakPolarHBondContact OG1-CE2 3.34Å; T354-Y356 PolarHBondContact OG1-OH 3.35Å
357	Q	89.1	Confident	89.8	Confident	48 Å²	48	59 Å²	59	22%	0.224	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	148.5	172.4	62.8	-175.9	-16.5	0	0	109.5	Q307	Q307-Q357 HydrophobicContact CB-CG 4.16Å; Q307-Q357 PolarHBondContact N-O 3.24Å; Q307-Q357 PolarHBondContact O-N 3.15Å
358	N	93.1	Very high	89.5	Confident	78 Å²	78	62.5 Å²	62.5	42%	0.417	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	139.9	175.7	-65.1	-29.6	0	0	0	110.5	V304 L385 A386 V389	V304-N358 HydrophobicContact CG1-CB 4.02Å; N358-L385 WeakPolarHBondContact O-CA 3.37Å; N358-A386 PolarHBondContact O-N 3.3Å; N358-V389 HydrophobicContact CB-CB 4.49Å; N358-V389 HydrophobicContact CB-CG1 3.79Å; N358-V389 HydrophobicContact CB-CG2 3.96Å
359	Y	92.7	Very high	89.1	Confident	51 Å²	51	59.4 Å²	59.4	20%	0.2	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134.7	179	173.5	-86.8	0	0	0	109.8	L305 Q307 R361 V383 L385	L305-Y359 PolarHBondContact N-O 2.97Å; L305-Y359 WeakPolarHBondContact O-CA 3.14Å; L305-Y359 WeakPolarHBondContact O-CB 3.4Å; L305-Y359 PolarHBondContact O-N 3.1Å; L305-Y359 VanDerWaalsContact O-O 3.12Å; Q307-Y359 HydrophobicContact CB-CG 4.35Å; Y359-R361 HydrophobicContact CE1-CB 4.13Å; Y359-V383 HydrophobicContact CD2-CG1 3.79Å; Y359-V383 HydrophobicContact CE2-CB 4.34Å; Y359-V383 HydrophobicContact CE2-CG1 3.34Å; Y359-V383 HydrophobicContact CE2-CG2 4.03Å; Y359-L385 HydrophobicContact CD2-CD2 3.98Å
360	Q	92.9	Very high	88.7	Confident	5 Å²	5	62.6 Å²	62.6	2%	0.023	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	137.2	172.9	-170.7	178.7	24.5	0	0	109.6	T302 I362 L384 V389	T302-Q360 WeakPolarHBondContact O-CG 3.36Å; T302-Q360 PolarHBondContact O-NE2 3.36Å; Q360-I362 HydrophobicContact CG-CG2 4.48Å; Q360-L384 HydrophobicContact CB-CB 4.31Å; Q360-L384 PolarHBondContact N-O 3.45Å; Q360-L384 PolarHBondContact O-N 3.39Å; Q360-V389 HydrophobicContact CB-CB 4.18Å; Q360-V389 HydrophobicContact CB-CG1 3.87Å
361	R	92.4	Very high	88.3	Confident	82 Å²	82	63.1 Å²	63.1	31%	0.309	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	132.5	175.4	-175.6	165.7	60.4	154.1	-7.3	110.1	T302 Y359 D381 V551	T302-R361 HydrophobicContact CG2-CB 4.14Å; T302-R361 PolarHBondContact N-O 2.95Å; T302-R361 PolarHBondContact OG1-N 3.11Å; T302-R361 PolarHBondContact OG1-O 3.23Å; Y359-R361 HydrophobicContact CE1-CB 4.13Å; R361-D381 IonicContact NH1-OD2 2.54Å; R361-D381 PolarHBondContact NH1-OD2 3.49Å; R361-V551 HydrophobicContact CG-CG1 4.45Å
362	I	93.7	Very high	87.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	152.7	178.7	64.5	165.5	0	0	0	110.6	V298 S300 C301 Q360 D381 A382 L384 I398 L400	V298-I362 HydrophobicContact CG1-CB 4.33Å; S300-I362 CarbonylContact O-C 3.5Å; S300-I362 VanDerWaalsContact O-CA 3.31Å; S300-I362 WeakPolarHBondContact O-CA 3.27Å; C301-I362 HydrophobicContact CB-CG2 3.87Å; Q360-I362 HydrophobicContact CG-CG2 4.48Å; I362-D381 WeakPolarHBondContact O-CA 3.44Å; I362-A382 HydrophobicContact CD1-CB 4.16Å; I362-A382 HydrophobicContact CG1-CB 3.81Å; I362-A382 WeakPolarHBondContact CG1-O 3.45Å; I362-A382 PolarHBondContact N-O 3.39Å; I362-A382 PolarHBondContact O-N 3.19Å; I362-L384 HydrophobicContact CD1-CD1 4.17Å; I362-L384 HydrophobicContact CD1-CD2 3.98Å; I362-L384 HydrophobicContact CD1-CG 4.27Å; I362-L384 HydrophobicContact CG1-CD1 4.5Å; I362-L384 HydrophobicContact CG1-CD2 4.33Å; I362-L384 HydrophobicContact CG1-CG 4.32Å; I362-L384 HydrophobicContact CG2-CD1 3.93Å; I362-L384 HydrophobicContact CG2-CG 4.34Å; I362-I398 HydrophobicContact CD1-CD1 4.02Å; I362-L400 HydrophobicContact CD1-CD1 4.35Å
363	T	92.4	Very high	87.2	Confident	13 Å²	13	55.4 Å²	55.4	8%	0.08	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	111	173.9	46.9	0	0	0	0	109.3	S299 S300 K380 D381 V551	S299-T363 PolarHBondContact N-O 3.08Å; S299-T363 WeakPolarHBondContact OG-CB 3.27Å; S299-T363 PolarHBondContact OG-O 2.92Å; S299-T363 PolarHBondContact OG-OG1 3.5Å; S300-T363 VanDerWaalsContact CB-OG1 3.24Å; S300-T363 WeakPolarHBondContact CB-OG1 3.49Å; S300-T363 PolarHBondContact N-OG1 2.82Å; S300-T363 VanDerWaalsContact N-OG1 3.08Å; S300-T363 PolarHBondContact O-N 3.4Å; S300-T363 PolarHBondContact O-OG1 2.94Å; T363-K380 CarbonylContact C-O 3.58Å; T363-D381 WeakPolarHBondContact CG2-OD1 3.44Å; T363-V551 HydrophobicContact CG2-CG2 3.52Å
364	I	93.4	Very high	86.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	138	177.6	-165.9	174	0	0	0	110.3	I280 S379 K380 I398	I280-I364 HydrophobicContact CD1-CD1 4.32Å; I280-I364 HydrophobicContact CD1-CG1 4.06Å; I280-I364 HydrophobicContact CD1-CG2 4.13Å; I364-S379 CarbonylContact O-C 3.51Å; I364-S379 WeakPolarHBondContact O-CA 3.29Å; I364-S379 WeakPolarHBondContact O-CB 3.42Å; I364-K380 HydrophobicContact CG2-CB 4.17Å; I364-K380 WeakPolarHBondContact CG2-O 3.44Å; I364-K380 PolarHBondContact N-O 3.42Å; I364-K380 PolarHBondContact O-N 3.14Å; I364-I398 HydrophobicContact CD1-CD1 3.96Å; I364-I398 HydrophobicContact CD1-CG1 3.8Å; I364-I398 HydrophobicContact CG1-CG1 4.46Å
365	Q	91.6	Very high	86.8	Confident	68 Å²	68	63.7 Å²	63.7	32%	0.318	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	150.5	-179.1	-172.8	174.2	5.5	0	0	110.6	G296 V297 P377	G296-Q365 CarbonylContact C-O 3.51Å; G296-Q365 WeakPolarHBondContact CA-O 3.22Å; V297-Q365 PolarHBondContact N-O 3.33Å; V297-Q365 PolarHBondContact O-N 2.82Å; Q365-P377 HydrophobicContact CG-CB 4.1Å
366	E	91.1	Very high	86.8	Confident	16 Å²	16	67 Å²	67	8%	0.075	39%	0.391	C	S	.	.			trans	-58.5	137.9	173	-68	179.4	149.1	0	0	111.6	I280 R281 V371 P377 R378	I280-E366 HydrophobicContact CB-CG 3.85Å; I280-E366 HydrophobicContact CD1-CG 4.23Å; I280-E366 HydrophobicContact CG1-CG 4.45Å; I280-E366 HydrophobicContact CG2-CG 4.49Å; R281-E366 WeakPolarHBondContact CB-OE1 3.28Å; R281-E366 IonicContact CZ-OE2 3.46Å; R281-E366 PolarHBondContact N-OE1 3.42Å; R281-E366 IonicContact NE-OE1 3.48Å; R281-E366 IonicContact NE-OE2 3.96Å; R281-E366 PolarHBondContact NE-OE2 2.98Å; R281-E366 IonicContact NH2-OE2 2.68Å; R281-E366 PolarHBondContact NH2-OE2 3.24Å; E366-V371 HydrophobicContact CB-CG2 3.84Å; E366-P377 HydrophobicContact CB-CB 4.33Å; E366-R378 PolarHBondContact N-O 3.17Å; E366-R378 VanDerWaalsContact N-O 3.1Å; E366-R378 PolarHBondContact OE2-N 3.13Å; E366-R378 VanDerWaalsContact OE2-N 3.17Å
367	S	86.6	Confident	86.8	Confident	29 Å²	29	64.6 Å²	64.6	20%	0.203	39%	0.387	C	S	.	.			trans	-63.1	128.8	175.9	177.1	0	0	0	0	110.2	G369 K370	S367-G369 PolarHBondContact O-N 3.08Å; S367-G369 VanDerWaalsContact O-N 3.09Å; S367-K370 PolarHBondContact O-N 2.91Å
368	P	79.8	Confident	86.8	Confident	107 Å²	107	70 Å²	70	70%	0.695	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-32.8	-175.7	-27.5	34.1	0	0	0	114.3	K370	P368-K370 VanDerWaalsContact C-N 3.34Å; P368-K370 PolarHBondContact O-N 3.45Å
369	G	77.2	Confident	86.7	Confident	79 Å²	79	69.7 Å²	69.7	81%	0.814	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-19	-178.6	0	0	0	0	0	114.8	S367	S367-G369 PolarHBondContact O-N 3.08Å; S367-G369 VanDerWaalsContact O-N 3.09Å
370	K	78.9	Confident	86.7	Confident	124 Å²	124	69.7 Å²	69.7	54%	0.539	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-12.3	-178.2	-131.2	-177.8	-177.6	-168.1	0	113	S367 P368	S367-K370 PolarHBondContact O-N 2.91Å; P368-K370 VanDerWaalsContact C-N 3.34Å; P368-K370 PolarHBondContact O-N 3.45Å
371	V	79.8	Confident	86.7	Confident	29 Å²	29	72 Å²	72	18%	0.176	42%	0.424	C	S	.	.	S	Bend	trans	-75.4	132	-176.9	179.6	0	0	0	0	110.4	E366 A373 R375 P377	E366-V371 HydrophobicContact CB-CG2 3.84Å; V371-A373 PolarHBondContact O-N 3.46Å; V371-R375 WeakPolarHBondContact CG1-O 3.46Å; V371-P377 HydrophobicContact CG2-CB 4.23Å
372	A	74.6	Confident	86.8	Confident	58 Å²	58	68.1 Å²	68.1	48%	0.479	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-55	130	172.8	0	0	0	0	0	110.9	G374 R375	A372-G374 PolarHBondContact O-N 3.08Å; A372-R375 PolarHBondContact O-N 2.69Å
373	A	77.1	Confident	86.8	Confident	109 Å²	109	68.4 Å²	68.4	90%	0.901	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	131.5	-174.7	0	0	0	0	0	111.9	V371	V371-A373 PolarHBondContact O-N 3.46Å
374	G	81.4	Confident	86.9	Confident	91 Å²	91	67.8 Å²	67.8	94%	0.938	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	3.5	176.7	0	0	0	0	0	116.3	A372	A372-G374 PolarHBondContact O-N 3.08Å
375	R	87	Confident	86.8	Confident	174 Å²	174	69.7 Å²	69.7	66%	0.657	42%	0.417	S	S	*	.	S	Bend	trans	-107.9	146.4	173.5	-66.9	-173.5	179.6	-176.4	2.2	112.2	V371 A372	V371-R375 WeakPolarHBondContact CG1-O 3.46Å; A372-R375 PolarHBondContact O-N 2.69Å
376	L	87.4	Confident	86.5	Confident	144 Å²	144	67.3 Å²	67.3	75%	0.754	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-68.7	138.1	174.8	-65.9	166.9	0	0	0	111	R281	R281-L376 PolarHBondContact NH2-O 2.98Å; R281-L376 VanDerWaalsContact NH2-O 3.08Å
377	P	89.6	Confident	86.3	Confident	51 Å²	51	68.8 Å²	68.8	33%	0.331	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-65.9	140.8	173	27.2	-34.4	0	0	0	110.8	Q365 E366 V371	Q365-P377 HydrophobicContact CG-CB 4.1Å; E366-P377 HydrophobicContact CB-CB 4.33Å; V371-P377 HydrophobicContact CG2-CB 4.23Å
378	R	90.6	Very high	86.4	Confident	161 Å²	161	67.9 Å²	67.9	61%	0.608	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-94.7	154.9	173.9	-61.9	-62.9	-175.6	175.2	-0.7	110.8	E366	E366-R378 PolarHBondContact N-O 3.17Å; E366-R378 VanDerWaalsContact N-O 3.1Å; E366-R378 PolarHBondContact OE2-N 3.13Å; E366-R378 VanDerWaalsContact OE2-N 3.17Å
379	S	91.4	Very high	87	Confident	73 Å²	73	63.8 Å²	63.8	51%	0.51	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	156.8	176.2	57.2	0	0	0	0	111.7	I364	I364-S379 CarbonylContact O-C 3.51Å; I364-S379 WeakPolarHBondContact O-CA 3.29Å; I364-S379 WeakPolarHBondContact O-CB 3.42Å
380	K	92.6	Very high	87.6	Confident	51 Å²	51	65.3 Å²	65.3	22%	0.222	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	152.5	174.5	-73.9	-65	-172.6	174.9	0	110.3	I280 T363 I364 Y404 T423 I425	I280-K380 HydrophobicContact CG2-CB 4.22Å; I280-K380 HydrophobicContact CG2-CG 3.58Å; T363-K380 CarbonylContact C-O 3.58Å; I364-K380 HydrophobicContact CG2-CB 4.17Å; I364-K380 WeakPolarHBondContact CG2-O 3.44Å; I364-K380 PolarHBondContact N-O 3.42Å; I364-K380 PolarHBondContact O-N 3.14Å; K380-Y404 PolarHBondContact NZ-OH 2.98Å; K380-T423 PolarHBondContact NZ-OG1 2.9Å; K380-I425 HydrophobicContact CB-CD1 4.35Å
381	D	92.8	Very high	87.9	Confident	54 Å²	54	61.5 Å²	61.5	29%	0.289	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	137.5	174.1	-70.8	15.3	0	0	0	109.2	R361 I362 T363 V424 I425	R361-D381 IonicContact NH1-OD2 2.54Å; R361-D381 PolarHBondContact NH1-OD2 3.49Å; I362-D381 WeakPolarHBondContact O-CA 3.44Å; T363-D381 WeakPolarHBondContact CG2-OD1 3.44Å; D381-V424 HydrophobicContact CB-CG2 4.38Å; D381-I425 PolarHBondContact O-N 3.24Å
382	A	93.9	Very high	88.3	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	147.7	168.5	0	0	0	0	0	111.1	I362 L400 I425	I362-A382 HydrophobicContact CD1-CB 4.16Å; I362-A382 HydrophobicContact CG1-CB 3.81Å; I362-A382 WeakPolarHBondContact CG1-O 3.45Å; I362-A382 PolarHBondContact N-O 3.39Å; I362-A382 PolarHBondContact O-N 3.19Å; A382-L400 HydrophobicContact CB-CD1 3.64Å; A382-I425 CarbonylContact C-O 3.54Å; A382-I425 WeakPolarHBondContact CA-O 3.28Å; A382-I425 HydrophobicContact CB-CB 4.08Å
383	V	94.2	Very high	88.8	Confident	6 Å²	6	62.5 Å²	62.5	4%	0.036	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128	-179.4	169.7	0	0	0	0	108.9	Y359 L385 V424 I425 L426 A427	Y359-V383 HydrophobicContact CD2-CG1 3.79Å; Y359-V383 HydrophobicContact CE2-CB 4.34Å; Y359-V383 HydrophobicContact CE2-CG1 3.34Å; Y359-V383 HydrophobicContact CE2-CG2 4.03Å; V383-L385 HydrophobicContact CG1-CD2 3.85Å; V383-L385 HydrophobicContact CG1-CG 4.24Å; V383-V424 HydrophobicContact CB-CG2 4.39Å; V383-V424 HydrophobicContact CG2-CG2 3.58Å; V383-I425 PolarHBondContact N-O 2.97Å; V383-L426 HydrophobicContact CB-CD2 4.01Å; V383-L426 HydrophobicContact CG1-CD2 4.4Å; V383-A427 WeakPolarHBondContact O-CB 3.3Å; V383-A427 PolarHBondContact O-N 3.12Å
384	L	93.8	Very high	89.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	136.8	175.5	-44	-175.2	0	0	0	108.6	Q360 I362 L388 A427 I430	Q360-L384 HydrophobicContact CB-CB 4.31Å; Q360-L384 PolarHBondContact N-O 3.45Å; Q360-L384 PolarHBondContact O-N 3.39Å; I362-L384 HydrophobicContact CD1-CD1 4.17Å; I362-L384 HydrophobicContact CD1-CD2 3.98Å; I362-L384 HydrophobicContact CD1-CG 4.27Å; I362-L384 HydrophobicContact CG1-CD1 4.5Å; I362-L384 HydrophobicContact CG1-CD2 4.33Å; I362-L384 HydrophobicContact CG1-CG 4.32Å; I362-L384 HydrophobicContact CG2-CD1 3.93Å; I362-L384 HydrophobicContact CG2-CG 4.34Å; L384-L388 HydrophobicContact CB-CB 4.08Å; L384-L388 WeakPolarHBondContact CD1-O 3.43Å; L384-A427 HydrophobicContact CD2-CB 3.37Å; L384-I430 HydrophobicContact CD1-CD1 3.78Å; L384-I430 HydrophobicContact CD2-CD1 3.35Å; L384-I430 HydrophobicContact CD2-CG1 4.37Å; L384-I430 HydrophobicContact CG-CD1 4.19Å
385	L	91.1	Very high	89.1	Confident	39 Å²	39	58.4 Å²	58.4	20%	0.204	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	153.7	-177.8	-57.9	172.9	0	0	0	110.3	Q329 N358 Y359 V383 D387 L388	Q329-L385 VanDerWaalsContact NE2-CD1 3.3Å; N358-L385 WeakPolarHBondContact O-CA 3.37Å; Y359-L385 HydrophobicContact CD2-CD2 3.98Å; V383-L385 HydrophobicContact CG1-CD2 3.85Å; V383-L385 HydrophobicContact CG1-CG 4.24Å; L385-D387 PolarHBondContact O-N 3.16Å; L385-D387 VanDerWaalsContact O-N 3.16Å; L385-L388 WeakPolarHBondContact O-CB 3.29Å; L385-L388 PolarHBondContact O-N 2.88Å
386	A	85.4	Confident	89	Confident	19 Å²	19	51 Å²	51	16%	0.157	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	52.3	-110.6	169.8	0	0	0	0	0	113.9	N358 V389	N358-A386 PolarHBondContact O-N 3.3Å; A386-V389 VanDerWaalsContact O-CG2 3.31Å; A386-V389 WeakPolarHBondContact O-CG2 3.3Å
387	D	86.8	Confident	88.9	Confident	46 Å²	46	47.4 Å²	47.4	25%	0.246	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-72.7	-22.6	-178.8	65	-35.7	0	0	0	114.1	E214 S215 R270 L385 V389	E214-D387 HydrophobicContact CG-CB 4.35Å; S215-D387 WeakPolarHBondContact CB-OD2 3.47Å; S215-D387 PolarHBondContact OG-OD2 2.67Å; R270-D387 IonicContact CZ-OD1 2.58Å; R270-D387 IonicContact CZ-OD2 3.79Å; R270-D387 IonicContact NE-OD1 3.85Å; R270-D387 IonicContact NE-OD2 3.36Å; R270-D387 PolarHBondContact NE-OD2 3.44Å; R270-D387 IonicContact NH2-OD1 3.45Å; R270-D387 PolarHBondContact NH2-OD1 3.41Å; R270-D387 IonicContact NH2-OD2 3.91Å; R270-D387 PolarHBondContact NH2-OD2 2.81Å; L385-D387 PolarHBondContact O-N 3.16Å; L385-D387 VanDerWaalsContact O-N 3.16Å; D387-V389 VanDerWaalsContact C-N 3.26Å; D387-V389 PolarHBondContact O-N 3.47Å
388	L	89.6	Confident	89	Confident	10 Å²	10	45 Å²	45	5%	0.052	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-78.2	-10.7	-177.5	-64.9	174.6	0	0	0	113.1	L384 L385 S391 A427	L384-L388 HydrophobicContact CB-CB 4.08Å; L384-L388 WeakPolarHBondContact CD1-O 3.43Å; L385-L388 WeakPolarHBondContact O-CB 3.29Å; L385-L388 PolarHBondContact O-N 2.88Å; L388-S391 WeakPolarHBondContact O-CB 3.26Å; L388-S391 PolarHBondContact O-N 3.38Å; L388-S391 PolarHBondContact O-OG 3.33Å; L388-A427 HydrophobicContact CD1-CB 4.21Å; L388-A427 WeakPolarHBondContact CD1-O 3.49Å
389	V	91.8	Very high	89	Confident	22 Å²	22	38.4 Å²	38.4	13%	0.133	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	146.7	178.2	-53.9	0	0	0	0	111.1	V304 N358 Q360 A386 D387 S391	V304-V389 HydrophobicContact CG1-CB 4.33Å; V304-V389 HydrophobicContact CG1-CG2 4.08Å; V304-V389 HydrophobicContact CG2-CB 4.17Å; V304-V389 HydrophobicContact CG2-CG2 4.24Å; N358-V389 HydrophobicContact CB-CB 4.49Å; N358-V389 HydrophobicContact CB-CG1 3.79Å; N358-V389 HydrophobicContact CB-CG2 3.96Å; Q360-V389 HydrophobicContact CB-CB 4.18Å; Q360-V389 HydrophobicContact CB-CG1 3.87Å; A386-V389 VanDerWaalsContact O-CG2 3.31Å; A386-V389 WeakPolarHBondContact O-CG2 3.3Å; D387-V389 VanDerWaalsContact C-N 3.26Å; D387-V389 PolarHBondContact O-N 3.47Å; V389-S391 PolarHBondContact O-N 2.95Å; V389-S391 VanDerWaalsContact O-N 3.12Å
390	D	89.4	Confident	89	Confident	111 Å²	111	35 Å²	35	59%	0.594	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	16.2	-175.8	-154	27.8	0	0	0	114.6	C392	D390-C392 VanDerWaalsContact C-N 3.34Å
391	S	86.4	Confident	89.1	Confident	43 Å²	43	32.7 Å²	32.7	30%	0.301	19%	0.189	S	C	.	.	S	Bend	trans	-72.2	-28.2	176.4	-68.8	0	0	0	0	112.9	L388 V389 R432	L388-S391 WeakPolarHBondContact O-CB 3.26Å; L388-S391 PolarHBondContact O-N 3.38Å; L388-S391 PolarHBondContact O-OG 3.33Å; V389-S391 PolarHBondContact O-N 2.95Å; V389-S391 VanDerWaalsContact O-N 3.12Å; S391-R432 WeakPolarHBondContact O-CD 3.44Å
392	C	87.2	Confident	89.1	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.175	C	C	.	.			trans	-130.9	149.4	-176.7	61	0	0	0	0	111.8	V298 D390 I398	V298-C392 HydrophobicContact CG2-CB 4.08Å; D390-C392 VanDerWaalsContact C-N 3.34Å; C392-I398 HydrophobicContact CB-CG2 4.03Å
393	K	86.1	Confident	89.1	Confident	109 Å²	109	30.9 Å²	30.9	47%	0.474	18%	0.179	S	C	.	.			trans	-116.5	157.8	176	-63.4	176.8	-176.6	178.4	0	110.1	G395 D396	K393-G395 PolarHBondContact O-N 2.88Å; K393-D396 WeakPolarHBondContact CB-OD2 3.45Å; K393-D396 PolarHBondContact N-OD2 2.86Å; K393-D396 VanDerWaalsContact O-CB 3.3Å; K393-D396 WeakPolarHBondContact O-CB 3.36Å; K393-D396 VanDerWaalsContact O-CG 3.28Å; K393-D396 PolarHBondContact O-N 3.37Å; K393-D396 VanDerWaalsContact O-N 3.12Å
394	P	84.1	Confident	89.2	Confident	61 Å²	61	31 Å²	31	40%	0.396	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	133.6	173.4	-21.6	35.2	0	0	0	110.3	V298 C301	V298-P394 CarbonylContact O-C 3.58Å; V298-P394 WeakPolarHBondContact O-CA 3.37Å; C301-P394 WeakPolarHBondContact SG-CD 3.36Å; C301-P394 WeakPolarHBondContact SG-CG 3.29Å
395	G	80.1	Confident	89.1	Confident	53 Å²	53	32.5 Å²	32.5	55%	0.546	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.7	-16.6	-174.7	0	0	0	0	0	114.6	V298 K393	V298-G395 PolarHBondContact O-N 3.45Å; K393-G395 PolarHBondContact O-N 2.88Å
396	D	84.6	Confident	89.1	Confident	18 Å²	18	32.8 Å²	32.8	10%	0.096	19%	0.188	C	C	.	.			trans	-70.2	136.9	-179.5	-66.8	-16.4	0	0	0	111.3	V297 V298 K393 I398 R432	V297-D396 WeakPolarHBondContact CA-O 3.3Å; V298-D396 PolarHBondContact N-O 3.37Å; K393-D396 WeakPolarHBondContact CB-OD2 3.45Å; K393-D396 PolarHBondContact N-OD2 2.86Å; K393-D396 VanDerWaalsContact O-CB 3.3Å; K393-D396 WeakPolarHBondContact O-CB 3.36Å; K393-D396 VanDerWaalsContact O-CG 3.28Å; K393-D396 PolarHBondContact O-N 3.37Å; K393-D396 VanDerWaalsContact O-N 3.12Å; D396-I398 HydrophobicContact CB-CG2 4.24Å; D396-R432 VanDerWaalsContact CG-CZ 3.5Å; D396-R432 IonicContact OD1-CZ 3.54Å; D396-R432 IonicContact OD1-NH2 3.64Å; D396-R432 PolarHBondContact OD1-NH2 3.15Å; D396-R432 IonicContact OD2-CZ 2.74Å; D396-R432 IonicContact OD2-NE 3.72Å; D396-R432 PolarHBondContact OD2-NE 2.55Å; D396-R432 IonicContact OD2-NH1 2.73Å; D396-R432 PolarHBondContact OD2-NH1 3.42Å; D396-R432 IonicContact OD2-NH2 2.72Å; D396-R432 PolarHBondContact OD2-NH2 3.05Å
397	E	85.9	Confident	89.2	Confident	68 Å²	68	34.7 Å²	34.7	32%	0.318	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	117.5	167.2	-60	-153	150.4	0	0	109.9	V297 R433	V297-E397 HydrophobicContact CG2-CG 4.23Å; E397-R433 HydrophobicContact CB-CB 4.27Å; E397-R433 PolarHBondContact O-N 2.71Å
398	I	90.1	Very high	89.1	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	150.8	-179.2	66.2	167.6	0	0	0	111.6	S295 G296 V298 I362 I364 C392 D396 L400 I430 R432	S295-I398 WeakPolarHBondContact CA-O 3.47Å; G296-I398 PolarHBondContact N-O 3.45Å; G296-I398 PolarHBondContact O-N 3.03Å; G296-I398 VanDerWaalsContact O-O 3.07Å; V298-I398 HydrophobicContact CG2-CD1 3.41Å; V298-I398 VanDerWaalsContact CG2-CD1 3.41Å; V298-I398 HydrophobicContact CG2-CG1 3.73Å; V298-I398 HydrophobicContact CG2-CG2 4.02Å; I362-I398 HydrophobicContact CD1-CD1 4.02Å; I364-I398 HydrophobicContact CD1-CD1 3.96Å; I364-I398 HydrophobicContact CD1-CG1 3.8Å; I364-I398 HydrophobicContact CG1-CG1 4.46Å; C392-I398 HydrophobicContact CB-CG2 4.03Å; D396-I398 HydrophobicContact CB-CG2 4.24Å; I398-L400 HydrophobicContact CD1-CD1 4.43Å; I398-I430 HydrophobicContact CB-CG2 4.08Å; I398-I430 HydrophobicContact CD1-CG2 4.42Å; I398-I430 HydrophobicContact CG2-CG2 4.12Å; I398-R432 HydrophobicContact CG2-CG 4.25Å
399	E	91.1	Very high	88.7	Confident	24 Å²	24	41.6 Å²	41.6	11%	0.112	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	125.9	158.2	-42.7	-173.8	159.7	0	0	108.1	R293 T294 I430 T431 R433	R293-E399 IonicContact CZ-OE2 3.54Å; R293-E399 IonicContact NE-OE2 2.94Å; R293-E399 PolarHBondContact NE-OE2 2.76Å; R293-E399 IonicContact NH2-OE2 3.52Å; R293-E399 PolarHBondContact NH2-OE2 3.46Å; T294-E399 CarbonylContact O-C 3.41Å; T294-E399 WeakPolarHBondContact O-CA 3.47Å; E399-I430 WeakPolarHBondContact O-CA 3.26Å; E399-T431 WeakPolarHBondContact CB-OG1 3.5Å; E399-T431 PolarHBondContact N-O 2.86Å; E399-T431 PolarHBondContact O-N 3.1Å; E399-R433 HydrophobicContact CG-CG 4.11Å; E399-R433 IonicContact OE1-CZ 3.34Å; E399-R433 IonicContact OE1-NE 2.79Å; E399-R433 PolarHBondContact OE1-NE 3.22Å; E399-R433 IonicContact OE1-NH2 3.86Å; E399-R433 PolarHBondContact OE1-NH2 3.15Å
400	L	92.4	Very high	88.1	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	120.9	-175.9	-175.1	147	0	0	0	108.4	R293 T294 I362 A382 I398 I425 A427 I430	R293-L400 WeakPolarHBondContact CA-O 3.43Å; T294-L400 PolarHBondContact N-O 3.31Å; T294-L400 PolarHBondContact O-N 3.3Å; I362-L400 HydrophobicContact CD1-CD1 4.35Å; A382-L400 HydrophobicContact CB-CD1 3.64Å; I398-L400 HydrophobicContact CD1-CD1 4.43Å; L400-I425 HydrophobicContact CD2-CB 4.2Å; L400-I425 HydrophobicContact CD2-CG2 3.38Å; L400-A427 HydrophobicContact CD1-CB 3.97Å; L400-A427 HydrophobicContact CG-CB 4.24Å; L400-I430 HydrophobicContact CD1-CG1 4.48Å
401	T	93.8	Very high	87.9	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.018	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125.4	166.5	-54.7	0	0	0	0	107.8	L274 L291 I292 N428 H429	L274-T401 HydrophobicContact CD1-CG2 4.48Å; L291-T401 HydrophobicContact CD1-CG2 4.2Å; L291-T401 HydrophobicContact CD2-CG2 4.36Å; L291-T401 HydrophobicContact CG-CG2 4.18Å; I292-T401 CarbonylContact O-C 3.59Å; I292-T401 VanDerWaalsContact O-CA 3.3Å; I292-T401 WeakPolarHBondContact O-CA 3.41Å; T401-N428 PolarHBondContact O-N 3.4Å; T401-H429 PolarHBondContact N-O 3.06Å; T401-H429 PolarHBondContact O-N 3.47Å
402	G	93.8	Very high	87.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167	172.1	-173.3	0	0	0	0	0	113.3	I292 L426	I292-G402 WeakPolarHBondContact CG1-O 3.44Å; I292-G402 PolarHBondContact N-O 3.15Å; I292-G402 PolarHBondContact O-N 3.5Å; G402-L426 CarbonylContact C-O 3.58Å; G402-L426 WeakPolarHBondContact CA-O 3.41Å
403	I	94.2	Very high	87.6	Confident	16 Å²	16	43.4 Å²	43.4	8%	0.082	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	125.1	179.3	-54.4	172.6	0	0	0	107.8	P238 L242 Q290 L291 H405 L426	P238-I403 HydrophobicContact CB-CD1 4.02Å; P238-I403 HydrophobicContact CB-CG1 4.1Å; P238-I403 HydrophobicContact CG-CD1 3.98Å; P238-I403 HydrophobicContact CG-CG1 3.9Å; P238-I403 HydrophobicContact CG-CG2 4.24Å; L242-I403 HydrophobicContact CD1-CD1 4.36Å; Q290-I403 WeakPolarHBondContact O-CA 3.47Å; L291-I403 HydrophobicContact CD1-CG1 4.08Å; I403-H405 PolarHBondContact O-N 3.13Å; I403-L426 PolarHBondContact N-O 2.9Å; I403-L426 PolarHBondContact O-N 3.2Å
404	Y	94.4	Very high	87.6	Confident	10 Å²	10	44 Å²	44	4%	0.039	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	105.4	175.9	-173.1	-112.8	0	0	0	110.1	L283 H287 L288 N289 Q290 I292 K380 T423 I425	L283-Y404 HydrophobicContact CB-CE2 4.4Å; L283-Y404 HydrophobicContact CD1-CD2 4.23Å; L283-Y404 HydrophobicContact CD1-CE2 4.06Å; H287-Y404 HydrophobicContact CB-CD1 4.32Å; H287-Y404 WeakPolarHBondContact O-CB 3.15Å; L288-Y404 HydrophobicContact CD2-CD1 3.99Å; L288-Y404 HydrophobicContact CD2-CE1 3.92Å; N289-Y404 WeakPolarHBondContact CA-O 3.5Å; N289-Y404 PolarHBondContact N-O 3.23Å; Q290-Y404 PolarHBondContact O-N 2.86Å; Q290-Y404 VanDerWaalsContact O-N 3.15Å; I292-Y404 HydrophobicContact CD1-CD2 4.13Å; I292-Y404 HydrophobicContact CD1-CG 4.35Å; K380-Y404 PolarHBondContact NZ-OH 2.98Å; Y404-T423 HydrophobicContact CE1-CG2 4.32Å; Y404-T423 VanDerWaalsContact OH-CB 3.31Å; Y404-T423 WeakPolarHBondContact OH-CB 3.47Å; Y404-T423 VanDerWaalsContact OH-CG2 3.26Å; Y404-T423 WeakPolarHBondContact OH-CG2 3.42Å; Y404-T423 PolarHBondContact OH-OG1 3.36Å; Y404-I425 HydrophobicContact CD2-CG1 4.09Å
405	H	91.9	Very high	87.7	Confident	30 Å²	30	45 Å²	45	14%	0.139	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	154.8	-174.6	-164.6	53.4	0	0	0	112	N289 N330 I403 T423 V424 L426	N289-H405 PolarHBondContact OD1-ND1 3.27Å; N330-H405 PolarHBondContact ND2-NE2 3.03Å; N330-H405 PolarHBondContact OD1-NE2 3.39Å; I403-H405 PolarHBondContact O-N 3.13Å; H405-T423 CarbonylContact O-C 3.56Å; H405-T423 WeakPolarHBondContact O-CA 3.25Å; H405-V424 CarbonylContact C-O 3.57Å; H405-V424 WeakPolarHBondContact CA-O 3.35Å; H405-V424 HydrophobicContact CB-CG1 4.3Å; H405-V424 PolarHBondContact N-O 3.37Å; H405-V424 PolarHBondContact O-N 3.34Å; H405-L426 HydrophobicContact CB-CD1 4.19Å; H405-L426 HydrophobicContact CB-CG 4.11Å
406	N	91.2	Very high	88	Confident	46 Å²	46	46.6 Å²	46.6	25%	0.246	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	143.5	175.3	68.8	-33.8	0	0	0	111.3	L288 F421 A422	L288-N406 HydrophobicContact CD2-CB 3.88Å; N406-F421 HydrophobicContact CB-CB 4.45Å; N406-A422 CarbonylContact C-O 3.6Å; N406-A422 VanDerWaalsContact CA-O 3.31Å; N406-A422 WeakPolarHBondContact CA-O 3.06Å
407	N	87.6	Confident	88	Confident	58 Å²	58	48.7 Å²	48.7	31%	0.31	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	147.5	173.8	58.7	-14.4	0	0	0	110.2	A422	N407-A422 PolarHBondContact N-O 3.05Å; N407-A422 PolarHBondContact O-N 3.36Å; N407-A422 WeakPolarHBondContact OD1-CA 3.5Å; N407-A422 WeakPolarHBondContact OD1-CB 3.4Å; N407-A422 PolarHBondContact OD1-O 2.89Å
408	Y	84.3	Confident	87.9	Confident	145 Å²	145	52.7 Å²	52.7	57%	0.569	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	121.5	175.3	179	-106	0	0	0	109.5	N413 F421	Y408-N413 PolarHBondContact OH-ND2 3.18Å; Y408-F421 AromaticContact CD2-CD1 3.91Å; Y408-F421 HydrophobicContact CD2-CD1 3.91Å; Y408-F421 AromaticContact CD2-CE1 3.57Å; Y408-F421 HydrophobicContact CD2-CE1 3.57Å; Y408-F421 HydrophobicContact CD2-CZ 4.33Å; Y408-F421 HydrophobicContact CG-CD1 4.46Å; Y408-F421 HydrophobicContact CG-CE1 4.23Å
409	D	81.8	Confident	87.5	Confident	56 Å²	56	57 Å²	57	30%	0.299	34%	0.335	S	S	.	.			trans	-116.2	116.8	174.4	-173.2	-6.5	0	0	0	109.5	S411 L412 A422	D409-S411 PolarHBondContact O-N 3.1Å; D409-S411 WeakPolarHBondContact OD1-CB 3.41Å; D409-S411 PolarHBondContact OD1-N 2.83Å; D409-S411 PolarHBondContact OD1-OG 2.89Å; D409-S411 PolarHBondContact OD2-OG 3.3Å; D409-L412 HydrophobicContact CB-CD1 4.17Å; D409-L412 HydrophobicContact CB-CG 4.27Å; D409-A422 HydrophobicContact CB-CB 4.2Å
410	G	79.3	Confident	87.3	Confident	37 Å²	37	58.4 Å²	58.4	38%	0.381	35%	0.346	S	S	.	.	H	α-helix	trans	-68.7	-23	178.8	0	0	0	0	0	113.6	T414	G410-T414 PolarHBondContact O-N 3.17Å; G410-T414 PolarHBondContact O-OG1 2.76Å
411	S	85	Confident	87	Confident	72 Å²	72	63.4 Å²	63.4	50%	0.503	37%	0.368	S	S	.	.	H	α-helix	trans	-72	-42.6	-178.9	71	0	0	0	0	111.9	D409 N413 T414 A415	D409-S411 PolarHBondContact O-N 3.1Å; D409-S411 WeakPolarHBondContact OD1-CB 3.41Å; D409-S411 PolarHBondContact OD1-N 2.83Å; D409-S411 PolarHBondContact OD1-OG 2.89Å; D409-S411 PolarHBondContact OD2-OG 3.3Å; S411-N413 VanDerWaalsContact C-N 3.32Å; S411-N413 PolarHBondContact O-N 2.88Å; S411-T414 PolarHBondContact O-N 3.17Å; S411-A415 PolarHBondContact O-N 2.75Å; S411-A415 VanDerWaalsContact O-N 3.16Å
412	L	83.4	Confident	86.8	Confident	57 Å²	57	64.4 Å²	64.4	30%	0.298	38%	0.376	S	S	.	.	H	α-helix	trans	-65.2	-35	177.3	-67.3	179.3	0	0	0	112.6	D409 T414 A415 N416 V420 A422	D409-L412 HydrophobicContact CB-CD1 4.17Å; D409-L412 HydrophobicContact CB-CG 4.27Å; L412-T414 VanDerWaalsContact C-N 3.3Å; L412-T414 PolarHBondContact O-N 2.95Å; L412-A415 PolarHBondContact O-N 2.61Å; L412-N416 WeakPolarHBondContact O-CB 3.33Å; L412-N416 PolarHBondContact O-N 2.82Å; L412-N416 PolarHBondContact O-ND2 3.33Å; L412-V420 HydrophobicContact CB-CB 4.45Å; L412-A422 HydrophobicContact CD1-CB 3.91Å
413	N	84.9	Confident	86.6	Confident	48 Å²	48	66.1 Å²	66.1	26%	0.257	39%	0.387	S	S	.	.	H	α-helix	trans	-62.9	-40	176.4	-169.2	10.3	0	0	0	111.4	Y408 S411 G417 F418	Y408-N413 PolarHBondContact OH-ND2 3.18Å; S411-N413 VanDerWaalsContact C-N 3.32Å; S411-N413 PolarHBondContact O-N 2.88Å; N413-G417 PolarHBondContact O-N 3.15Å; N413-F418 VanDerWaalsContact OD1-C 3.3Å; N413-F418 PolarHBondContact OD1-O 3.38Å
414	T	85.9	Confident	86.6	Confident	123 Å²	123	66.2 Å²	66.2	76%	0.755	39%	0.388	S	S	*	.	H	α-helix	trans	-70.9	-36.1	179.6	-47.9	0	0	0	0	111.8	G410 S411 L412	G410-T414 PolarHBondContact O-N 3.17Å; G410-T414 PolarHBondContact O-OG1 2.76Å; S411-T414 PolarHBondContact O-N 3.17Å; L412-T414 VanDerWaalsContact C-N 3.3Å; L412-T414 PolarHBondContact O-N 2.95Å
415	A	85.3	Confident	86.6	Confident	82 Å²	82	65.8 Å²	65.8	68%	0.678	39%	0.386	S	S	*	.	H	α-helix	trans	-74.6	-40.7	179.9	0	0	0	0	0	113.2	S411 L412	S411-A415 PolarHBondContact O-N 2.75Å; S411-A415 VanDerWaalsContact O-N 3.16Å; L412-A415 PolarHBondContact O-N 2.61Å
416	N	86.3	Confident	86.7	Confident	85 Å²	85	66.1 Å²	66.1	46%	0.455	39%	0.389	S	S	.	.	H	α-helix	trans	-93	-16	-173	-62.4	-44.8	0	0	0	113.5	L412 F418 V420	L412-N416 WeakPolarHBondContact O-CB 3.33Å; L412-N416 PolarHBondContact O-N 2.82Å; L412-N416 PolarHBondContact O-ND2 3.33Å; N416-F418 VanDerWaalsContact O-CD2 3.25Å; N416-F418 WeakPolarHBondContact O-CD2 3.31Å; N416-F418 PolarHBondContact O-N 2.95Å; N416-V420 HydrophobicContact CB-CG2 4.02Å
417	G	84.4	Confident	86.9	Confident	63 Å²	63	64.4 Å²	64.4	65%	0.649	38%	0.381	S	S	*	.	S	Bend	trans	71.1	2.6	-175.9	0	0	0	0	0	114.7	N413	N413-G417 PolarHBondContact O-N 3.15Å
418	F	83.7	Confident	87.1	Confident	152 Å²	152	62.2 Å²	62.2	67%	0.667	37%	0.369	S	S	*	.	S	Bend	trans	-128.5	150.6	176	-63.6	-79.9	0	0	0	109.7	N413 N416 V420	N413-F418 VanDerWaalsContact OD1-C 3.3Å; N413-F418 PolarHBondContact OD1-O 3.38Å; N416-F418 VanDerWaalsContact O-CD2 3.25Å; N416-F418 WeakPolarHBondContact O-CD2 3.31Å; N416-F418 PolarHBondContact O-N 2.95Å; F418-V420 VanDerWaalsContact C-N 3.31Å; F418-V420 HydrophobicContact CB-CG2 4.49Å; F418-V420 PolarHBondContact O-N 2.89Å
419	P	83.5	Confident	87.5	Confident	90 Å²	90	56.4 Å²	56.4	58%	0.584	35%	0.347	S	S	*	.			trans	-68.8	88.4	177.4	29	-34.6	0	0	0	110.5
420	V	85.6	Confident	88	Confident	54 Å²	54	54.6 Å²	54.6	33%	0.327	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-96.3	125.7	176.4	-180	0	0	0	0	109.1	L412 N416 F418	L412-V420 HydrophobicContact CB-CB 4.45Å; N416-V420 HydrophobicContact CB-CG2 4.02Å; F418-V420 VanDerWaalsContact C-N 3.31Å; F418-V420 HydrophobicContact CB-CG2 4.49Å; F418-V420 PolarHBondContact O-N 2.89Å
421	F	87.1	Confident	88.3	Confident	105 Å²	105	55 Å²	55	46%	0.461	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	140.1	172.1	-61.7	-88.5	0	0	0	109.8	N406 Y408	N406-F421 HydrophobicContact CB-CB 4.45Å; Y408-F421 AromaticContact CD2-CD1 3.91Å; Y408-F421 HydrophobicContact CD2-CD1 3.91Å; Y408-F421 AromaticContact CD2-CE1 3.57Å; Y408-F421 HydrophobicContact CD2-CE1 3.57Å; Y408-F421 HydrophobicContact CD2-CZ 4.33Å; Y408-F421 HydrophobicContact CG-CD1 4.46Å; Y408-F421 HydrophobicContact CG-CE1 4.23Å
422	A	88.8	Confident	88.4	Confident	23 Å²	23	55.9 Å²	55.9	19%	0.19	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	155	167.9	0	0	0	0	0	109.5	N406 N407 D409 L412	N406-A422 CarbonylContact C-O 3.6Å; N406-A422 VanDerWaalsContact CA-O 3.31Å; N406-A422 WeakPolarHBondContact CA-O 3.06Å; N407-A422 PolarHBondContact N-O 3.05Å; N407-A422 PolarHBondContact O-N 3.36Å; N407-A422 WeakPolarHBondContact OD1-CA 3.5Å; N407-A422 WeakPolarHBondContact OD1-CB 3.4Å; N407-A422 PolarHBondContact OD1-O 2.89Å; D409-A422 HydrophobicContact CB-CB 4.2Å; L412-A422 HydrophobicContact CD1-CB 3.91Å
423	T	90.8	Very high	87.9	Confident	37 Å²	37	58.7 Å²	58.7	23%	0.227	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.1	-175.4	62.6	0	0	0	0	108.8	K380 Y404 H405	K380-T423 PolarHBondContact NZ-OG1 2.9Å; Y404-T423 HydrophobicContact CE1-CG2 4.32Å; Y404-T423 VanDerWaalsContact OH-CB 3.31Å; Y404-T423 WeakPolarHBondContact OH-CB 3.47Å; Y404-T423 VanDerWaalsContact OH-CG2 3.26Å; Y404-T423 WeakPolarHBondContact OH-CG2 3.42Å; Y404-T423 PolarHBondContact OH-OG1 3.36Å; H405-T423 CarbonylContact O-C 3.56Å; H405-T423 WeakPolarHBondContact O-CA 3.25Å
424	V	93.2	Very high	86.9	Confident	18 Å²	18	59.2 Å²	59.2	11%	0.109	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	141.1	-177.2	62.7	0	0	0	0	109.3	D381 V383 H405 L426	D381-V424 HydrophobicContact CB-CG2 4.38Å; V383-V424 HydrophobicContact CB-CG2 4.39Å; V383-V424 HydrophobicContact CG2-CG2 3.58Å; H405-V424 CarbonylContact C-O 3.57Å; H405-V424 WeakPolarHBondContact CA-O 3.35Å; H405-V424 HydrophobicContact CB-CG1 4.3Å; H405-V424 PolarHBondContact N-O 3.37Å; H405-V424 PolarHBondContact O-N 3.34Å; V424-L426 HydrophobicContact CG1-CD2 4.44Å
425	I	94.6	Very high	85.3	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	119.5	175.6	-47.8	174.2	0	0	0	108.5	L283 I292 K380 D381 A382 V383 L400 Y404 A427	L283-I425 HydrophobicContact CD1-CD1 4.34Å; I292-I425 HydrophobicContact CD1-CD1 4.07Å; I292-I425 HydrophobicContact CD1-CG1 4.29Å; I292-I425 HydrophobicContact CD1-CG2 4.19Å; I292-I425 HydrophobicContact CG1-CG2 4.49Å; K380-I425 HydrophobicContact CB-CD1 4.35Å; D381-I425 PolarHBondContact O-N 3.24Å; A382-I425 CarbonylContact C-O 3.54Å; A382-I425 WeakPolarHBondContact CA-O 3.28Å; A382-I425 HydrophobicContact CB-CB 4.08Å; V383-I425 PolarHBondContact N-O 2.97Å; L400-I425 HydrophobicContact CD2-CB 4.2Å; L400-I425 HydrophobicContact CD2-CG2 3.38Å; Y404-I425 HydrophobicContact CD2-CG1 4.09Å; I425-A427 PolarHBondContact O-N 3.46Å
426	L	94	Very high	83.7	Confident	37 Å²	37	54.2 Å²	54.2	19%	0.194	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	108	171.2	-57	-175.8	0	0	0	107.8	V383 G402 I403 H405 V424 N428	V383-L426 HydrophobicContact CB-CD2 4.01Å; V383-L426 HydrophobicContact CG1-CD2 4.4Å; G402-L426 CarbonylContact C-O 3.58Å; G402-L426 WeakPolarHBondContact CA-O 3.41Å; I403-L426 PolarHBondContact N-O 2.9Å; I403-L426 PolarHBondContact O-N 3.2Å; H405-L426 HydrophobicContact CB-CD1 4.19Å; H405-L426 HydrophobicContact CB-CG 4.11Å; V424-L426 HydrophobicContact CG1-CD2 4.44Å; L426-N428 PolarHBondContact O-N 3.09Å
427	A	94.6	Very high	81.9	Confident	10 Å²	10	53.7 Å²	53.7	8%	0.083	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	127.2	-176.4	0	0	0	0	0	110	V383 L384 L388 L400 I425 I430	V383-A427 WeakPolarHBondContact O-CB 3.3Å; V383-A427 PolarHBondContact O-N 3.12Å; L384-A427 HydrophobicContact CD2-CB 3.37Å; L388-A427 HydrophobicContact CD1-CB 4.21Å; L388-A427 WeakPolarHBondContact CD1-O 3.49Å; L400-A427 HydrophobicContact CD1-CB 3.97Å; L400-A427 HydrophobicContact CG-CB 4.24Å; I425-A427 PolarHBondContact O-N 3.46Å; A427-I430 HydrophobicContact CB-CG1 4.5Å
428	N	93.3	Very high	80.2	Confident	12 Å²	12	51.5 Å²	51.5	6%	0.064	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-42.3	166.9	-173.6	23.7	0	0	0	110.4	V269 R270 T401 L426	V269-N428 PolarHBondContact O-OD1 3.36Å; R270-N428 WeakPolarHBondContact CD-O 3.44Å; R270-N428 PolarHBondContact NE-O 2.88Å; R270-N428 PolarHBondContact NH1-O 3.4Å; R270-N428 PolarHBondContact NH1-OD1 3.25Å; T401-N428 PolarHBondContact O-N 3.4Å; L426-N428 PolarHBondContact O-N 3.09Å
429	H	92.1	Very high	78.6	Confident	22 Å²	22	47.1 Å²	47.1	10%	0.102	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	139	-178.4	-177.5	59.3	0	0	0	110.9	R270 I271 C272 T401 T431	R270-H429 HydrophobicContact CB-CB 4.28Å; I271-H429 WeakPolarHBondContact O-CB 3.43Å; I271-H429 PolarHBondContact O-CD2 3.48Å; C272-H429 VanDerWaalsContact SG-CD2 3.52Å; C272-H429 PolarHBondContact SG-NE2 3.14Å; T401-H429 PolarHBondContact N-O 3.06Å; T401-H429 PolarHBondContact O-N 3.47Å; H429-T431 WeakPolarHBondContact NE2-CG2 3.25Å
430	I	91.5	Very high	77.1	Confident	19 Å²	19	47.1 Å²	47.1	10%	0.097	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125.1	175.9	-61.8	165.9	0	0	0	108.2	L384 I398 E399 L400 A427	L384-I430 HydrophobicContact CD1-CD1 3.78Å; L384-I430 HydrophobicContact CD2-CD1 3.35Å; L384-I430 HydrophobicContact CD2-CG1 4.37Å; L384-I430 HydrophobicContact CG-CD1 4.19Å; I398-I430 HydrophobicContact CB-CG2 4.08Å; I398-I430 HydrophobicContact CD1-CG2 4.42Å; I398-I430 HydrophobicContact CG2-CG2 4.12Å; E399-I430 WeakPolarHBondContact O-CA 3.26Å; L400-I430 HydrophobicContact CD1-CG1 4.48Å; A427-I430 HydrophobicContact CB-CG1 4.5Å
431	T	87.2	Confident	75.6	Confident	45 Å²	45	51.7 Å²	51.7	28%	0.276	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	125.7	165.1	52.8	0	0	0	0	108.6	E399 H429	E399-T431 WeakPolarHBondContact CB-OG1 3.5Å; E399-T431 PolarHBondContact N-O 2.86Å; E399-T431 PolarHBondContact O-N 3.1Å; H429-T431 WeakPolarHBondContact NE2-CG2 3.25Å
432	R	85.5	Confident	74.6	Confident	90 Å²	90	48.1 Å²	48.1	34%	0.34	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	136.2	170.5	-62.4	-179.2	63.3	168.2	-1.9	108.9	S391 D396 I398 D434	S391-R432 WeakPolarHBondContact O-CD 3.44Å; D396-R432 VanDerWaalsContact CG-CZ 3.5Å; D396-R432 IonicContact OD1-CZ 3.54Å; D396-R432 IonicContact OD1-NH2 3.64Å; D396-R432 PolarHBondContact OD1-NH2 3.15Å; D396-R432 IonicContact OD2-CZ 2.74Å; D396-R432 IonicContact OD2-NE 3.72Å; D396-R432 PolarHBondContact OD2-NE 2.55Å; D396-R432 IonicContact OD2-NH1 2.73Å; D396-R432 PolarHBondContact OD2-NH1 3.42Å; D396-R432 IonicContact OD2-NH2 2.72Å; D396-R432 PolarHBondContact OD2-NH2 3.05Å; I398-R432 HydrophobicContact CG2-CG 4.25Å; R432-D434 VanDerWaalsContact C-N 3.27Å; R432-D434 IonicContact NH2-OD2 3.93Å; R432-D434 PolarHBondContact NH2-OD2 3.22Å
433	R	73.4	Confident	73.7	Confident	116 Å²	116	50.2 Å²	50.2	44%	0.438	29%	0.286	S	S	.	.			trans	-77.3	-19.8	169.7	-75.6	-170.3	178.5	172.7	0.2	112.4	E397 E399 E435	E397-R433 HydrophobicContact CB-CB 4.27Å; E397-R433 PolarHBondContact O-N 2.71Å; E399-R433 HydrophobicContact CG-CG 4.11Å; E399-R433 IonicContact OE1-CZ 3.34Å; E399-R433 IonicContact OE1-NE 2.79Å; E399-R433 PolarHBondContact OE1-NE 3.22Å; E399-R433 IonicContact OE1-NH2 3.86Å; E399-R433 PolarHBondContact OE1-NH2 3.15Å; R433-E435 PolarHBondContact O-N 2.63Å
434	D	64.5	Low	73	Confident	59 Å²	59	54.5 Å²	54.5	32%	0.316	31%	0.308	S	S	.	.	S	Bend	trans	-65.1	129.2	176.6	-62.3	-30.7	0	0	0	111.4	R432 G436	R432-D434 VanDerWaalsContact C-N 3.27Å; R432-D434 IonicContact NH2-OD2 3.93Å; R432-D434 PolarHBondContact NH2-OD2 3.22Å; D434-G436 PolarHBondContact O-N 2.75Å
435	E	52.2	Low	72.4	Confident	43 Å²	43	60.4 Å²	60.4	20%	0.201	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-66.1	3.2	-169.6	-56.9	171.1	170.7	0	0	115.2	R433 V437 A438 R703	R433-E435 PolarHBondContact O-N 2.63Å; E435-V437 PolarHBondContact O-N 3.04Å; E435-A438 WeakPolarHBondContact O-CB 3.46Å; E435-A438 PolarHBondContact O-N 3.11Å; E435-R703 VanDerWaalsContact CD-NE 3.34Å; E435-R703 VanDerWaalsContact OE1-CD 3.31Å; E435-R703 WeakPolarHBondContact OE1-CD 3.49Å; E435-R703 IonicContact OE1-CZ 3.55Å; E435-R703 IonicContact OE1-NE 2.77Å; E435-R703 PolarHBondContact OE1-NE 2.96Å; E435-R703 IonicContact OE1-NH1 3.72Å; E435-R703 PolarHBondContact OE1-NH1 2.75Å; E435-R703 WeakPolarHBondContact OE2-CD 3.38Å; E435-R703 IonicContact OE2-CZ 3.05Å; E435-R703 IonicContact OE2-NE 3.11Å; E435-R703 PolarHBondContact OE2-NE 3.27Å; E435-R703 IonicContact OE2-NH1 2.62Å
436	G	50.4	Low	71.7	Confident	57 Å²	57	61.9 Å²	61.9	59%	0.588	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-61.2	-16.7	-179.6	0	0	0	0	0	114	D434	D434-G436 PolarHBondContact O-N 2.75Å
437	V	50.2	Low	71.3	Confident	74 Å²	74	61.3 Å²	61.3	45%	0.448	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-89.1	-8.3	177.2	-171.2	0	0	0	0	112.4	E435 V439 A440 E441	E435-V437 PolarHBondContact O-N 3.04Å; V437-V439 PolarHBondContact O-N 2.62Å; V437-A440 HydrophobicContact CG1-CB 4.35Å; V437-A440 PolarHBondContact O-N 2.77Å; V437-E441 PolarHBondContact O-N 3.29Å
438	A	49	Very low	70.9	Confident	18 Å²	18	67.8 Å²	67.8	15%	0.149	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-16.8	-176.8	0	0	0	0	0	114.1	E435 L442 I707	E435-A438 WeakPolarHBondContact O-CB 3.46Å; E435-A438 PolarHBondContact O-N 3.11Å; A438-L442 WeakPolarHBondContact O-CD1 3.35Å; A438-I707 HydrophobicContact CB-CD1 3.99Å
439	V	49.9	Very low	70.6	Confident	60 Å²	60	68.9 Å²	68.9	36%	0.364	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-42	169.8	-179.2	0	0	0	0	111.2	V437 E441 L442 I707 E711	V437-V439 PolarHBondContact O-N 2.62Å; V439-E441 VanDerWaalsContact C-N 3.32Å; V439-L442 PolarHBondContact O-N 2.92Å; V439-I707 HydrophobicContact CB-CG2 4.4Å; V439-I707 HydrophobicContact CG2-CG2 3.22Å; V439-E711 WeakPolarHBondContact CG1-OE2 3.49Å; V439-E711 WeakPolarHBondContact CG2-OE2 3.44Å
440	A	51.1	Low	70.4	Confident	89 Å²	89	68 Å²	68	74%	0.736	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-19.5	-173.2	0	0	0	0	0	112.7	V437	V437-A440 HydrophobicContact CG1-CB 4.35Å; V437-A440 PolarHBondContact O-N 2.77Å
441	E	55.1	Low	70.2	Confident	150 Å²	150	69.4 Å²	69.4	70%	0.701	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	12.6	176.2	-63.3	-174.3	166.8	0	0	113.4	V437 V439 T443	V437-E441 PolarHBondContact O-N 3.29Å; V439-E441 VanDerWaalsContact C-N 3.32Å; E441-T443 PolarHBondContact O-N 2.99Å
442	L	64.3	Low	70.2	Confident	30 Å²	30	70.1 Å²	70.1	16%	0.157	39%	0.393	C	S	.	.			trans	-65.2	110.5	172.1	-99.5	126.7	0	0	0	109.1	A438 V439 D446 V447 I450 Y708	A438-L442 WeakPolarHBondContact O-CD1 3.35Å; V439-L442 PolarHBondContact O-N 2.92Å; L442-D446 HydrophobicContact CD2-CB 3.97Å; L442-V447 HydrophobicContact CB-CG2 4.31Å; L442-V447 HydrophobicContact CD2-CG2 3.81Å; L442-I450 HydrophobicContact CD2-CD1 3.75Å; L442-Y708 HydrophobicContact CD2-CD2 4.47Å
443	T	70.3	Confident	70.2	Confident	68 Å²	68	67.8 Å²	67.8	42%	0.417	39%	0.387	S	S	.	.			trans	-66.8	151.5	173	63.6	0	0	0	0	109.9	E441 E445 D446 V447	E441-T443 PolarHBondContact O-N 2.99Å; T443-E445 PolarHBondContact O-N 2.93Å; T443-E445 VanDerWaalsContact O-N 3.11Å; T443-D446 PolarHBondContact N-OD2 3.5Å; T443-D446 WeakPolarHBondContact O-CB 3.32Å; T443-D446 PolarHBondContact O-N 3.43Å; T443-D446 VanDerWaalsContact O-N 3.08Å; T443-D446 WeakPolarHBondContact OG1-CB 3.37Å; T443-D446 PolarHBondContact OG1-N 2.94Å; T443-D446 VanDerWaalsContact OG1-N 3.08Å; T443-D446 PolarHBondContact OG1-OD2 3.19Å; T443-V447 PolarHBondContact O-N 2.84Å; T443-V447 VanDerWaalsContact O-N 3.13Å
444	D	76.8	Confident	70.8	Confident	127 Å²	127	63.2 Å²	63.2	68%	0.679	37%	0.373	S	S	*	.	H	α-helix	trans	-58.7	-23.6	172.7	-82.4	-9.6	0	0	0	112.3	K448	D444-K448 WeakPolarHBondContact O-CD 3.34Å; D444-K448 VanDerWaalsContact O-CG 3.22Å; D444-K448 WeakPolarHBondContact O-CG 3.44Å; D444-K448 PolarHBondContact O-N 3.32Å
445	E	80.9	Confident	71.9	Confident	141 Å²	141	68 Å²	68	66%	0.659	39%	0.391	S	S	*	.	H	α-helix	trans	-72.1	-45.6	173.9	-60.9	-171.2	172.7	0	0	111.9	T443 V447 K448 A449	T443-E445 PolarHBondContact O-N 2.93Å; T443-E445 VanDerWaalsContact O-N 3.11Å; E445-V447 VanDerWaalsContact C-N 3.31Å; E445-V447 PolarHBondContact O-N 3.43Å; E445-K448 PolarHBondContact O-N 3.09Å; E445-A449 PolarHBondContact O-N 3.08Å
446	D	80.4	Confident	73.5	Confident	33 Å²	33	68.9 Å²	68.9	18%	0.176	40%	0.397	C	S	.	.	H	α-helix	trans	-58.5	-43.9	175.5	-71	-53.1	0	0	0	111.3	L442 T443 K448 A449 I450 K704	L442-D446 HydrophobicContact CD2-CB 3.97Å; T443-D446 PolarHBondContact N-OD2 3.5Å; T443-D446 WeakPolarHBondContact O-CB 3.32Å; T443-D446 PolarHBondContact O-N 3.43Å; T443-D446 VanDerWaalsContact O-N 3.08Å; T443-D446 WeakPolarHBondContact OG1-CB 3.37Å; T443-D446 PolarHBondContact OG1-N 2.94Å; T443-D446 VanDerWaalsContact OG1-N 3.08Å; T443-D446 PolarHBondContact OG1-OD2 3.19Å; D446-K448 VanDerWaalsContact C-N 3.34Å; D446-K448 PolarHBondContact O-N 3.02Å; D446-A449 WeakPolarHBondContact O-CB 3.18Å; D446-A449 PolarHBondContact O-N 2.76Å; D446-I450 VanDerWaalsContact O-CG1 3.29Å; D446-I450 WeakPolarHBondContact O-CG1 3.35Å; D446-I450 PolarHBondContact O-N 2.89Å; D446-K704 HydrophobicContact CB-CD 4.38Å; D446-K704 IonicContact OD1-NZ 2.75Å; D446-K704 PolarHBondContact OD1-NZ 3.5Å; D446-K704 IonicContact OD2-NZ 3.91Å; D446-K704 PolarHBondContact OD2-NZ 3.36Å
447	V	84.3	Confident	74.9	Confident	25 Å²	25	73.8 Å²	73.8	15%	0.152	40%	0.404	C	S	.	.	H	α-helix	trans	-63.3	-41.6	178.5	176.9	0	0	0	0	111	L442 T443 E445 A449 I450 V451 Y708	L442-V447 HydrophobicContact CB-CG2 4.31Å; L442-V447 HydrophobicContact CD2-CG2 3.81Å; T443-V447 PolarHBondContact O-N 2.84Å; T443-V447 VanDerWaalsContact O-N 3.13Å; E445-V447 VanDerWaalsContact C-N 3.31Å; E445-V447 PolarHBondContact O-N 3.43Å; V447-A449 VanDerWaalsContact C-N 3.34Å; V447-A449 PolarHBondContact O-N 3Å; V447-I450 PolarHBondContact O-N 3.32Å; V447-V451 HydrophobicContact CG1-CG2 4.49Å; V447-V451 WeakPolarHBondContact O-CG2 3.14Å; V447-V451 PolarHBondContact O-N 2.83Å; V447-Y708 HydrophobicContact CG1-CE2 3.91Å; V447-Y708 HydrophobicContact CG2-CE2 4.17Å
448	K	87.3	Confident	76.4	Confident	145 Å²	145	78 Å²	78	63%	0.63	41%	0.413	S	S	*	.	H	α-helix	trans	-63	-41.3	175.7	-73.7	166.6	-170.2	164.9	0	111.5	D444 E445 D446 V451 A452	D444-K448 WeakPolarHBondContact O-CD 3.34Å; D444-K448 VanDerWaalsContact O-CG 3.22Å; D444-K448 WeakPolarHBondContact O-CG 3.44Å; D444-K448 PolarHBondContact O-N 3.32Å; E445-K448 PolarHBondContact O-N 3.09Å; D446-K448 VanDerWaalsContact C-N 3.34Å; D446-K448 PolarHBondContact O-N 3.02Å; K448-V451 PolarHBondContact O-N 3.15Å; K448-A452 WeakPolarHBondContact O-CB 3.35Å; K448-A452 PolarHBondContact O-N 2.96Å
449	A	86.3	Confident	78.2	Confident	36 Å²	36	77.2 Å²	77.2	30%	0.298	41%	0.406	S	S	.	.	H	α-helix	trans	-62.6	-44.9	176.2	0	0	0	0	0	111.6	E445 D446 V447 V451 A452 L453 L701	E445-A449 PolarHBondContact O-N 3.08Å; D446-A449 WeakPolarHBondContact O-CB 3.18Å; D446-A449 PolarHBondContact O-N 2.76Å; V447-A449 VanDerWaalsContact C-N 3.34Å; V447-A449 PolarHBondContact O-N 3Å; A449-V451 PolarHBondContact O-N 3.38Å; A449-A452 PolarHBondContact O-N 2.73Å; A449-L453 WeakPolarHBondContact O-CG 2.79Å; A449-L453 PolarHBondContact O-N 3.44Å; A449-L701 HydrophobicContact CB-CD1 4.34Å
450	I	87.1	Confident	79.8	Confident	2 Å²	2	74.7 Å²	74.7	1%	0.01	39%	0.391	C	S	.	.	H	α-helix	trans	-58.4	-45.9	176	-73	166.6	0	0	0	111.3	L442 D446 V447 L453 S454 K704 Y705 Y708 L764	L442-I450 HydrophobicContact CD2-CD1 3.75Å; D446-I450 VanDerWaalsContact O-CG1 3.29Å; D446-I450 WeakPolarHBondContact O-CG1 3.35Å; D446-I450 PolarHBondContact O-N 2.89Å; V447-I450 PolarHBondContact O-N 3.32Å; I450-L453 PolarHBondContact O-N 3.45Å; I450-S454 WeakPolarHBondContact O-CB 3.16Å; I450-S454 PolarHBondContact O-N 3.06Å; I450-S454 PolarHBondContact O-OG 3.38Å; I450-K704 HydrophobicContact CD1-CB 4.32Å; I450-Y705 HydrophobicContact CB-CD2 4.27Å; I450-Y705 HydrophobicContact CG1-CD2 4.17Å; I450-Y705 HydrophobicContact CG2-CD2 3.61Å; I450-Y705 HydrophobicContact CG2-CE2 3.82Å; I450-Y708 HydrophobicContact CD1-CG 4.33Å; I450-Y708 HydrophobicContact CG2-CD1 3.78Å; I450-Y708 HydrophobicContact CG2-CE1 4.11Å; I450-Y708 HydrophobicContact CG2-CG 4.24Å; I450-L764 HydrophobicContact CG2-CD1 3.93Å
451	V	87.8	Confident	81.3	Confident	49 Å²	49	74.2 Å²	74.2	30%	0.297	37%	0.374	S	S	.	.	H	α-helix	trans	-70.3	-31.8	179.8	173	0	0	0	0	112.3	V447 K448 A449 S454 K455	V447-V451 HydrophobicContact CG1-CG2 4.49Å; V447-V451 WeakPolarHBondContact O-CG2 3.14Å; V447-V451 PolarHBondContact O-N 2.83Å; K448-V451 PolarHBondContact O-N 3.15Å; A449-V451 PolarHBondContact O-N 3.38Å; V451-S454 PolarHBondContact O-OG 2.96Å; V451-S454 VanDerWaalsContact O-OG 3.13Å; V451-K455 WeakPolarHBondContact O-CG 2.99Å
452	A	88.3	Confident	82.8	Confident	61 Å²	61	69.7 Å²	69.7	50%	0.504	35%	0.35	S	S	.	.	H	α-helix	trans	-66.8	-44	173.4	0	0	0	0	0	110.9	K448 A449 K455	K448-A452 WeakPolarHBondContact O-CB 3.35Å; K448-A452 PolarHBondContact O-N 2.96Å; A449-A452 PolarHBondContact O-N 2.73Å; A452-K455 PolarHBondContact O-N 3.39Å
453	L	85.5	Confident	84	Confident	41 Å²	41	68.2 Å²	68.2	22%	0.215	34%	0.343	C	S	.	.	H	α-helix	trans	-68.1	-38.2	179.4	-72.4	166.2	0	0	0	113	A449 I450 K455 D456 L701	A449-L453 WeakPolarHBondContact O-CG 2.79Å; A449-L453 PolarHBondContact O-N 3.44Å; I450-L453 PolarHBondContact O-N 3.45Å; L453-K455 PolarHBondContact O-N 3.34Å; L453-D456 WeakPolarHBondContact O-CB 3.36Å; L453-D456 PolarHBondContact O-N 2.83Å; L453-L701 HydrophobicContact CD1-CD1 3.9Å; L453-L701 HydrophobicContact CD1-CD2 3.28Å; L453-L701 HydrophobicContact CD1-CG 4.24Å
454	S	86.2	Confident	84.8	Confident	19 Å²	19	66.5 Å²	66.5	13%	0.133	33%	0.33	C	S	.	.	H	α-helix	trans	-67.5	-22.3	-178.7	68.9	0	0	0	0	113.7	I450 V451 D456	I450-S454 WeakPolarHBondContact O-CB 3.16Å; I450-S454 PolarHBondContact O-N 3.06Å; I450-S454 PolarHBondContact O-OG 3.38Å; V451-S454 PolarHBondContact O-OG 2.96Å; V451-S454 VanDerWaalsContact O-OG 3.13Å; S454-D456 VanDerWaalsContact C-N 3.25Å; S454-D456 PolarHBondContact O-N 2.98Å
455	K	86	Confident	85.1	Confident	161 Å²	161	62.4 Å²	62.4	70%	0.7	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-15.9	177.2	-73.7	175.4	-178.3	179.1	0	113.2	V451 A452 L453 E457	V451-K455 WeakPolarHBondContact O-CG 2.99Å; A452-K455 PolarHBondContact O-N 3.39Å; L453-K455 PolarHBondContact O-N 3.34Å; K455-E457 PolarHBondContact O-N 3.3Å
456	D	85.5	Confident	85.4	Confident	60 Å²	60	55.7 Å²	55.7	32%	0.321	28%	0.282	S	S	.	.			trans	-70.4	124.1	176.3	-73.9	-17.6	0	0	0	110.6	L453 S454 R458 I459 R462	L453-D456 WeakPolarHBondContact O-CB 3.36Å; L453-D456 PolarHBondContact O-N 2.83Å; S454-D456 VanDerWaalsContact C-N 3.25Å; S454-D456 PolarHBondContact O-N 2.98Å; D456-R458 PolarHBondContact O-N 3.03Å; D456-R458 VanDerWaalsContact O-N 3.1Å; D456-I459 WeakPolarHBondContact O-CB 3.47Å; D456-I459 WeakPolarHBondContact O-CG2 3.48Å; D456-I459 PolarHBondContact O-N 2.97Å; D456-I459 VanDerWaalsContact O-N 3.12Å; D456-R462 IonicContact OD2-CZ 2.92Å; D456-R462 IonicContact OD2-NH1 3.36Å; D456-R462 PolarHBondContact OD2-NH1 3.48Å; D456-R462 IonicContact OD2-NH2 3.78Å
457	E	80.3	Confident	85.7	Confident	160 Å²	160	54.2 Å²	54.2	75%	0.748	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-20.7	-179.1	-67.4	-174.2	156.8	0	0	113.5	K455	K455-E457 PolarHBondContact O-N 3.3Å
458	R	82.9	Confident	85.6	Confident	164 Å²	164	53 Å²	53	62%	0.619	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	16.5	179.1	-62.3	-172.5	-178.1	176	-2	113.9	D456 G460 E461 R462	D456-R458 PolarHBondContact O-N 3.03Å; D456-R458 VanDerWaalsContact O-N 3.1Å; R458-G460 VanDerWaalsContact C-N 3.26Å; R458-G460 PolarHBondContact O-N 2.97Å; R458-E461 PolarHBondContact O-N 3.37Å; R458-R462 PolarHBondContact O-N 2.84Å
459	I	86.5	Confident	85.3	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-60.6	-32.9	-178.1	-171.8	60.7	0	0	0	113.3	D456 E461 R462 I463 I697 H763	D456-I459 WeakPolarHBondContact O-CB 3.47Å; D456-I459 WeakPolarHBondContact O-CG2 3.48Å; D456-I459 PolarHBondContact O-N 2.97Å; D456-I459 VanDerWaalsContact O-N 3.12Å; I459-E461 PolarHBondContact O-N 2.74Å; I459-R462 HydrophobicContact CD1-CB 4.42Å; I459-R462 WeakPolarHBondContact O-CB 3.31Å; I459-R462 PolarHBondContact O-N 3.46Å; I459-I463 HydrophobicContact CD1-CD1 4.23Å; I459-I463 HydrophobicContact CD1-CG1 4.24Å; I459-I463 HydrophobicContact CG1-CD1 3.8Å; I459-I463 HydrophobicContact CG1-CG1 4.26Å; I459-I463 WeakPolarHBondContact O-CG1 3.35Å; I459-I463 PolarHBondContact O-N 2.77Å; I459-I697 HydrophobicContact CD1-CD1 3.87Å; I459-H763 WeakPolarHBondContact CG2-CE1 3.33Å; I459-H763 WeakPolarHBondContact CG2-ND1 3.39Å
460	G	83.8	Confident	85.1	Confident	6 Å²	6	51 Å²	51	6%	0.062	27%	0.268	C	S	.	.	H	α-helix	trans	-60.4	-47.4	178.7	0	0	0	0	0	113.1	R458 R462 I463 F464 M762	R458-G460 VanDerWaalsContact C-N 3.26Å; R458-G460 PolarHBondContact O-N 2.97Å; G460-R462 PolarHBondContact O-N 2.92Å; G460-I463 PolarHBondContact O-N 2.86Å; G460-F464 WeakPolarHBondContact O-CD1 3.33Å; G460-F464 WeakPolarHBondContact O-CD2 3.36Å; G460-F464 WeakPolarHBondContact O-CG 3.41Å; G460-F464 PolarHBondContact O-N 3.49Å; G460-M762 VanDerWaalsContact CA-CE 3.45Å
461	E	82.7	Confident	85	Confident	79 Å²	79	51.8 Å²	51.8	37%	0.369	27%	0.272	S	S	.	.	H	α-helix	trans	-65.9	-38.4	177.3	-71.9	165.4	-156.5	0	0	111.9	R458 I459 I463 F464 A465 R807	R458-E461 PolarHBondContact O-N 3.37Å; I459-E461 PolarHBondContact O-N 2.74Å; E461-I463 VanDerWaalsContact C-N 3.34Å; E461-I463 PolarHBondContact O-N 3.49Å; E461-F464 PolarHBondContact O-N 3.35Å; E461-A465 WeakPolarHBondContact O-CB 3.39Å; E461-A465 PolarHBondContact O-N 3.22Å; E461-R807 IonicContact OE1-NH1 3.96Å
462	R	86	Confident	84.8	Confident	55 Å²	55	52.3 Å²	52.3	21%	0.208	27%	0.268	C	S	.	.	H	α-helix	trans	-59	-44.9	173.4	-77.4	-177.7	-177.7	176.4	9.5	112.2	D456 R458 I459 G460 A465 S466 V694 I697	D456-R462 IonicContact OD2-CZ 2.92Å; D456-R462 IonicContact OD2-NH1 3.36Å; D456-R462 PolarHBondContact OD2-NH1 3.48Å; D456-R462 IonicContact OD2-NH2 3.78Å; R458-R462 PolarHBondContact O-N 2.84Å; I459-R462 HydrophobicContact CD1-CB 4.42Å; I459-R462 WeakPolarHBondContact O-CB 3.31Å; I459-R462 PolarHBondContact O-N 3.46Å; G460-R462 PolarHBondContact O-N 2.92Å; R462-A465 PolarHBondContact O-N 3.19Å; R462-S466 WeakPolarHBondContact O-CB 3.49Å; R462-S466 PolarHBondContact O-N 3.09Å; R462-S466 PolarHBondContact O-OG 2.77Å; R462-V694 HydrophobicContact CB-CG1 4.12Å; R462-V694 HydrophobicContact CG-CG1 3.15Å; R462-I697 HydrophobicContact CB-CD1 4.1Å; R462-I697 HydrophobicContact CB-CG1 4.32Å
463	I	88.5	Confident	84.6	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.3	-44.3	179.2	-71.8	171.2	0	0	0	110.1	I459 G460 E461 A465 S466 I467 A482 F486 I697 L702 Y705 M762	I459-I463 HydrophobicContact CD1-CD1 4.23Å; I459-I463 HydrophobicContact CD1-CG1 4.24Å; I459-I463 HydrophobicContact CG1-CD1 3.8Å; I459-I463 HydrophobicContact CG1-CG1 4.26Å; I459-I463 WeakPolarHBondContact O-CG1 3.35Å; I459-I463 PolarHBondContact O-N 2.77Å; G460-I463 PolarHBondContact O-N 2.86Å; E461-I463 VanDerWaalsContact C-N 3.34Å; E461-I463 PolarHBondContact O-N 3.49Å; I463-A465 VanDerWaalsContact C-N 3.32Å; I463-A465 PolarHBondContact O-N 2.74Å; I463-S466 WeakPolarHBondContact CA-OG 3.17Å; I463-S466 PolarHBondContact O-N 3.04Å; I463-S466 VanDerWaalsContact O-N 3.14Å; I463-S466 PolarHBondContact O-OG 3.4Å; I463-I467 HydrophobicContact CG2-CD1 3.99Å; I463-I467 WeakPolarHBondContact O-CG1 3.3Å; I463-I467 PolarHBondContact O-N 2.93Å; I463-A482 HydrophobicContact CG2-CB 4.49Å; I463-F486 HydrophobicContact CD1-CE2 4.44Å; I463-F486 HydrophobicContact CD1-CZ 4.14Å; I463-F486 HydrophobicContact CG2-CE2 4Å; I463-I697 HydrophobicContact CG1-CD1 4.01Å; I463-L702 HydrophobicContact CG1-CD1 4.34Å; I463-L702 HydrophobicContact CG2-CD1 4.3Å; I463-Y705 HydrophobicContact CD1-CD1 4.43Å; I463-Y705 HydrophobicContact CD1-CE1 3.92Å; I463-M762 HydrophobicContact CB-SD 4.26Å; I463-M762 HydrophobicContact CD1-CG 3.4Å; I463-M762 HydrophobicContact CD1-SD 4.02Å; I463-M762 HydrophobicContact CG2-SD 4.13Å
464	F	87.7	Confident	84.5	Confident	31 Å²	31	52.3 Å²	52.3	14%	0.136	27%	0.265	C	S	.	.	H	α-helix	trans	-62.3	-38.9	177.7	-56.1	-29.2	0	0	0	112.5	G460 E461 S466 I467 R479 A482 M762	G460-F464 WeakPolarHBondContact O-CD1 3.33Å; G460-F464 WeakPolarHBondContact O-CD2 3.36Å; G460-F464 WeakPolarHBondContact O-CG 3.41Å; G460-F464 PolarHBondContact O-N 3.49Å; E461-F464 PolarHBondContact O-N 3.35Å; F464-S466 VanDerWaalsContact C-N 3.34Å; F464-I467 PolarHBondContact O-N 2.81Å; F464-R479 HydrophobicContact CD1-CB 4.21Å; F464-R479 HydrophobicContact CD1-CG 4.48Å; F464-R479 HydrophobicContact CD2-CB 4.39Å; F464-R479 HydrophobicContact CD2-CG 4.46Å; F464-R479 HydrophobicContact CE1-CB 4.19Å; F464-R479 HydrophobicContact CE1-CG 3.98Å; F464-R479 HydrophobicContact CE2-CB 4.37Å; F464-R479 HydrophobicContact CE2-CG 3.95Å; F464-R479 HydrophobicContact CG-CB 4.33Å; F464-R479 HydrophobicContact CZ-CB 4.27Å; F464-R479 HydrophobicContact CZ-CG 3.69Å; F464-A482 HydrophobicContact CD1-CB 3.6Å; F464-A482 HydrophobicContact CE1-CB 3.62Å; F464-M762 HydrophobicContact CE1-CE 4.33Å; F464-M762 HydrophobicContact CE1-SD 3.84Å; F464-M762 HydrophobicContact CZ-CE 3.99Å; F464-M762 HydrophobicContact CZ-SD 4.13Å
465	A	83.3	Confident	84.4	Confident	41 Å²	41	57.5 Å²	57.5	34%	0.339	29%	0.287	S	S	.	.	H	α-helix	trans	-68.2	-32.6	175.2	0	0	0	0	0	112.8	E461 R462 I463 I467	E461-A465 WeakPolarHBondContact O-CB 3.39Å; E461-A465 PolarHBondContact O-N 3.22Å; R462-A465 PolarHBondContact O-N 3.19Å; I463-A465 VanDerWaalsContact C-N 3.32Å; I463-A465 PolarHBondContact O-N 2.74Å; A465-I467 VanDerWaalsContact C-N 3.33Å
466	S	86.4	Confident	84.4	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-73.6	-22.5	178.5	71.2	0	0	0	0	113.8	R462 I463 F464 Y521 Q699	R462-S466 WeakPolarHBondContact O-CB 3.49Å; R462-S466 PolarHBondContact O-N 3.09Å; R462-S466 PolarHBondContact O-OG 2.77Å; I463-S466 WeakPolarHBondContact CA-OG 3.17Å; I463-S466 PolarHBondContact O-N 3.04Å; I463-S466 VanDerWaalsContact O-N 3.14Å; I463-S466 PolarHBondContact O-OG 3.4Å; F464-S466 VanDerWaalsContact C-N 3.34Å; S466-Y521 PolarHBondContact O-OH 3.21Å; S466-Q699 PolarHBondContact O-NE2 3.18Å
467	I	86.9	Confident	84.6	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	26%	0.258	C	S	.	.	S	Bend	trans	-79.6	127.7	179.7	-71.5	164.4	0	0	0	110.5	I463 F464 A465 K478 A482 Y521 L702	I463-I467 HydrophobicContact CG2-CD1 3.99Å; I463-I467 WeakPolarHBondContact O-CG1 3.3Å; I463-I467 PolarHBondContact O-N 2.93Å; F464-I467 PolarHBondContact O-N 2.81Å; A465-I467 VanDerWaalsContact C-N 3.33Å; I467-K478 HydrophobicContact CG2-CB 4.44Å; I467-K478 WeakPolarHBondContact O-CD 3.47Å; I467-K478 WeakPolarHBondContact O-CE 3.43Å; I467-K478 PolarHBondContact O-NZ 2.73Å; I467-A482 HydrophobicContact CD1-CB 3.26Å; I467-Y521 HydrophobicContact CB-CE1 4.3Å; I467-Y521 HydrophobicContact CG2-CD1 4.4Å; I467-Y521 HydrophobicContact CG2-CE1 3.91Å; I467-L702 HydrophobicContact CG1-CD2 4.34Å
468	A	82.5	Confident	85.1	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.226	C	C	.	.			trans	50.4	69	-178.8	0	0	0	0	0	112.5	S470 I471 K478 F518 Y521	A468-S470 PolarHBondContact O-N 2.91Å; A468-I471 HydrophobicContact CB-CD1 4.48Å; A468-I471 PolarHBondContact O-N 3.11Å; A468-K478 PolarHBondContact O-NZ 2.67Å; A468-F518 HydrophobicContact CB-CD1 3.76Å; A468-F518 HydrophobicContact CB-CE1 3.68Å; A468-Y521 HydrophobicContact CB-CD1 4.12Å; A468-Y521 HydrophobicContact CB-CE1 4.48Å; A468-Y521 HydrophobicContact CB-CG 4.22Å; A468-Y521 PolarHBondContact N-OH 3.14Å
469	P	80.4	Confident	85.4	Confident	69 Å²	69	36.7 Å²	36.7	45%	0.448	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-18.1	-179.4	29.1	-35.6	0	0	0	112.7	I471 F664	P469-I471 VanDerWaalsContact C-N 3.32Å; P469-F664 VanDerWaalsContact O-CZ 3.28Å; P469-F664 WeakPolarHBondContact O-CZ 3.12Å
470	S	82.5	Confident	85.6	Confident	71 Å²	71	36.7 Å²	36.7	50%	0.497	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-6.6	179.6	56.5	0	0	0	0	114.4	A468 F664	A468-S470 PolarHBondContact O-N 2.91Å; S470-F664 VanDerWaalsContact O-CE1 3.24Å; S470-F664 WeakPolarHBondContact O-CE1 3.44Å
471	I	85.6	Confident	85.9	Confident	18 Å²	18	36.5 Å²	36.5	9%	0.092	20%	0.197	C	C	.	.	S	Bend	trans	-119.3	122.6	-178.4	-57.1	170.7	0	0	0	108.3	A468 P469 K478 A514 Q517 F518	A468-I471 HydrophobicContact CB-CD1 4.48Å; A468-I471 PolarHBondContact O-N 3.11Å; P469-I471 VanDerWaalsContact C-N 3.32Å; I471-K478 PolarHBondContact O-NZ 2.72Å; I471-A514 HydrophobicContact CD1-CB 3.91Å; I471-A514 HydrophobicContact CG1-CB 4.23Å; I471-A514 HydrophobicContact CG2-CB 4.49Å; I471-Q517 HydrophobicContact CD1-CB 4.02Å; I471-F518 HydrophobicContact CB-CE1 4.28Å; I471-F518 HydrophobicContact CB-CZ 4.07Å; I471-F518 HydrophobicContact CD1-CD1 3.71Å; I471-F518 HydrophobicContact CD1-CD2 3.81Å; I471-F518 HydrophobicContact CD1-CE1 3.58Å; I471-F518 HydrophobicContact CD1-CE2 3.7Å; I471-F518 HydrophobicContact CD1-CG 3.82Å; I471-F518 HydrophobicContact CD1-CZ 3.58Å; I471-F518 HydrophobicContact CG1-CZ 4.43Å; I471-F518 HydrophobicContact CG2-CE1 4.39Å; I471-F518 HydrophobicContact CG2-CE2 4.19Å; I471-F518 HydrophobicContact CG2-CZ 3.69Å
472	Y	84	Confident	86.4	Confident	59 Å²	59	32.8 Å²	32.8	23%	0.231	18%	0.179	C	C	.	.			trans	-77.6	140	175	179.8	-107.1	0	0	0	110.9	M660 N690	Y472-M660 HydrophobicContact CE1-CB 3.91Å; Y472-M660 PolarHBondContact OH-SD 3.01Å; Y472-N690 PolarHBondContact OH-ND2 2.69Å
473	G	82.5	Confident	86.7	Confident	30 Å²	30	30.2 Å²	30.2	31%	0.309	17%	0.169	S	C	.	.	S	Bend	trans	74.2	-150.4	178.5	0	0	0	0	0	114.5	E475 K478	G473-E475 VanDerWaalsContact C-N 3.33Å; G473-E475 PolarHBondContact O-N 3.45Å; G473-K478 VanDerWaalsContact O-CE 3.29Å; G473-K478 WeakPolarHBondContact O-CE 3.35Å
474	H	84.8	Confident	86.8	Confident	73 Å²	73	30.2 Å²	30.2	34%	0.338	17%	0.17	S	C	.	.			trans	50.5	42.8	-179.5	-60.9	-62.1	0	0	0	115.2	D476 I477 K478 F518 V649	H474-D476 PolarHBondContact O-N 3.32Å; H474-I477 HydrophobicContact CB-CB 4.31Å; H474-I477 HydrophobicContact CB-CD1 3.96Å; H474-I477 HydrophobicContact CB-CG1 4.22Å; H474-I477 PolarHBondContact O-N 3.28Å; H474-I477 VanDerWaalsContact O-N 3.1Å; H474-K478 WeakPolarHBondContact O-CG 3.49Å; H474-K478 PolarHBondContact O-N 3.33Å; H474-F518 HydrophobicContact CB-CZ 4.16Å; H474-V649 VanDerWaalsContact CE1-CG1 3.44Å; H474-V649 WeakPolarHBondContact CE1-CG1 3.4Å
475	E	84.3	Confident	87	Confident	127 Å²	127	28.8 Å²	28.8	59%	0.593	16%	0.164	S	C	*	.	H	α-helix	trans	-59.1	-32.9	-179.7	-63.3	-168.5	172.1	0	0	113.2	G473 I477 K478 R479	G473-E475 VanDerWaalsContact C-N 3.33Å; G473-E475 PolarHBondContact O-N 3.45Å; E475-I477 VanDerWaalsContact C-N 3.33Å; E475-I477 PolarHBondContact O-N 3.39Å; E475-K478 PolarHBondContact O-N 3.17Å; E475-R479 VanDerWaalsContact O-CB 3.27Å; E475-R479 WeakPolarHBondContact O-CB 3.46Å; E475-R479 PolarHBondContact O-N 2.94Å
476	D	85	Confident	87.3	Confident	66 Å²	66	27 Å²	27	35%	0.353	15%	0.148	S	C	.	.	H	α-helix	trans	-62.6	-41.3	177.5	-62	-35.7	0	0	0	111.8	H474 R479 A480	H474-D476 PolarHBondContact O-N 3.32Å; D476-R479 IonicContact OD1-CZ 3.46Å; D476-R479 IonicContact OD1-NH2 3.5Å; D476-R479 PolarHBondContact OD1-NH2 3.43Å; D476-A480 PolarHBondContact O-N 3.32Å; D476-A480 VanDerWaalsContact O-N 3.1Å
477	I	89.3	Confident	87.3	Confident	11 Å²	11	27.4 Å²	27.4	6%	0.056	15%	0.152	C	C	.	.	H	α-helix	trans	-72.5	-43.5	178	-52	179.2	0	0	0	110.1	H474 E475 R479 A480 L481 L507 C647 V649	H474-I477 HydrophobicContact CB-CB 4.31Å; H474-I477 HydrophobicContact CB-CD1 3.96Å; H474-I477 HydrophobicContact CB-CG1 4.22Å; H474-I477 PolarHBondContact O-N 3.28Å; H474-I477 VanDerWaalsContact O-N 3.1Å; E475-I477 VanDerWaalsContact C-N 3.33Å; E475-I477 PolarHBondContact O-N 3.39Å; I477-R479 VanDerWaalsContact C-N 3.27Å; I477-R479 PolarHBondContact O-N 2.88Å; I477-A480 PolarHBondContact O-N 3Å; I477-L481 HydrophobicContact CG2-CD1 4.07Å; I477-L481 HydrophobicContact CG2-CG 4.35Å; I477-L481 WeakPolarHBondContact O-CG 3.31Å; I477-L481 PolarHBondContact O-N 3.23Å; I477-L507 HydrophobicContact CG2-CD2 3.62Å; I477-C647 HydrophobicContact CG1-CB 4.19Å; I477-V649 HydrophobicContact CD1-CG1 4.48Å; I477-V649 HydrophobicContact CD1-CG2 3.45Å; I477-V649 VanDerWaalsContact CD1-CG2 3.45Å
478	K	90.4	Very high	87.3	Confident	19 Å²	19	27.6 Å²	27.6	8%	0.083	15%	0.154	C	C	.	.	H	α-helix	trans	-58.5	-41.8	177.1	-69.3	-178.8	-179.9	-163	0	111.3	I467 A468 I471 G473 H474 E475 L481 A482 F518	I467-K478 HydrophobicContact CG2-CB 4.44Å; I467-K478 WeakPolarHBondContact O-CD 3.47Å; I467-K478 WeakPolarHBondContact O-CE 3.43Å; I467-K478 PolarHBondContact O-NZ 2.73Å; A468-K478 PolarHBondContact O-NZ 2.67Å; I471-K478 PolarHBondContact O-NZ 2.72Å; G473-K478 VanDerWaalsContact O-CE 3.29Å; G473-K478 WeakPolarHBondContact O-CE 3.35Å; H474-K478 WeakPolarHBondContact O-CG 3.49Å; H474-K478 PolarHBondContact O-N 3.33Å; E475-K478 PolarHBondContact O-N 3.17Å; K478-L481 PolarHBondContact O-N 3.23Å; K478-A482 VanDerWaalsContact O-CB 3.3Å; K478-A482 WeakPolarHBondContact O-CB 3.4Å; K478-A482 PolarHBondContact O-N 3.08Å; K478-F518 HydrophobicContact CG-CE1 4.15Å
479	R	89.4	Confident	87.5	Confident	13 Å²	13	29.3 Å²	29.3	5%	0.049	16%	0.163	C	C	.	.	H	α-helix	trans	-63.7	-44.9	174.9	175.2	165.8	48	136.4	-0.5	112.4	F464 E475 D476 I477 A482 L483 M775 V779 E782	F464-R479 HydrophobicContact CD1-CB 4.21Å; F464-R479 HydrophobicContact CD1-CG 4.48Å; F464-R479 HydrophobicContact CD2-CB 4.39Å; F464-R479 HydrophobicContact CD2-CG 4.46Å; F464-R479 HydrophobicContact CE1-CB 4.19Å; F464-R479 HydrophobicContact CE1-CG 3.98Å; F464-R479 HydrophobicContact CE2-CB 4.37Å; F464-R479 HydrophobicContact CE2-CG 3.95Å; F464-R479 HydrophobicContact CG-CB 4.33Å; F464-R479 HydrophobicContact CZ-CB 4.27Å; F464-R479 HydrophobicContact CZ-CG 3.69Å; E475-R479 VanDerWaalsContact O-CB 3.27Å; E475-R479 WeakPolarHBondContact O-CB 3.46Å; E475-R479 PolarHBondContact O-N 2.94Å; D476-R479 IonicContact OD1-CZ 3.46Å; D476-R479 IonicContact OD1-NH2 3.5Å; D476-R479 PolarHBondContact OD1-NH2 3.43Å; I477-R479 VanDerWaalsContact C-N 3.27Å; I477-R479 PolarHBondContact O-N 2.88Å; R479-A482 WeakPolarHBondContact O-CB 3.49Å; R479-A482 PolarHBondContact O-N 2.92Å; R479-L483 HydrophobicContact CG-CD1 4.22Å; R479-L483 VanDerWaalsContact O-CG 3.29Å; R479-L483 WeakPolarHBondContact O-CG 3.24Å; R479-L483 PolarHBondContact O-N 3.33Å; R479-M775 HydrophobicContact CG-SD 4.35Å; R479-V779 HydrophobicContact CG-CG2 3.93Å; R479-E782 IonicContact CZ-OE2 2.86Å; R479-E782 IonicContact NH1-OE2 3.71Å; R479-E782 PolarHBondContact NH1-OE2 2.85Å; R479-E782 IonicContact NH2-OE1 2.78Å; R479-E782 IonicContact NH2-OE2 3.93Å; R479-E782 PolarHBondContact NH2-OE2 3.29Å
480	A	90.6	Very high	87.8	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-61.5	-45.2	175.9	0	0	0	0	0	112.4	D476 I477 L483 S484 V645	D476-A480 PolarHBondContact O-N 3.32Å; D476-A480 VanDerWaalsContact O-N 3.1Å; I477-A480 PolarHBondContact O-N 3Å; A480-L483 PolarHBondContact O-N 3.29Å; A480-S484 WeakPolarHBondContact O-CB 3.46Å; A480-S484 PolarHBondContact O-N 2.72Å; A480-V645 HydrophobicContact CB-CG1 3.89Å
481	L	91.9	Very high	87.9	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-64.4	-39.6	176.8	-71.1	174.6	0	0	0	111.8	I477 K478 S484 L485 V505 F518 M613	I477-L481 HydrophobicContact CG2-CD1 4.07Å; I477-L481 HydrophobicContact CG2-CG 4.35Å; I477-L481 WeakPolarHBondContact O-CG 3.31Å; I477-L481 PolarHBondContact O-N 3.23Å; K478-L481 PolarHBondContact O-N 3.23Å; L481-S484 PolarHBondContact O-N 3.09Å; L481-L485 WeakPolarHBondContact O-CB 3.47Å; L481-L485 WeakPolarHBondContact O-CG 3.41Å; L481-L485 PolarHBondContact O-N 3.01Å; L481-V505 HydrophobicContact CD2-CG1 4.33Å; L481-F518 HydrophobicContact CD1-CB 4.02Å; L481-F518 HydrophobicContact CD1-CD1 3.91Å; L481-F518 HydrophobicContact CD1-CG 4.14Å; L481-M613 HydrophobicContact CD2-SD 3.89Å
482	A	92.1	Very high	87.8	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-57.7	-51.8	174.6	0	0	0	0	0	111.3	I463 F464 I467 K478 R479 S484 L485 F486	I463-A482 HydrophobicContact CG2-CB 4.49Å; F464-A482 HydrophobicContact CD1-CB 3.6Å; F464-A482 HydrophobicContact CE1-CB 3.62Å; I467-A482 HydrophobicContact CD1-CB 3.26Å; K478-A482 VanDerWaalsContact O-CB 3.3Å; K478-A482 WeakPolarHBondContact O-CB 3.4Å; K478-A482 PolarHBondContact O-N 3.08Å; R479-A482 WeakPolarHBondContact O-CB 3.49Å; R479-A482 PolarHBondContact O-N 2.92Å; A482-S484 VanDerWaalsContact C-N 3.28Å; A482-S484 PolarHBondContact O-N 3.24Å; A482-L485 WeakPolarHBondContact O-CB 3.5Å; A482-L485 PolarHBondContact O-N 3.33Å; A482-L485 VanDerWaalsContact O-N 3.13Å; A482-F486 VanDerWaalsContact O-CD2 3.26Å; A482-F486 WeakPolarHBondContact O-CD2 3.24Å; A482-F486 PolarHBondContact O-N 3.47Å; A482-F486 VanDerWaalsContact O-N 3.15Å
483	L	91.6	Very high	87.4	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-61.5	-39.6	-179.9	-65.8	165.3	0	0	0	111.7	R479 A480 F486 G487 A758 H759 M775 V779	R479-L483 HydrophobicContact CG-CD1 4.22Å; R479-L483 VanDerWaalsContact O-CG 3.29Å; R479-L483 WeakPolarHBondContact O-CG 3.24Å; R479-L483 PolarHBondContact O-N 3.33Å; A480-L483 PolarHBondContact O-N 3.29Å; L483-F486 PolarHBondContact O-N 2.87Å; L483-G487 PolarHBondContact O-N 3.36Å; L483-A758 HydrophobicContact CB-CB 4.36Å; L483-A758 HydrophobicContact CD2-CB 4.2Å; L483-A758 WeakPolarHBondContact O-CB 3.3Å; L483-H759 HydrophobicContact CD2-CB 4.01Å; L483-M775 HydrophobicContact CD1-CE 3.48Å; L483-M775 VanDerWaalsContact CD1-CE 3.48Å; L483-M775 HydrophobicContact CD1-SD 4.12Å; L483-M775 HydrophobicContact CD2-CE 3.7Å; L483-M775 HydrophobicContact CG-CE 4.21Å; L483-V779 HydrophobicContact CD1-CG1 4.43Å; L483-V779 HydrophobicContact CD1-CG2 4.12Å
484	S	92.1	Very high	86.9	Confident	1 Å²	1	37 Å²	37	1%	0.007	22%	0.216	C	C	.	.	H	α-helix	trans	-66	-38.1	175.7	-178.4	0	0	0	0	112.4	A480 L481 A482 G487 I503 T611 M613	A480-S484 WeakPolarHBondContact O-CB 3.46Å; A480-S484 PolarHBondContact O-N 2.72Å; L481-S484 PolarHBondContact O-N 3.09Å; A482-S484 VanDerWaalsContact C-N 3.28Å; A482-S484 PolarHBondContact O-N 3.24Å; S484-G487 PolarHBondContact O-N 3.36Å; S484-I503 PolarHBondContact OG-O 3.25Å; S484-T611 WeakPolarHBondContact OG-CG2 3.27Å; S484-M613 WeakPolarHBondContact OG-CE 3.42Å
485	L	90.8	Very high	86.4	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-62.3	-42.3	176.1	-84.6	173.8	0	0	0	112.9	L481 A482 V522 A526 M613 K710	L481-L485 WeakPolarHBondContact O-CB 3.47Å; L481-L485 WeakPolarHBondContact O-CG 3.41Å; L481-L485 PolarHBondContact O-N 3.01Å; A482-L485 WeakPolarHBondContact O-CB 3.5Å; A482-L485 PolarHBondContact O-N 3.33Å; A482-L485 VanDerWaalsContact O-N 3.13Å; L485-V522 HydrophobicContact CD2-CG1 3.93Å; L485-A526 HydrophobicContact CD2-CB 4.02Å; L485-M613 HydrophobicContact CD2-CE 4.38Å; L485-M613 HydrophobicContact CG-CE 4.34Å; L485-K710 WeakPolarHBondContact O-CE 3.21Å; L485-K710 PolarHBondContact O-NZ 2.91Å
486	F	89.8	Confident	86	Confident	3 Å²	3	38.6 Å²	38.6	1%	0.013	24%	0.237	C	C	.	.	H	α-helix	trans	-73.4	-34.8	175.2	-74.5	-83.4	0	0	0	112.1	I463 A482 L483 Y705 I706 A709 K710 M762	I463-F486 HydrophobicContact CD1-CE2 4.44Å; I463-F486 HydrophobicContact CD1-CZ 4.14Å; I463-F486 HydrophobicContact CG2-CE2 4Å; A482-F486 VanDerWaalsContact O-CD2 3.26Å; A482-F486 WeakPolarHBondContact O-CD2 3.24Å; A482-F486 PolarHBondContact O-N 3.47Å; A482-F486 VanDerWaalsContact O-N 3.15Å; L483-F486 PolarHBondContact O-N 2.87Å; F486-Y705 AromaticContact CE1-CD1 3.64Å; F486-Y705 HydrophobicContact CE1-CD1 3.64Å; F486-Y705 AromaticContact CE1-CE1 3.71Å; F486-Y705 HydrophobicContact CE1-CE1 3.71Å; F486-Y705 AromaticContact CZ-CD1 3.68Å; F486-Y705 HydrophobicContact CZ-CD1 3.68Å; F486-Y705 AromaticContact CZ-CE1 3.81Å; F486-Y705 HydrophobicContact CZ-CE1 3.81Å; F486-I706 HydrophobicContact CE1-CB 4.37Å; F486-I706 HydrophobicContact CE1-CG1 3.91Å; F486-I706 HydrophobicContact CE2-CG1 4.21Å; F486-I706 HydrophobicContact CZ-CG1 3.7Å; F486-A709 HydrophobicContact CD1-CB 3.86Å; F486-A709 HydrophobicContact CE1-CB 3.83Å; F486-K710 VanDerWaalsContact O-CE 3.25Å; F486-K710 WeakPolarHBondContact O-CE 3.42Å; F486-M762 HydrophobicContact CD2-CB 4.28Å; F486-M762 HydrophobicContact CD2-CG 4.29Å; F486-M762 HydrophobicContact CE2-CB 4.38Å; F486-M762 HydrophobicContact CE2-CG 3.96Å; F486-M762 HydrophobicContact CG-CB 4.45Å; F486-M762 HydrophobicContact CZ-CG 4.19Å
487	G	86.9	Confident	85.5	Confident	8 Å²	8	41.8 Å²	41.8	8%	0.082	25%	0.25	C	S	.	.			trans	72	166	178.7	0	0	0	0	0	113.7	L483 S484 A758	L483-G487 PolarHBondContact O-N 3.36Å; S484-G487 PolarHBondContact O-N 3.36Å; G487-A758 WeakPolarHBondContact O-CA 3.38Å; G487-A758 WeakPolarHBondContact O-CB 3.37Å
488	G	85.7	Confident	85	Confident	6 Å²	6	46.7 Å²	46.7	6%	0.062	27%	0.271	C	S	.	.			trans	-88.3	-166	174.4	0	0	0	0	0	112.8	G501 K761	G488-G501 CarbonylContact C-O 3.57Å; G488-G501 WeakPolarHBondContact CA-O 3.11Å; G488-G501 PolarHBondContact N-O 2.92Å; G488-K761 PolarHBondContact O-NZ 3.08Å
489	E	87.8	Confident	84.7	Confident	37 Å²	37	48.2 Å²	48.2	17%	0.173	28%	0.282	C	S	.	.			trans	-105.6	125.3	174.6	-170.6	64	-166.9	0	0	111.3	K491 H714 E757 K761	E489-K491 PolarHBondContact O-N 3.22Å; E489-H714 IonicContact OE1-CE1 2.55Å; E489-H714 IonicContact OE1-CG 3.91Å; E489-H714 IonicContact OE1-ND1 3.4Å; E489-H714 PolarHBondContact OE1-ND1 2.81Å; E489-H714 IonicContact OE2-ND1 3.96Å; E489-H714 PolarHBondContact OE2-ND1 3.03Å; E489-E757 PolarHBondContact N-OE2 2.86Å; E489-K761 WeakPolarHBondContact OE2-CE 3.49Å; E489-K761 IonicContact OE2-NZ 2.64Å; E489-K761 PolarHBondContact OE2-NZ 2.72Å
490	P	87.1	Confident	84.6	Confident	73 Å²	73	48.8 Å²	48.8	47%	0.474	28%	0.284	S	S	.	.			trans	-72.8	125.4	173.9	29.5	-33	0	0	0	110.4
491	K	84.9	Confident	84.3	Confident	67 Å²	67	48.9 Å²	48.9	29%	0.291	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-114.7	141.8	-176.4	-63.6	177.7	-171.7	176.9	0	111.6	E489 P493 V499 E757	E489-K491 PolarHBondContact O-N 3.22Å; K491-P493 VanDerWaalsContact C-CD 3.49Å; K491-P493 WeakPolarHBondContact O-CD 3.21Å; K491-V499 HydrophobicContact CB-CB 4.5Å; K491-V499 PolarHBondContact N-O 3.01Å; K491-V499 PolarHBondContact O-N 3.41Å; K491-E757 WeakPolarHBondContact CE-OE1 3.42Å; K491-E757 IonicContact NZ-OE1 2.8Å; K491-E757 PolarHBondContact NZ-OE1 2.86Å
492	N	82.6	Confident	84.1	Confident	104 Å²	104	50.2 Å²	50.2	56%	0.556	29%	0.292	S	S	*	.			trans	-119.2	79.4	173.2	-167.9	7.2	0	0	0	110.7	G494 G495	N492-G494 PolarHBondContact O-N 2.88Å; N492-G495 WeakPolarHBondContact OD1-CA 3.35Å; N492-G495 PolarHBondContact OD1-N 2.93Å
493	P	74.7	Confident	84.1	Confident	78 Å²	78	50.3 Å²	50.3	51%	0.506	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-62.2	107.9	173.8	24.3	-34.2	0	0	0	111	K491 G495 H497 V499	K491-P493 VanDerWaalsContact C-CD 3.49Å; K491-P493 WeakPolarHBondContact O-CD 3.21Å; P493-G495 PolarHBondContact O-N 2.83Å; P493-G495 VanDerWaalsContact O-N 3.1Å; P493-H497 WeakPolarHBondContact CD-O 3.44Å; P493-H497 WeakPolarHBondContact CG-O 3.4Å; P493-V499 HydrophobicContact CG-CG2 4.15Å
494	G	72.9	Confident	84.2	Confident	85 Å²	85	50.4 Å²	50.4	88%	0.876	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	64	17.6	168	0	0	0	0	0	116.2	N492 K496	N492-G494 PolarHBondContact O-N 2.88Å; G494-K496 VanDerWaalsContact C-N 3.3Å; G494-K496 PolarHBondContact O-N 3.38Å
495	G	73.9	Confident	84.3	Confident	60 Å²	60	50.4 Å²	50.4	62%	0.619	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	77.9	-1.9	172.4	0	0	0	0	0	116.6	N492 P493	N492-G495 WeakPolarHBondContact OD1-CA 3.35Å; N492-G495 PolarHBondContact OD1-N 2.93Å; P493-G495 PolarHBondContact O-N 2.83Å; P493-G495 VanDerWaalsContact O-N 3.1Å
496	K	75.6	Confident	84.4	Confident	174 Å²	174	50.4 Å²	50.4	76%	0.757	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-32.1	-174	-160.7	174	-176.9	-179.9	0	114.3	G494	G494-K496 VanDerWaalsContact C-N 3.3Å; G494-K496 PolarHBondContact O-N 3.38Å
497	H	75.6	Confident	84.6	Confident	134 Å²	134	50.3 Å²	50.3	62%	0.62	29%	0.293	S	S	*	.			trans	-130.8	114.4	179.2	-63.7	-66.3	0	0	0	109	P493	P493-H497 WeakPolarHBondContact CD-O 3.44Å; P493-H497 WeakPolarHBondContact CG-O 3.4Å
498	K	78.6	Confident	84.8	Confident	114 Å²	114	50 Å²	50	50%	0.496	29%	0.289	S	S	.	.			trans	-84.9	115.2	173.2	-171.5	-178.2	176.2	-163.1	0	108.3
499	V	83.4	Confident	85	Confident	51 Å²	51	49.7 Å²	49.7	31%	0.309	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-86.5	127.5	175	-177.6	0	0	0	0	107.9	K491 P493	K491-V499 HydrophobicContact CB-CB 4.5Å; K491-V499 PolarHBondContact N-O 3.01Å; K491-V499 PolarHBondContact O-N 3.41Å; P493-V499 HydrophobicContact CG-CG2 4.15Å
500	R	87.1	Confident	85.1	Confident	25 Å²	25	48.8 Å²	48.8	9%	0.094	28%	0.283	C	S	.	.			trans	-64.1	144.8	177.8	70.6	-179.4	-168.5	-176.8	6.9	111.1	N504 M590 R642 D644 R754	R500-N504 PolarHBondContact NH1-ND2 3.21Å; R500-M590 PolarHBondContact NH1-O 3.13Å; R500-R642 PolarHBondContact NH1-O 3.4Å; R500-R642 PolarHBondContact NH2-O 3.38Å; R500-D644 IonicContact CZ-OD1 3.77Å; R500-D644 IonicContact NH2-OD1 3.42Å; R500-D644 PolarHBondContact NH2-OD1 2.86Å; R500-D644 IonicContact NH2-OD2 3.6Å; R500-R754 VanDerWaalsContact CG-NH2 3.27Å; R500-R754 PolarHBondContact O-NE 3.48Å
501	G	84.9	Confident	85.2	Confident	3 Å²	3	49.3 Å²	49.3	3%	0.031	29%	0.286	C	S	.	.			trans	-102.3	-6.4	172.4	0	0	0	0	0	113.7	G488	G488-G501 CarbonylContact C-O 3.57Å; G488-G501 WeakPolarHBondContact CA-O 3.11Å; G488-G501 PolarHBondContact N-O 2.92Å
502	D	88.8	Confident	85.2	Confident	30 Å²	30	50.1 Å²	50.1	16%	0.16	31%	0.314	C	S	.	.			trans	-80.3	141.3	-175.4	-60	-65.5	0	0	0	111.9	Q593 T611	D502-Q593 PolarHBondContact OD2-NE2 3.47Å; D502-T611 WeakPolarHBondContact CB-OG1 3.42Å; D502-T611 PolarHBondContact OD1-OG1 2.98Å; D502-T611 VanDerWaalsContact OD1-OG1 3.11Å
503	I	92.1	Very high	85.4	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	29%	0.293	C	S	.	.			trans	-112.9	104.3	-179	-59.1	173.1	0	0	0	109.1	S484 T611 D644 V645 R754 M755 A758	S484-I503 PolarHBondContact OG-O 3.25Å; I503-T611 WeakPolarHBondContact O-CG2 3.41Å; I503-D644 HydrophobicContact CG2-CB 4Å; I503-V645 HydrophobicContact CG2-CG2 4.45Å; I503-R754 HydrophobicContact CD1-CB 4.16Å; I503-R754 HydrophobicContact CG1-CB 3.92Å; I503-M755 HydrophobicContact CD1-CG 4.05Å; I503-A758 HydrophobicContact CD1-CB 3.88Å
504	N	93.4	Very high	86	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.016	28%	0.283	C	S	.	.			trans	-84	136.2	-178.8	-60.2	-36.8	0	0	0	111.6	R500 M590 V612 R642 F643 D644 V645	R500-N504 PolarHBondContact NH1-ND2 3.21Å; N504-M590 HydrophobicContact CB-CE 4.05Å; N504-M590 VanDerWaalsContact ND2-CE 3.3Å; N504-M590 WeakPolarHBondContact ND2-CE 3.29Å; N504-V612 VanDerWaalsContact CA-O 3.31Å; N504-V612 WeakPolarHBondContact CA-O 3.12Å; N504-V612 PolarHBondContact OD1-N 2.71Å; N504-R642 PolarHBondContact ND2-O 3.34Å; N504-F643 HydrophobicContact CB-CD1 3.74Å; N504-F643 HydrophobicContact CB-CE1 4.25Å; N504-D644 PolarHBondContact O-N 3.06Å; N504-V645 PolarHBondContact O-N 3.02Å; N504-V645 VanDerWaalsContact O-N 3.15Å
505	V	93.5	Very high	86.9	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.6	-178	-178	0	0	0	0	110	L481 L507 V612 M613 A614 V645	L481-V505 HydrophobicContact CD2-CG1 4.33Å; V505-L507 HydrophobicContact CG1-CD2 3.93Å; V505-V612 PolarHBondContact N-O 3.08Å; V505-M613 WeakPolarHBondContact O-CA 3.2Å; V505-A614 PolarHBondContact O-N 3.46Å; V505-V645 WeakPolarHBondContact CA-O 3.11Å; V505-V645 HydrophobicContact CG2-CB 4.39Å
506	L	93.3	Very high	87.6	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	121.4	171.4	-179.1	64.2	0	0	0	110	A614 A616 F629 L635 F643 V645 L646 C647	L506-A614 WeakPolarHBondContact CA-O 3.11Å; L506-A614 HydrophobicContact CD1-CB 3.7Å; L506-A616 HydrophobicContact CD1-CB 4.12Å; L506-F629 HydrophobicContact CD2-CE1 4.4Å; L506-F629 HydrophobicContact CD2-CZ 4.02Å; L506-L635 HydrophobicContact CD2-CD1 4.05Å; L506-F643 HydrophobicContact CB-CB 4.36Å; L506-F643 HydrophobicContact CB-CD1 3.73Å; L506-F643 HydrophobicContact CB-CD2 4.26Å; L506-F643 HydrophobicContact CB-CE1 4.03Å; L506-F643 HydrophobicContact CB-CG 3.86Å; L506-F643 HydrophobicContact CB-CZ 4.41Å; L506-F643 HydrophobicContact CD1-CZ 4.4Å; L506-F643 HydrophobicContact CD2-CD2 4.24Å; L506-F643 HydrophobicContact CD2-CE2 4.36Å; L506-V645 PolarHBondContact N-O 3.36Å; L506-L646 HydrophobicContact CB-CD2 3.89Å; L506-L646 HydrophobicContact CD2-CD2 3.94Å; L506-L646 HydrophobicContact CG-CD2 4.45Å; L506-C647 PolarHBondContact O-N 3.19Å
507	L	93.1	Very high	88.4	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	115.8	172.9	-53.3	-177.3	0	0	0	109	I477 V505 K515 F518 A614 A615 A616 C647	I477-L507 HydrophobicContact CG2-CD2 3.62Å; V505-L507 HydrophobicContact CG1-CD2 3.93Å; L507-K515 HydrophobicContact CB-CD 4.28Å; L507-F518 HydrophobicContact CD1-CB 4.36Å; L507-A614 PolarHBondContact N-O 2.86Å; L507-A615 HydrophobicContact CB-CB 4.5Å; L507-A615 CarbonylContact O-C 3.52Å; L507-A615 WeakPolarHBondContact O-CA 3.46Å; L507-A616 PolarHBondContact O-N 3.41Å; L507-C647 HydrophobicContact CD2-CB 3.66Å
508	C	91.3	Very high	89.2	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.007	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	149.1	172.3	-175.2	0	0	0	0	109.5	A616 F629 V633 C647 V648 V649	C508-A616 WeakPolarHBondContact CA-O 3.31Å; C508-F629 HydrophobicContact CB-CE2 3.65Å; C508-F629 HydrophobicContact CB-CZ 4.09Å; C508-V633 HydrophobicContact CB-CG2 4.48Å; C508-V633 WeakPolarHBondContact SG-CG2 3.45Å; C508-C647 PolarHBondContact N-O 3.26Å; C508-V648 CarbonylContact O-C 3.58Å; C508-V648 WeakPolarHBondContact O-CA 3.14Å; C508-V649 PolarHBondContact O-N 3.43Å
509	G	90	Very high	89.8	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.4	-177.2	176.3	0	0	0	0	0	114.6	K515 P618 V649	G509-K515 VanDerWaalsContact C-CE 3.41Å; G509-K515 VanDerWaalsContact CA-CE 3.4Å; G509-K515 VanDerWaalsContact N-CE 3.26Å; G509-K515 VanDerWaalsContact O-CE 3.32Å; G509-K515 WeakPolarHBondContact O-CE 3.31Å; G509-K515 PolarHBondContact O-NZ 2.94Å; G509-P618 WeakPolarHBondContact O-CD 3.38Å; G509-V649 WeakPolarHBondContact CA-O 3.39Å
510	D	90.4	Very high	90.2	Very high	18 Å²	18	27 Å²	27	10%	0.096	17%	0.168	C	C	.	.			trans	-67.6	150	-175.2	-54.2	-39.6	0	0	0	111.8	T513 R622 Y623 V649 D651	D510-T513 HydrophobicContact CB-CG2 4.16Å; D510-T513 WeakPolarHBondContact O-CG2 3.41Å; D510-T513 PolarHBondContact O-OG1 2.88Å; D510-R622 VanDerWaalsContact OD1-CA 3.27Å; D510-R622 WeakPolarHBondContact OD1-CA 3.38Å; D510-Y623 PolarHBondContact OD1-N 2.81Å; D510-V649 PolarHBondContact N-O 2.92Å; D510-D651 PolarHBondContact OD2-N 3.41Å; D510-D651 VanDerWaalsContact OD2-N 3.09Å
511	P	89.3	Confident	90.4	Very high	83 Å²	83	27.1 Å²	27.1	54%	0.539	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	140.1	171.1	27.5	-32.8	0	0	0	109.7	G621	P511-G621 WeakPolarHBondContact CD-O 3.16Å
512	G	84.9	Confident	90.7	Very high	85 Å²	85	27 Å²	27	88%	0.876	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.4	-3.7	-178.3	0	0	0	0	0	115.3	A514	G512-A514 PolarHBondContact O-N 3.14Å; G512-A514 VanDerWaalsContact O-N 3.11Å
513	T	86.4	Confident	90.7	Very high	19 Å²	19	29.4 Å²	29.4	12%	0.117	18%	0.178	C	C	.	.	S	Bend	trans	-83.6	29.1	-179.5	55.2	0	0	0	0	114.6	D510 K515 V649 D651	D510-T513 HydrophobicContact CB-CG2 4.16Å; D510-T513 WeakPolarHBondContact O-CG2 3.41Å; D510-T513 PolarHBondContact O-OG1 2.88Å; T513-K515 PolarHBondContact O-N 3.24Å; T513-K515 VanDerWaalsContact OG1-CE 3.31Å; T513-K515 WeakPolarHBondContact OG1-CE 3.4Å; T513-V649 HydrophobicContact CG2-CG1 3.97Å; T513-D651 HydrophobicContact CG2-CB 4.49Å
514	A	88.3	Confident	90.4	Very high	36 Å²	36	36.7 Å²	36.7	30%	0.298	21%	0.21	S	C	.	.	S	Bend	trans	55.9	15.3	178.4	0	0	0	0	0	117.3	I471 G512 S516 Q517 F518	I471-A514 HydrophobicContact CD1-CB 3.91Å; I471-A514 HydrophobicContact CG1-CB 4.23Å; I471-A514 HydrophobicContact CG2-CB 4.49Å; G512-A514 PolarHBondContact O-N 3.14Å; G512-A514 VanDerWaalsContact O-N 3.11Å; A514-S516 PolarHBondContact O-N 3.21Å; A514-Q517 HydrophobicContact CB-CB 4.47Å; A514-Q517 WeakPolarHBondContact O-CA 3.31Å; A514-Q517 VanDerWaalsContact O-CB 3.31Å; A514-Q517 WeakPolarHBondContact O-CB 3.47Å; A514-Q517 PolarHBondContact O-N 3.03Å; A514-F518 PolarHBondContact O-N 2.86Å
515	K	90.1	Very high	90.1	Very high	10 Å²	10	37 Å²	37	4%	0.043	21%	0.212	C	C	.	.	H	α-helix	trans	-54.4	-47.7	-178.2	-57.4	-171.6	-141.5	142.2	0	114.6	L507 G509 T513 Q517 F518 L519 A615 A616 N617	L507-K515 HydrophobicContact CB-CD 4.28Å; G509-K515 VanDerWaalsContact C-CE 3.41Å; G509-K515 VanDerWaalsContact CA-CE 3.4Å; G509-K515 VanDerWaalsContact N-CE 3.26Å; G509-K515 VanDerWaalsContact O-CE 3.32Å; G509-K515 WeakPolarHBondContact O-CE 3.31Å; G509-K515 PolarHBondContact O-NZ 2.94Å; T513-K515 PolarHBondContact O-N 3.24Å; T513-K515 VanDerWaalsContact OG1-CE 3.31Å; T513-K515 WeakPolarHBondContact OG1-CE 3.4Å; K515-Q517 PolarHBondContact O-N 3.33Å; K515-F518 WeakPolarHBondContact O-CB 3.39Å; K515-F518 PolarHBondContact O-N 2.89Å; K515-L519 PolarHBondContact O-N 3.48Å; K515-A615 HydrophobicContact CB-CB 4.3Å; K515-A616 PolarHBondContact NZ-O 3.44Å; K515-N617 PolarHBondContact NZ-OD1 3.47Å
516	S	90.4	Very high	89.7	Confident	45 Å²	45	37.5 Å²	37.5	32%	0.315	22%	0.216	S	C	.	.	H	α-helix	trans	-63	-25.3	178.6	-49.2	0	0	0	0	112.2	A514 K520 D573	A514-S516 PolarHBondContact O-N 3.21Å; S516-K520 WeakPolarHBondContact O-CG 3.3Å; S516-K520 PolarHBondContact O-N 2.97Å; S516-K520 VanDerWaalsContact O-N 3.07Å; S516-D573 VanDerWaalsContact CB-OD2 3.29Å; S516-D573 WeakPolarHBondContact CB-OD2 3.18Å; S516-D573 PolarHBondContact OG-OD2 3.29Å
517	Q	90.8	Very high	88.7	Confident	103 Å²	103	39.8 Å²	39.8	48%	0.481	23%	0.232	S	C	.	.	H	α-helix	trans	-73.7	-33.1	174.7	-61.3	-65.9	-0.4	0	0	112.2	I471 A514 K515 K520 Y521	I471-Q517 HydrophobicContact CD1-CB 4.02Å; A514-Q517 HydrophobicContact CB-CB 4.47Å; A514-Q517 WeakPolarHBondContact O-CA 3.31Å; A514-Q517 VanDerWaalsContact O-CB 3.31Å; A514-Q517 WeakPolarHBondContact O-CB 3.47Å; A514-Q517 PolarHBondContact O-N 3.03Å; K515-Q517 PolarHBondContact O-N 3.33Å; Q517-K520 PolarHBondContact O-N 3.39Å; Q517-Y521 WeakPolarHBondContact O-CB 3.35Å; Q517-Y521 PolarHBondContact O-N 3.04Å
518	F	92.9	Very high	88.2	Confident	4 Å²	4	45 Å²	45	2%	0.018	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-45	170.9	-76	-65.6	0	0	0	111.3	A468 I471 H474 K478 L481 L507 A514 K515 Y521 V522	A468-F518 HydrophobicContact CB-CD1 3.76Å; A468-F518 HydrophobicContact CB-CE1 3.68Å; I471-F518 HydrophobicContact CB-CE1 4.28Å; I471-F518 HydrophobicContact CB-CZ 4.07Å; I471-F518 HydrophobicContact CD1-CD1 3.71Å; I471-F518 HydrophobicContact CD1-CD2 3.81Å; I471-F518 HydrophobicContact CD1-CE1 3.58Å; I471-F518 HydrophobicContact CD1-CE2 3.7Å; I471-F518 HydrophobicContact CD1-CG 3.82Å; I471-F518 HydrophobicContact CD1-CZ 3.58Å; I471-F518 HydrophobicContact CG1-CZ 4.43Å; I471-F518 HydrophobicContact CG2-CE1 4.39Å; I471-F518 HydrophobicContact CG2-CE2 4.19Å; I471-F518 HydrophobicContact CG2-CZ 3.69Å; H474-F518 HydrophobicContact CB-CZ 4.16Å; K478-F518 HydrophobicContact CG-CE1 4.15Å; L481-F518 HydrophobicContact CD1-CB 4.02Å; L481-F518 HydrophobicContact CD1-CD1 3.91Å; L481-F518 HydrophobicContact CD1-CG 4.14Å; L507-F518 HydrophobicContact CD1-CB 4.36Å; A514-F518 PolarHBondContact O-N 2.86Å; K515-F518 WeakPolarHBondContact O-CB 3.39Å; K515-F518 PolarHBondContact O-N 2.89Å; F518-Y521 PolarHBondContact O-N 2.91Å; F518-V522 WeakPolarHBondContact O-CG2 3.25Å; F518-V522 PolarHBondContact O-N 3.17Å
519	L	92.2	Very high	88	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-62.3	-47.4	177.4	-64.9	178.7	0	0	0	111.5	K515 Y521 V522 E523 F531 L571 D573 M613 A615	K515-L519 PolarHBondContact O-N 3.48Å; L519-Y521 VanDerWaalsContact C-N 3.25Å; L519-Y521 PolarHBondContact O-N 2.58Å; L519-V522 PolarHBondContact O-N 3.4Å; L519-V522 VanDerWaalsContact O-N 3.12Å; L519-E523 PolarHBondContact O-N 3.01Å; L519-F531 HydrophobicContact CB-CE2 4.3Å; L519-L571 HydrophobicContact CD2-CD2 4.01Å; L519-L571 WeakPolarHBondContact O-CD1 3.3Å; L519-D573 HydrophobicContact CD1-CB 4.17Å; L519-M613 HydrophobicContact CD2-CB 4.02Å; L519-A615 HydrophobicContact CD1-CB 3.78Å
520	K	91.5	Very high	87.9	Confident	95 Å²	95	47.9 Å²	47.9	41%	0.413	27%	0.272	S	S	.	.	H	α-helix	trans	-61.8	-31.4	176.4	-73.3	177.9	-179.7	-176.7	0	113.6	S516 Q517 K524	S516-K520 WeakPolarHBondContact O-CG 3.3Å; S516-K520 PolarHBondContact O-N 2.97Å; S516-K520 VanDerWaalsContact O-N 3.07Å; Q517-K520 PolarHBondContact O-N 3.39Å; K520-K524 WeakPolarHBondContact O-CG 3.32Å
521	Y	91.4	Very high	87.8	Confident	29 Å²	29	50.5 Å²	50.5	11%	0.114	28%	0.283	C	S	.	.	H	α-helix	trans	-69	-46.1	173.7	176	-94.5	0	0	0	110.8	S466 I467 A468 Q517 F518 L519 E523 K524 V525 Q699	S466-Y521 PolarHBondContact O-OH 3.21Å; I467-Y521 HydrophobicContact CB-CE1 4.3Å; I467-Y521 HydrophobicContact CG2-CD1 4.4Å; I467-Y521 HydrophobicContact CG2-CE1 3.91Å; A468-Y521 HydrophobicContact CB-CD1 4.12Å; A468-Y521 HydrophobicContact CB-CE1 4.48Å; A468-Y521 HydrophobicContact CB-CG 4.22Å; A468-Y521 PolarHBondContact N-OH 3.14Å; Q517-Y521 WeakPolarHBondContact O-CB 3.35Å; Q517-Y521 PolarHBondContact O-N 3.04Å; F518-Y521 PolarHBondContact O-N 2.91Å; L519-Y521 VanDerWaalsContact C-N 3.25Å; L519-Y521 PolarHBondContact O-N 2.58Å; Y521-E523 VanDerWaalsContact C-N 3.28Å; Y521-E523 PolarHBondContact O-N 3.45Å; Y521-K524 PolarHBondContact O-N 3.36Å; Y521-V525 HydrophobicContact CD1-CG2 4.27Å; Y521-V525 HydrophobicContact CD2-CG2 4.46Å; Y521-V525 HydrophobicContact CE1-CB 4.49Å; Y521-V525 HydrophobicContact CE1-CG2 3.71Å; Y521-V525 HydrophobicContact CE2-CG2 3.95Å; Y521-V525 WeakPolarHBondContact O-CG2 2.82Å; Y521-V525 PolarHBondContact O-N 3.28Å; Y521-Q699 VanDerWaalsContact OH-CD 3.27Å; Y521-Q699 PolarHBondContact OH-NE2 3.24Å; Y521-Q699 PolarHBondContact OH-OE1 3.27Å
522	V	91.4	Very high	87.7	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-39.6	176.3	170.7	0	0	0	0	111.5	L485 F518 L519 K524 V525 A526 V569 L571 M613	L485-V522 HydrophobicContact CD2-CG1 3.93Å; F518-V522 WeakPolarHBondContact O-CG2 3.25Å; F518-V522 PolarHBondContact O-N 3.17Å; L519-V522 PolarHBondContact O-N 3.4Å; L519-V522 VanDerWaalsContact O-N 3.12Å; V522-K524 PolarHBondContact O-N 3.12Å; V522-V525 PolarHBondContact O-N 2.94Å; V522-V525 VanDerWaalsContact O-N 3.14Å; V522-A526 HydrophobicContact CG1-CB 4.41Å; V522-A526 VanDerWaalsContact O-CB 3.3Å; V522-A526 WeakPolarHBondContact O-CB 3.27Å; V522-A526 PolarHBondContact O-N 3.3Å; V522-V569 HydrophobicContact CG1-CG1 4.42Å; V522-L571 HydrophobicContact CB-CD2 4.27Å; V522-L571 HydrophobicContact CG1-CD2 3.79Å; V522-M613 HydrophobicContact CB-SD 4.44Å; V522-M613 HydrophobicContact CG1-CE 4.14Å; V522-M613 HydrophobicContact CG1-SD 3.73Å; V522-M613 HydrophobicContact CG2-SD 4.22Å
523	E	88.4	Confident	87.9	Confident	79 Å²	79	45.9 Å²	45.9	37%	0.369	24%	0.236	S	C	.	.	H	α-helix	trans	-53.1	-40.5	175.8	-170.9	-176.4	-173.4	0	0	112.3	L519 Y521 A529 F531 L571	L519-E523 PolarHBondContact O-N 3.01Å; Y521-E523 VanDerWaalsContact C-N 3.28Å; Y521-E523 PolarHBondContact O-N 3.45Å; E523-A529 HydrophobicContact CG-CB 4.4Å; E523-F531 HydrophobicContact CG-CB 4.49Å; E523-L571 HydrophobicContact CB-CD1 3.57Å; E523-L571 HydrophobicContact CG-CD1 4.2Å
524	K	85.9	Confident	87.5	Confident	155 Å²	155	45 Å²	45	67%	0.674	23%	0.231	S	C	*	.	H	α-helix	trans	-81.3	-22.7	-179	-66.6	177	-179.2	-176.5	0	114.3	K520 Y521 V522	K520-K524 WeakPolarHBondContact O-CG 3.32Å; Y521-K524 PolarHBondContact O-N 3.36Å; V522-K524 PolarHBondContact O-N 3.12Å
525	V	87.1	Confident	87.1	Confident	9 Å²	9	49.7 Å²	49.7	6%	0.055	25%	0.246	C	C	.	.	H	α-helix	trans	-97.6	-28.8	-175.5	174.2	0	0	0	0	111.6	Y521 V522 L702 I706	Y521-V525 HydrophobicContact CD1-CG2 4.27Å; Y521-V525 HydrophobicContact CD2-CG2 4.46Å; Y521-V525 HydrophobicContact CE1-CB 4.49Å; Y521-V525 HydrophobicContact CE1-CG2 3.71Å; Y521-V525 HydrophobicContact CE2-CG2 3.95Å; Y521-V525 WeakPolarHBondContact O-CG2 2.82Å; Y521-V525 PolarHBondContact O-N 3.28Å; V522-V525 PolarHBondContact O-N 2.94Å; V522-V525 VanDerWaalsContact O-N 3.14Å; V525-L702 HydrophobicContact CG1-CD2 4.43Å; V525-I706 HydrophobicContact CG1-CD1 3.75Å
526	A	84.5	Confident	85.9	Confident	11 Å²	11	51.8 Å²	51.8	9%	0.091	27%	0.271	C	S	.	.	S	Bend	trans	-82.3	130.4	179.9	0	0	0	0	0	111.2	L485 V522 R528 A529 V569	L485-A526 HydrophobicContact CD2-CB 4.02Å; V522-A526 HydrophobicContact CG1-CB 4.41Å; V522-A526 VanDerWaalsContact O-CB 3.3Å; V522-A526 WeakPolarHBondContact O-CB 3.27Å; V522-A526 PolarHBondContact O-N 3.3Å; A526-R528 PolarHBondContact O-N 3.48Å; A526-A529 HydrophobicContact CB-CB 4.2Å; A526-V569 HydrophobicContact CB-CG2 4.23Å
527	S	73.2	Confident	84.5	Confident	49 Å²	49	49.7 Å²	49.7	34%	0.343	26%	0.256	S	S	.	.	S	Bend	trans	-66	-5.8	-176.4	62.7	0	0	0	0	115.7
528	R	81.5	Confident	83.1	Confident	111 Å²	111	47.3 Å²	47.3	42%	0.419	25%	0.251	S	S	.	.	S	Bend	trans	-161.8	86	177.3	-170.7	169.1	173	176.4	-9.9	109.1	A526 L564 D566 G568 V569	A526-R528 PolarHBondContact O-N 3.48Å; R528-L564 PolarHBondContact NE-O 3.04Å; R528-L564 PolarHBondContact NH2-O 3.33Å; R528-D566 PolarHBondContact NE-O 3.33Å; R528-D566 PolarHBondContact NH1-O 2.96Å; R528-D566 PolarHBondContact NH2-O 3.4Å; R528-G568 CarbonylContact O-C 3.52Å; R528-G568 WeakPolarHBondContact O-CA 3.47Å; R528-V569 PolarHBondContact O-N 3.27Å
529	A	87.3	Confident	81.4	Confident	30 Å²	30	48.5 Å²	48.5	25%	0.248	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	140	177	0	0	0	0	0	110.8	E523 A526 V569 L571	E523-A529 HydrophobicContact CG-CB 4.4Å; A526-A529 HydrophobicContact CB-CB 4.2Å; A529-V569 VanDerWaalsContact CA-O 3.32Å; A529-V569 WeakPolarHBondContact CA-O 3.42Å; A529-L571 HydrophobicContact CB-CD1 4.27Å
530	V	87.8	Confident	80	Confident	33 Å²	33	51.8 Å²	51.8	20%	0.2	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	124.1	168.2	-179.3	0	0	0	0	107.5	A561 L564 A565 V569 L571	V530-A561 HydrophobicContact CG1-CB 3.91Å; V530-L564 HydrophobicContact CG2-CB 4.09Å; V530-A565 HydrophobicContact CB-CB 4.23Å; V530-A565 HydrophobicContact CG2-CB 3.92Å; V530-V569 PolarHBondContact N-O 2.91Å; V530-L571 PolarHBondContact O-N 3Å
531	F	88.7	Confident	79	Confident	72 Å²	72	48.8 Å²	48.8	32%	0.316	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127	176.2	-175.9	-96.1	0	0	0	110.6	L519 E523 L571 D573	L519-F531 HydrophobicContact CB-CE2 4.3Å; E523-F531 HydrophobicContact CG-CB 4.49Å; F531-L571 HydrophobicContact CD2-CB 3.86Å; F531-L571 HydrophobicContact CD2-CD1 4.26Å; F531-D573 HydrophobicContact CE2-CB 4.26Å; F531-D573 HydrophobicContact CZ-CB 3.97Å
532	T	87.9	Confident	78.3	Confident	19 Å²	19	47.4 Å²	47.4	12%	0.117	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	149	175.2	-168.2	0	0	0	0	110.9	A537 L542 L571 I572 D573	T532-A537 HydrophobicContact CG2-CB 4.49Å; T532-A537 WeakPolarHBondContact OG1-CB 3.36Å; T532-L542 HydrophobicContact CG2-CD2 4.13Å; T532-L571 PolarHBondContact N-O 3.21Å; T532-I572 HydrophobicContact CG2-CB 4.39Å; T532-I572 HydrophobicContact CG2-CG1 3.85Å; T532-I572 HydrophobicContact CG2-CG2 4.35Å; T532-I572 WeakPolarHBondContact O-CA 3.2Å; T532-D573 PolarHBondContact O-N 3.11Å
533	T	88.8	Confident	77.9	Confident	52 Å²	52	47.7 Å²	47.7	32%	0.319	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	136.6	173.1	173	0	0	0	0	109.6	Q535 G536 A537	T533-Q535 PolarHBondContact O-N 3.04Å; T533-Q535 VanDerWaalsContact O-N 3.1Å; T533-G536 CarbonylContact O-C 3.55Å; T533-G536 PolarHBondContact O-N 2.69Å; T533-A537 WeakPolarHBondContact O-CB 3.32Å; T533-A537 PolarHBondContact O-N 2.77Å
534	G	78.1	Confident	77.5	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-25.1	-178.4	0	0	0	0	0	114.1	D573	G534-D573 PolarHBondContact N-O 3.41Å
535	Q	79.1	Confident	77.4	Confident	135 Å²	135	39.6 Å²	39.6	63%	0.631	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-29.4	176.4	-167	163.6	-4.5	0	0	113.3	T533	T533-Q535 PolarHBondContact O-N 3.04Å; T533-Q535 VanDerWaalsContact O-N 3.1Å
536	G	65.4	Low	77.2	Confident	54 Å²	54	40.9 Å²	40.9	56%	0.557	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-16.6	174.9	0	0	0	0	0	113.4	T533 S538	T533-G536 CarbonylContact O-C 3.55Å; T533-G536 PolarHBondContact O-N 2.69Å; G536-S538 VanDerWaalsContact C-N 3.3Å; G536-S538 PolarHBondContact O-N 3.02Å
537	A	61.2	Low	77.1	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.008	26%	0.256	C	S	.	.			trans	-82.2	64.5	-179.8	0	0	0	0	0	111.5	T532 T533 L542	T532-A537 HydrophobicContact CG2-CB 4.49Å; T532-A537 WeakPolarHBondContact OG1-CB 3.36Å; T533-A537 WeakPolarHBondContact O-CB 3.32Å; T533-A537 PolarHBondContact O-N 2.77Å; A537-L542 HydrophobicContact CB-CD1 3.87Å; A537-L542 HydrophobicContact CB-CD2 3.87Å; A537-L542 HydrophobicContact CB-CG 3.73Å; A537-L542 WeakPolarHBondContact O-CD1 3.34Å
538	S	60.4	Low	77.6	Confident	54 Å²	54	48.2 Å²	48.2	38%	0.378	27%	0.265	S	S	.	.			trans	-62.7	162.1	167.5	70.9	0	0	0	0	110.8	G536 V540 G541 L542	G536-S538 VanDerWaalsContact C-N 3.3Å; G536-S538 PolarHBondContact O-N 3.02Å; S538-V540 PolarHBondContact O-N 2.94Å; S538-G541 WeakPolarHBondContact O-CA 3.23Å; S538-G541 PolarHBondContact O-N 3.22Å; S538-L542 PolarHBondContact O-N 3.4Å
539	A	57.8	Low	77.5	Confident	28 Å²	28	43.6 Å²	43.6	23%	0.231	25%	0.248	C	C	.	.	H	α-helix	trans	-53.8	-30	178.9	0	0	0	0	0	112.5	T543 D582	A539-T543 WeakPolarHBondContact O-CB 3.34Å; A539-T543 PolarHBondContact O-N 2.97Å; A539-T543 VanDerWaalsContact O-N 3.1Å; A539-T543 PolarHBondContact O-OG1 3.07Å; A539-D582 WeakPolarHBondContact CA-OD1 3.44Å; A539-D582 WeakPolarHBondContact CB-OD1 3.41Å; A539-D582 PolarHBondContact N-OD1 3.3Å
540	V	61.8	Low	77	Confident	71 Å²	71	45.9 Å²	45.9	43%	0.43	26%	0.26	S	S	.	.	H	α-helix	trans	-66.7	-38.4	174.9	-175.4	0	0	0	0	110.9	S538 Y545	S538-V540 PolarHBondContact O-N 2.94Å; V540-Y545 VanDerWaalsContact CG1-CB 3.48Å; V540-Y545 HydrophobicContact CG1-CD1 3.82Å; V540-Y545 HydrophobicContact CG1-CD2 3.62Å; V540-Y545 HydrophobicContact CG1-CE1 4.39Å; V540-Y545 HydrophobicContact CG1-CE2 4.24Å; V540-Y545 HydrophobicContact CG1-CG 3.36Å; V540-Y545 WeakPolarHBondContact O-CD1 3.47Å
541	G	71.4	Confident	76.6	Confident	31 Å²	31	45.4 Å²	45.4	32%	0.32	26%	0.257	S	S	.	.	H	α-helix	trans	-83	-29.3	178.5	0	0	0	0	0	115.1	S538 G560 A561	S538-G541 WeakPolarHBondContact O-CA 3.23Å; S538-G541 PolarHBondContact O-N 3.22Å; G541-G560 WeakPolarHBondContact O-CA 3.44Å; G541-A561 PolarHBondContact O-N 3.1Å
542	L	77.4	Confident	76.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-83.5	-41.7	179.3	-73.7	171.3	0	0	0	113.4	T532 A537 S538 L562 M578 D582 I586	T532-L542 HydrophobicContact CG2-CD2 4.13Å; A537-L542 HydrophobicContact CB-CD1 3.87Å; A537-L542 HydrophobicContact CB-CD2 3.87Å; A537-L542 HydrophobicContact CB-CG 3.73Å; A537-L542 WeakPolarHBondContact O-CD1 3.34Å; S538-L542 PolarHBondContact O-N 3.4Å; L542-L562 PolarHBondContact O-N 2.92Å; L542-M578 HydrophobicContact CD1-CE 3.52Å; L542-D582 HydrophobicContact CD1-CB 3.81Å; L542-I586 HydrophobicContact CD1-CD1 4.23Å; L542-I586 HydrophobicContact CD1-CG1 4.45Å
543	T	82.6	Confident	75.8	Confident	8 Å²	8	52.1 Å²	52.1	5%	0.049	29%	0.286	C	S	.	.	S	Bend	trans	-100.8	173.6	178	72.8	0	0	0	0	110.3	A539 G560 I595	A539-T543 WeakPolarHBondContact O-CB 3.34Å; A539-T543 PolarHBondContact O-N 2.97Å; A539-T543 VanDerWaalsContact O-N 3.1Å; A539-T543 PolarHBondContact O-OG1 3.07Å; T543-G560 WeakPolarHBondContact O-CA 3.31Å; T543-G560 PolarHBondContact O-N 3.03Å; T543-I595 HydrophobicContact CG2-CG2 4.37Å
544	A	80.1	Confident	75.6	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.293	C	S	.	.			trans	-73.4	144.9	175	0	0	0	0	0	111.3	L557 E558 I597 L606	A544-L557 HydrophobicContact CB-CD1 4.04Å; A544-L557 HydrophobicContact CB-CD2 4.11Å; A544-L557 HydrophobicContact CB-CG 3.93Å; A544-E558 CarbonylContact C-O 3.57Å; A544-E558 WeakPolarHBondContact CA-O 3.43Å; A544-E558 WeakPolarHBondContact CB-O 3.49Å; A544-I597 HydrophobicContact CB-CD1 3.17Å; A544-L606 HydrophobicContact CB-CD1 3.6Å
545	Y	82.9	Confident	75.8	Confident	63 Å²	63	63.3 Å²	63.3	25%	0.247	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	161.7	179.4	68.7	-80.5	0	0	0	111.1	V540 Q547 L557 E558	V540-Y545 VanDerWaalsContact CG1-CB 3.48Å; V540-Y545 HydrophobicContact CG1-CD1 3.82Å; V540-Y545 HydrophobicContact CG1-CD2 3.62Å; V540-Y545 HydrophobicContact CG1-CE1 4.39Å; V540-Y545 HydrophobicContact CG1-CE2 4.24Å; V540-Y545 HydrophobicContact CG1-CG 3.36Å; V540-Y545 WeakPolarHBondContact O-CD1 3.47Å; Y545-Q547 HydrophobicContact CD2-CB 4.21Å; Y545-Q547 HydrophobicContact CE2-CB 3.82Å; Y545-Q547 PolarHBondContact OH-OE1 3.42Å; Y545-Q547 VanDerWaalsContact OH-OE1 3.07Å; Y545-L557 CarbonylContact O-C 3.59Å; Y545-L557 WeakPolarHBondContact O-CA 3.28Å; Y545-E558 HydrophobicContact CD1-CB 4.27Å; Y545-E558 HydrophobicContact CE1-CB 3.88Å; Y545-E558 HydrophobicContact CE2-CB 4.39Å; Y545-E558 VanDerWaalsContact CZ-OE2 3.25Å; Y545-E558 PolarHBondContact N-O 3.41Å; Y545-E558 PolarHBondContact O-N 3.35Å; Y545-E558 PolarHBondContact OH-OE2 2.92Å
546	V	83.2	Confident	76	Confident	37 Å²	37	58.3 Å²	58.3	22%	0.224	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	120.7	-177.4	179.8	0	0	0	0	107.9	W555 T556 L557 K599 A600	V546-W555 HydrophobicContact CG1-CB 4.33Å; V546-W555 HydrophobicContact CG1-CE3 3.87Å; V546-T556 WeakPolarHBondContact CA-O 3.38Å; V546-L557 HydrophobicContact CG2-CD1 3.86Å; V546-K599 HydrophobicContact CG2-CB 4.33Å; V546-A600 HydrophobicContact CG1-CB 4.22Å; V546-A600 HydrophobicContact CG2-CB 4.02Å
547	Q	82.5	Confident	76.8	Confident	72 Å²	72	58.3 Å²	58.3	34%	0.336	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	145	177.6	179.8	164.4	-12.1	0	0	109.8	Y545 H549 T556 E558	Y545-Q547 HydrophobicContact CD2-CB 4.21Å; Y545-Q547 HydrophobicContact CE2-CB 3.82Å; Y545-Q547 PolarHBondContact OH-OE1 3.42Å; Y545-Q547 VanDerWaalsContact OH-OE1 3.07Å; Q547-H549 PolarHBondContact O-N 3.09Å; Q547-T556 PolarHBondContact N-O 3.28Å; Q547-T556 PolarHBondContact O-N 2.75Å; Q547-T556 PolarHBondContact O-OG1 3.36Å; Q547-E558 HydrophobicContact CB-CG 4.23Å; Q547-E558 VanDerWaalsContact OE1-CD 3.22Å; Q547-E558 PolarHBondContact OE1-OE1 3.33Å; Q547-E558 PolarHBondContact OE1-OE2 2.82Å
548	R	84.3	Confident	77.8	Confident	142 Å²	142	60.7 Å²	60.7	54%	0.536	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	117.1	170.7	-170	177.8	-175.4	-175.6	0.5	108.9	R553 E554 W555	R548-R553 PolarHBondContact NE-O 2.64Å; R548-E554 CarbonylContact C-O 3.26Å; R548-E554 WeakPolarHBondContact CA-O 3.37Å; R548-W555 HydrophobicContact CB-CD2 4.38Å; R548-W555 HydrophobicContact CB-CE3 4.06Å; R548-W555 HydrophobicContact CB-CZ3 4.17Å
549	H	79.7	Confident	78.8	Confident	13 Å²	13	60 Å²	60	6%	0.06	30%	0.301	C	S	.	.			trans	-60.8	129.7	-178.2	-165	-69.8	0	0	0	110.2	C301 Q547 V551 S552 R553 E554 T556	C301-H549 PolarHBondContact O-NE2 2.88Å; Q547-H549 PolarHBondContact O-N 3.09Å; H549-V551 VanDerWaalsContact C-N 3.32Å; H549-V551 PolarHBondContact ND1-N 2.98Å; H549-V551 VanDerWaalsContact ND1-N 3.12Å; H549-V551 PolarHBondContact O-N 2.89Å; H549-S552 WeakPolarHBondContact CB-OG 3.31Å; H549-S552 PolarHBondContact ND1-N 2.88Å; H549-R553 WeakPolarHBondContact O-CA 3.28Å; H549-R553 PolarHBondContact O-N 3.06Å; H549-E554 PolarHBondContact N-O 2.94Å; H549-T556 HydrophobicContact CB-CG2 3.87Å
550	P	76.5	Confident	80	Confident	78 Å²	78	58.8 Å²	58.8	51%	0.506	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-35.5	-174.5	22.6	-31.6	0	0	0	112.6	S300	S300-P550 WeakPolarHBondContact OG-CG 3.47Å
551	V	78.6	Confident	81.1	Confident	23 Å²	23	56 Å²	56	14%	0.139	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-55	-175.9	-174.6	0	0	0	0	113.7	T302 R361 T363 H549	T302-V551 HydrophobicContact CG2-CB 4.22Å; T302-V551 HydrophobicContact CG2-CG1 3.73Å; R361-V551 HydrophobicContact CG-CG1 4.45Å; T363-V551 HydrophobicContact CG2-CG2 3.52Å; H549-V551 VanDerWaalsContact C-N 3.32Å; H549-V551 PolarHBondContact ND1-N 2.98Å; H549-V551 VanDerWaalsContact ND1-N 3.12Å; H549-V551 PolarHBondContact O-N 2.89Å
552	S	78.2	Confident	81.8	Confident	47 Å²	47	54.6 Å²	54.6	33%	0.329	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-13.2	-178.8	55.5	0	0	0	0	113.7	H549 E554	H549-S552 WeakPolarHBondContact CB-OG 3.31Å; H549-S552 PolarHBondContact ND1-N 2.88Å; S552-E554 VanDerWaalsContact CB-OE1 3.25Å; S552-E554 WeakPolarHBondContact CB-OE1 3.42Å; S552-E554 PolarHBondContact O-N 3.3Å; S552-E554 VanDerWaalsContact O-N 3.13Å; S552-E554 VanDerWaalsContact OG-CD 3.32Å; S552-E554 WeakPolarHBondContact OG-CG 3.29Å; S552-E554 PolarHBondContact OG-OE1 2.78Å
553	R	82.3	Confident	82.3	Confident	185 Å²	185	55.8 Å²	55.8	70%	0.698	27%	0.268	S	S	*	.			trans	60.8	11.2	-177.2	-57.9	-177.7	175.2	-176.2	-1	115	R548 H549	R548-R553 PolarHBondContact NE-O 2.64Å; H549-R553 WeakPolarHBondContact O-CA 3.28Å; H549-R553 PolarHBondContact O-N 3.06Å
554	E	83.7	Confident	82.4	Confident	103 Å²	103	59.2 Å²	59.2	48%	0.481	29%	0.285	S	S	.	.	S	Bend	trans	-88.2	161.6	175.3	78.8	-157.4	140	0	0	111.7	R548 H549 S552 T556	R548-E554 CarbonylContact C-O 3.26Å; R548-E554 WeakPolarHBondContact CA-O 3.37Å; H549-E554 PolarHBondContact N-O 2.94Å; S552-E554 VanDerWaalsContact CB-OE1 3.25Å; S552-E554 WeakPolarHBondContact CB-OE1 3.42Å; S552-E554 PolarHBondContact O-N 3.3Å; S552-E554 VanDerWaalsContact O-N 3.13Å; S552-E554 VanDerWaalsContact OG-CD 3.32Å; S552-E554 WeakPolarHBondContact OG-CG 3.29Å; S552-E554 PolarHBondContact OG-OE1 2.78Å; E554-T556 HydrophobicContact CG-CG2 3.59Å; E554-T556 PolarHBondContact O-N 3.23Å
555	W	83.6	Confident	82.7	Confident	184 Å²	184	59.2 Å²	59.2	70%	0.697	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	110.8	175.1	-69.1	100.3	0	0	0	109.7	V546 R548	V546-W555 HydrophobicContact CG1-CB 4.33Å; V546-W555 HydrophobicContact CG1-CE3 3.87Å; R548-W555 HydrophobicContact CB-CD2 4.38Å; R548-W555 HydrophobicContact CB-CE3 4.06Å; R548-W555 HydrophobicContact CB-CZ3 4.17Å
556	T	82.3	Confident	83	Confident	30 Å²	30	57.3 Å²	57.3	18%	0.184	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	152.8	-178.9	53	0	0	0	0	111.3	V546 Q547 H549 E554	V546-T556 WeakPolarHBondContact CA-O 3.38Å; Q547-T556 PolarHBondContact N-O 3.28Å; Q547-T556 PolarHBondContact O-N 2.75Å; Q547-T556 PolarHBondContact O-OG1 3.36Å; H549-T556 HydrophobicContact CB-CG2 3.87Å; E554-T556 HydrophobicContact CG-CG2 3.59Å; E554-T556 PolarHBondContact O-N 3.23Å
557	L	82.9	Confident	83.1	Confident	54 Å²	54	64.3 Å²	64.3	28%	0.283	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	117	172.9	-171.4	77.1	0	0	0	108.8	A544 Y545 V546 L606	A544-L557 HydrophobicContact CB-CD1 4.04Å; A544-L557 HydrophobicContact CB-CD2 4.11Å; A544-L557 HydrophobicContact CB-CG 3.93Å; Y545-L557 CarbonylContact O-C 3.59Å; Y545-L557 WeakPolarHBondContact O-CA 3.28Å; V546-L557 HydrophobicContact CG2-CD1 3.86Å; L557-L606 HydrophobicContact CD2-CD1 4.18Å
558	E	81.4	Confident	83.4	Confident	52 Å²	52	61.1 Å²	61.1	24%	0.243	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	134.5	173.1	-71.5	-169.9	-174.8	0	0	110.4	A544 Y545 Q547	A544-E558 CarbonylContact C-O 3.57Å; A544-E558 WeakPolarHBondContact CA-O 3.43Å; A544-E558 WeakPolarHBondContact CB-O 3.49Å; Y545-E558 HydrophobicContact CD1-CB 4.27Å; Y545-E558 HydrophobicContact CE1-CB 3.88Å; Y545-E558 HydrophobicContact CE2-CB 4.39Å; Y545-E558 VanDerWaalsContact CZ-OE2 3.25Å; Y545-E558 PolarHBondContact N-O 3.41Å; Y545-E558 PolarHBondContact O-N 3.35Å; Y545-E558 PolarHBondContact OH-OE2 2.92Å; Q547-E558 HydrophobicContact CB-CG 4.23Å; Q547-E558 VanDerWaalsContact OE1-CD 3.22Å; Q547-E558 PolarHBondContact OE1-OE1 3.33Å; Q547-E558 PolarHBondContact OE1-OE2 2.82Å
559	A	80.8	Confident	83.7	Confident	40 Å²	40	54.5 Å²	54.5	33%	0.331	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-74.4	131.9	-178.6	0	0	0	0	0	111	V563 L564	A559-V563 HydrophobicContact CB-CB 4.06Å; A559-V563 HydrophobicContact CB-CG1 3.95Å; A559-L564 HydrophobicContact CB-CD2 4.15Å; A559-L564 HydrophobicContact CB-CG 4.32Å
560	G	84.5	Confident	84.3	Confident	2 Å²	2	53.9 Å²	53.9	2%	0.021	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-73.7	171.8	172.2	0	0	0	0	0	113.2	G541 T543 L562 V563 L564	G541-G560 WeakPolarHBondContact O-CA 3.44Å; T543-G560 WeakPolarHBondContact O-CA 3.31Å; T543-G560 PolarHBondContact O-N 3.03Å; G560-L562 VanDerWaalsContact C-N 3.27Å; G560-L562 PolarHBondContact O-N 2.89Å; G560-L562 VanDerWaalsContact O-N 3.16Å; G560-V563 PolarHBondContact O-N 2.81Å; G560-L564 WeakPolarHBondContact O-CG 3.48Å; G560-L564 PolarHBondContact O-N 3.33Å; G560-L564 VanDerWaalsContact O-N 3.08Å
561	A	84.3	Confident	85.1	Confident	12 Å²	12	50.2 Å²	50.2	10%	0.099	24%	0.237	C	C	.	.	H	α-helix	trans	-52.3	-39.8	-176.5	0	0	0	0	0	114	V530 G541 V563 L564 A565	V530-A561 HydrophobicContact CG1-CB 3.91Å; G541-A561 PolarHBondContact O-N 3.1Å; A561-V563 VanDerWaalsContact C-N 3.34Å; A561-V563 PolarHBondContact O-N 2.89Å; A561-L564 PolarHBondContact O-N 3.3Å; A561-A565 WeakPolarHBondContact O-CB 3.41Å; A561-A565 PolarHBondContact O-N 2.88Å
562	L	86.8	Confident	85.8	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-67.7	-33.3	-179.3	-70.1	170.3	0	0	0	113.2	L542 G560 C570 I586 A589 I595 A608	L542-L562 PolarHBondContact O-N 2.92Å; G560-L562 VanDerWaalsContact C-N 3.27Å; G560-L562 PolarHBondContact O-N 2.89Å; G560-L562 VanDerWaalsContact O-N 3.16Å; L562-C570 HydrophobicContact CD2-CB 4.23Å; L562-I586 HydrophobicContact CD1-CG1 4.26Å; L562-A589 HydrophobicContact CD1-CB 4.1Å; L562-I595 HydrophobicContact CB-CD1 4.08Å; L562-I595 HydrophobicContact CD1-CD1 4.03Å; L562-A608 HydrophobicContact CB-CB 4.42Å
563	V	87.6	Confident	86.4	Confident	24 Å²	24	48 Å²	48	15%	0.145	22%	0.221	C	C	.	.	H	α-helix	trans	-78.8	-37.3	179.4	-179.1	0	0	0	0	109.9	A559 G560 A561 A565 D566 I595 L606	A559-V563 HydrophobicContact CB-CB 4.06Å; A559-V563 HydrophobicContact CB-CG1 3.95Å; G560-V563 PolarHBondContact O-N 2.81Å; A561-V563 VanDerWaalsContact C-N 3.34Å; A561-V563 PolarHBondContact O-N 2.89Å; V563-A565 PolarHBondContact O-N 3.32Å; V563-D566 WeakPolarHBondContact O-CB 3.26Å; V563-D566 PolarHBondContact O-N 3.24Å; V563-I595 HydrophobicContact CG2-CD1 4.32Å; V563-L606 HydrophobicContact CG1-CB 4.36Å; V563-L606 HydrophobicContact CG1-CD1 4.41Å; V563-L606 HydrophobicContact CG2-CB 4.11Å; V563-L606 HydrophobicContact CG2-CD1 4.15Å
564	L	84.8	Confident	86.8	Confident	81 Å²	81	41.5 Å²	41.5	42%	0.424	20%	0.198	S	C	.	.	H	α-helix	trans	-61.2	-36.1	173	-66.1	173.1	0	0	0	111.5	R528 V530 A559 G560 A561 D566	R528-L564 PolarHBondContact NE-O 3.04Å; R528-L564 PolarHBondContact NH2-O 3.33Å; V530-L564 HydrophobicContact CG2-CB 4.09Å; A559-L564 HydrophobicContact CB-CD2 4.15Å; A559-L564 HydrophobicContact CB-CG 4.32Å; G560-L564 WeakPolarHBondContact O-CG 3.48Å; G560-L564 PolarHBondContact O-N 3.33Å; G560-L564 VanDerWaalsContact O-N 3.08Å; A561-L564 PolarHBondContact O-N 3.3Å; L564-D566 VanDerWaalsContact C-N 3.27Å; L564-D566 PolarHBondContact O-N 2.86Å
565	A	86.5	Confident	87	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	12.7	177.5	0	0	0	0	0	115.2	V530 A561 V563 R567 G568 C570 C610	V530-A565 HydrophobicContact CB-CB 4.23Å; V530-A565 HydrophobicContact CG2-CB 3.92Å; A561-A565 WeakPolarHBondContact O-CB 3.41Å; A561-A565 PolarHBondContact O-N 2.88Å; V563-A565 PolarHBondContact O-N 3.32Å; A565-R567 PolarHBondContact O-N 3.28Å; A565-G568 CarbonylContact O-C 3.32Å; A565-G568 WeakPolarHBondContact O-CA 3.35Å; A565-G568 PolarHBondContact O-N 3.29Å; A565-C570 HydrophobicContact CB-CB 4.06Å; A565-C610 HydrophobicContact CB-CB 4.01Å; A565-C610 VanDerWaalsContact O-CB 3.31Å; A565-C610 WeakPolarHBondContact O-CB 3.26Å
566	D	87.9	Confident	87.3	Confident	23 Å²	23	29.6 Å²	29.6	12%	0.123	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	130.7	178	-174.7	51.7	0	0	0	112	R528 V563 L564 G568 R609	R528-D566 PolarHBondContact NE-O 3.33Å; R528-D566 PolarHBondContact NH1-O 2.96Å; R528-D566 PolarHBondContact NH2-O 3.4Å; V563-D566 WeakPolarHBondContact O-CB 3.26Å; V563-D566 PolarHBondContact O-N 3.24Å; L564-D566 VanDerWaalsContact C-N 3.27Å; L564-D566 PolarHBondContact O-N 2.86Å; D566-G568 PolarHBondContact O-N 3.22Å; D566-R609 WeakPolarHBondContact OD1-CA 3.47Å; D566-R609 WeakPolarHBondContact OD1-CB 3.49Å; D566-R609 WeakPolarHBondContact OD1-CG 3.46Å; D566-R609 IonicContact OD1-CZ 3.42Å; D566-R609 PolarHBondContact OD1-N 2.92Å; D566-R609 IonicContact OD1-NE 2.71Å; D566-R609 PolarHBondContact OD1-NE 2.71Å; D566-R609 IonicContact OD1-NH2 3.15Å; D566-R609 IonicContact OD2-CZ 2.55Å; D566-R609 IonicContact OD2-NE 3.42Å; D566-R609 IonicContact OD2-NH2 3.03Å; D566-R609 PolarHBondContact OD2-NH2 3.43Å
567	R	86	Confident	87.5	Confident	183 Å²	183	32.4 Å²	32.4	69%	0.691	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	10.7	-169.3	-56.6	-176.8	175.8	-169.4	-4.3	115.6	A565 R609	A565-R567 PolarHBondContact O-N 3.28Å; R567-R609 WeakPolarHBondContact CA-O 3.48Å; R567-R609 PolarHBondContact N-O 2.89Å; R567-R609 VanDerWaalsContact NE-NH2 3.19Å
568	G	88.7	Confident	87.6	Confident	6 Å²	6	30.1 Å²	30.1	6%	0.062	15%	0.149	C	C	.	.	S	Bend	trans	-115.4	-155.7	178.9	0	0	0	0	0	112.6	R528 A565 D566 T611	R528-G568 CarbonylContact O-C 3.52Å; R528-G568 WeakPolarHBondContact O-CA 3.47Å; A565-G568 CarbonylContact O-C 3.32Å; A565-G568 WeakPolarHBondContact O-CA 3.35Å; A565-G568 PolarHBondContact O-N 3.29Å; D566-G568 PolarHBondContact O-N 3.22Å; G568-T611 PolarHBondContact O-N 3.11Å; G568-T611 VanDerWaalsContact O-N 3.1Å
569	V	91.2	Very high	87.7	Confident	3 Å²	3	32.2 Å²	32.2	2%	0.018	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.3	178.1	-172.3	0	0	0	0	109.3	V522 A526 R528 A529 V530 L571 T611 M613	V522-V569 HydrophobicContact CG1-CG1 4.42Å; A526-V569 HydrophobicContact CB-CG2 4.23Å; R528-V569 PolarHBondContact O-N 3.27Å; A529-V569 VanDerWaalsContact CA-O 3.32Å; A529-V569 WeakPolarHBondContact CA-O 3.42Å; V530-V569 PolarHBondContact N-O 2.91Å; V569-L571 HydrophobicContact CG1-CD2 3.6Å; V569-L571 HydrophobicContact CG1-CG 4.31Å; V569-T611 CarbonylContact C-O 3.56Å; V569-T611 WeakPolarHBondContact CA-O 3.27Å; V569-M613 HydrophobicContact CG1-CB 4.49Å; V569-M613 HydrophobicContact CG1-CE 3.83Å; V569-M613 HydrophobicContact CG1-CG 3.84Å; V569-M613 HydrophobicContact CG1-SD 3.78Å; V569-M613 HydrophobicContact CG2-CE 4.4Å
570	C	92.1	Very high	87.9	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	117.1	169.8	-173.8	0	0	0	0	108.5	L562 A565 C610 T611 M613	L562-C570 HydrophobicContact CD2-CB 4.23Å; A565-C570 HydrophobicContact CB-CB 4.06Å; C570-C610 HydrophobicContact CB-CB 4.38Å; C570-T611 PolarHBondContact N-O 2.92Å; C570-M613 PolarHBondContact O-N 3.39Å
571	L	93.4	Very high	87.7	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	121.3	-179.4	-53.7	174.4	0	0	0	108.7	L519 V522 E523 A529 V530 F531 T532 V569 M613	L519-L571 HydrophobicContact CD2-CD2 4.01Å; L519-L571 WeakPolarHBondContact O-CD1 3.3Å; V522-L571 HydrophobicContact CB-CD2 4.27Å; V522-L571 HydrophobicContact CG1-CD2 3.79Å; E523-L571 HydrophobicContact CB-CD1 3.57Å; E523-L571 HydrophobicContact CG-CD1 4.2Å; A529-L571 HydrophobicContact CB-CD1 4.27Å; V530-L571 PolarHBondContact O-N 3Å; F531-L571 HydrophobicContact CD2-CB 3.86Å; F531-L571 HydrophobicContact CD2-CD1 4.26Å; T532-L571 PolarHBondContact N-O 3.21Å; V569-L571 HydrophobicContact CG1-CD2 3.6Å; V569-L571 HydrophobicContact CG1-CG 4.31Å; L571-M613 WeakPolarHBondContact CA-O 3.08Å; L571-M613 HydrophobicContact CD2-CB 3.89Å; L571-M613 HydrophobicContact CD2-CG 4.33Å; L571-M613 HydrophobicContact CD2-SD 3.96Å
572	I	92.3	Very high	87.6	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	113	-179.6	-48.6	177.6	0	0	0	109.5	T532 F575 M578 I586 V612 M613 A614 A615	T532-I572 HydrophobicContact CG2-CB 4.39Å; T532-I572 HydrophobicContact CG2-CG1 3.85Å; T532-I572 HydrophobicContact CG2-CG2 4.35Å; T532-I572 WeakPolarHBondContact O-CA 3.2Å; I572-F575 HydrophobicContact CB-CD2 4.26Å; I572-F575 HydrophobicContact CD1-CD2 4.26Å; I572-F575 HydrophobicContact CD1-CE2 4.17Å; I572-F575 HydrophobicContact CG2-CD2 3.84Å; I572-M578 HydrophobicContact CG2-SD 4.33Å; I572-I586 HydrophobicContact CD1-CD1 3.8Å; I572-V612 HydrophobicContact CD1-CG1 3.91Å; I572-V612 HydrophobicContact CG1-CG1 4.47Å; I572-M613 PolarHBondContact N-O 2.87Å; I572-A614 HydrophobicContact CB-CB 4.39Å; I572-A614 CarbonylContact O-C 3.58Å; I572-A614 VanDerWaalsContact O-CA 3.23Å; I572-A614 WeakPolarHBondContact O-CA 3.32Å; I572-A615 PolarHBondContact O-N 2.88Å
573	D	92	Very high	87.5	Confident	23 Å²	23	39.3 Å²	39.3	12%	0.123	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	155	170	-155.8	-3	0	0	0	110.8	S516 L519 F531 T532 G534 F575	S516-D573 VanDerWaalsContact CB-OD2 3.29Å; S516-D573 WeakPolarHBondContact CB-OD2 3.18Å; S516-D573 PolarHBondContact OG-OD2 3.29Å; L519-D573 HydrophobicContact CD1-CB 4.17Å; F531-D573 HydrophobicContact CE2-CB 4.26Å; F531-D573 HydrophobicContact CZ-CB 3.97Å; T532-D573 PolarHBondContact O-N 3.11Å; G534-D573 PolarHBondContact N-O 3.41Å; D573-F575 PolarHBondContact O-N 2.89Å
574	E	89.8	Confident	87.4	Confident	49 Å²	49	42.4 Å²	42.4	23%	0.229	22%	0.217	C	C	.	.			trans	52.3	48.5	-178.7	-53.1	-165.5	140.5	0	0	113.9	D576 K577 A615	E574-D576 PolarHBondContact O-N 3.37Å; E574-D576 VanDerWaalsContact O-N 3.16Å; E574-K577 HydrophobicContact CB-CD 4.29Å; E574-K577 HydrophobicContact CB-CG 4.43Å; E574-K577 PolarHBondContact O-N 3.25Å; E574-K577 VanDerWaalsContact O-N 3.1Å; E574-K577 IonicContact OE1-NZ 2.58Å; E574-K577 PolarHBondContact OE1-NZ 2.84Å; E574-K577 WeakPolarHBondContact OE2-CD 3.29Å; E574-K577 IonicContact OE2-NZ 3.4Å; E574-K577 PolarHBondContact OE2-NZ 3.11Å; E574-A615 PolarHBondContact N-O 3.02Å
575	F	89.1	Confident	87.3	Confident	1 Å²	1	39.6 Å²	39.6	0%	0.004	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-60.6	-25.1	-176.8	-168.7	-102.6	0	0	0	113.6	I572 D573 K577 M578 I586 A614 A615 A616 L635 I639 F643	I572-F575 HydrophobicContact CB-CD2 4.26Å; I572-F575 HydrophobicContact CD1-CD2 4.26Å; I572-F575 HydrophobicContact CD1-CE2 4.17Å; I572-F575 HydrophobicContact CG2-CD2 3.84Å; D573-F575 PolarHBondContact O-N 2.89Å; F575-K577 VanDerWaalsContact C-N 3.33Å; F575-K577 PolarHBondContact O-N 3.07Å; F575-M578 HydrophobicContact CD2-SD 3.56Å; F575-M578 VanDerWaalsContact CD2-SD 3.56Å; F575-M578 HydrophobicContact CE2-SD 3.63Å; F575-M578 HydrophobicContact CG-SD 4.33Å; F575-M578 HydrophobicContact CZ-SD 4.44Å; F575-M578 WeakPolarHBondContact O-CG 3Å; F575-I586 HydrophobicContact CE2-CD1 3.97Å; F575-A614 HydrophobicContact CB-CB 4.15Å; F575-A614 HydrophobicContact CD2-CB 3.9Å; F575-A614 HydrophobicContact CG-CB 4Å; F575-A615 WeakPolarHBondContact CB-O 3.32Å; F575-A615 PolarHBondContact N-O 2.74Å; F575-A616 HydrophobicContact CB-CB 4.35Å; F575-L635 HydrophobicContact CD1-CD1 3.71Å; F575-L635 HydrophobicContact CD1-CD2 3.55Å; F575-L635 HydrophobicContact CD1-CG 4.25Å; F575-L635 HydrophobicContact CE1-CD1 3.8Å; F575-L635 HydrophobicContact CE1-CD2 3.45Å; F575-L635 VanDerWaalsContact CE1-CD2 3.45Å; F575-L635 HydrophobicContact CE1-CG 4.28Å; F575-I639 HydrophobicContact CE1-CG2 3.98Å; F575-I639 HydrophobicContact CZ-CG2 4.05Å; F575-F643 HydrophobicContact CE1-CE2 4.32Å; F575-F643 HydrophobicContact CE1-CZ 4.43Å; F575-F643 HydrophobicContact CZ-CE2 4.38Å; F575-F643 HydrophobicContact CZ-CZ 4.25Å
576	D	88	Confident	87.4	Confident	36 Å²	36	39.7 Å²	39.7	19%	0.193	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-66.1	-31.9	176.4	53.2	-64	0	0	0	113	E574 M578 R583 N617	E574-D576 PolarHBondContact O-N 3.37Å; E574-D576 VanDerWaalsContact O-N 3.16Å; D576-M578 PolarHBondContact O-N 3.11Å; D576-R583 PolarHBondContact O-NH2 3.49Å; D576-N617 PolarHBondContact OD1-N 3.24Å
577	K	86.6	Confident	87.4	Confident	89 Å²	89	41.6 Å²	41.6	39%	0.387	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-82.9	7.4	-176	-60.7	-172.9	-169.2	163.7	0	114.8	E574 F575	E574-K577 HydrophobicContact CB-CD 4.29Å; E574-K577 HydrophobicContact CB-CG 4.43Å; E574-K577 PolarHBondContact O-N 3.25Å; E574-K577 VanDerWaalsContact O-N 3.1Å; E574-K577 IonicContact OE1-NZ 2.58Å; E574-K577 PolarHBondContact OE1-NZ 2.84Å; E574-K577 WeakPolarHBondContact OE2-CD 3.29Å; E574-K577 IonicContact OE2-NZ 3.4Å; E574-K577 PolarHBondContact OE2-NZ 3.11Å; F575-K577 VanDerWaalsContact C-N 3.33Å; F575-K577 PolarHBondContact O-N 3.07Å
578	M	85.4	Confident	87.4	Confident	7 Å²	7	35.1 Å²	35.1	3%	0.034	19%	0.19	C	C	.	.			trans	-71.7	143	-178.7	-71	-168	59.4	0	0	112.9	L542 I572 F575 D576 D582 R583 I586	L542-M578 HydrophobicContact CD1-CE 3.52Å; I572-M578 HydrophobicContact CG2-SD 4.33Å; F575-M578 HydrophobicContact CD2-SD 3.56Å; F575-M578 VanDerWaalsContact CD2-SD 3.56Å; F575-M578 HydrophobicContact CE2-SD 3.63Å; F575-M578 HydrophobicContact CG-SD 4.33Å; F575-M578 HydrophobicContact CZ-SD 4.44Å; F575-M578 WeakPolarHBondContact O-CG 3Å; D576-M578 PolarHBondContact O-N 3.11Å; M578-D582 HydrophobicContact CE-CB 3.31Å; M578-R583 HydrophobicContact CB-CG 4.29Å; M578-R583 PolarHBondContact O-NE 3.42Å; M578-R583 VanDerWaalsContact O-NE 3.14Å; M578-I586 HydrophobicContact CE-CD1 3.39Å; M578-I586 HydrophobicContact CE-CG1 4.29Å; M578-I586 HydrophobicContact SD-CD1 3.81Å
579	N	84.7	Confident	87.4	Confident	96 Å²	96	35.2 Å²	35.2	51%	0.513	19%	0.19	S	C	.	.			trans	-71.2	158.4	174.6	-50.4	-59.1	0	0	0	111.5	A581 D582 R583	N579-A581 VanDerWaalsContact C-N 3.33Å; N579-A581 PolarHBondContact O-N 2.79Å; N579-D582 WeakPolarHBondContact CB-OD2 3.42Å; N579-D582 PolarHBondContact ND2-OD2 3.18Å; N579-D582 WeakPolarHBondContact O-CB 3.35Å; N579-D582 PolarHBondContact O-N 2.99Å; N579-R583 WeakPolarHBondContact O-CG 3.41Å; N579-R583 PolarHBondContact O-N 3.16Å; N579-R583 VanDerWaalsContact O-N 3.09Å
580	D	83.4	Confident	87.1	Confident	112 Å²	112	35.5 Å²	35.5	60%	0.599	19%	0.192	S	C	*	.	H	α-helix	trans	-66.9	-31.8	-175.4	-151.7	32.1	0	0	0	113.5	D582 R583 T584	D580-D582 VanDerWaalsContact C-N 3.28Å; D580-D582 PolarHBondContact O-N 2.84Å; D580-R583 PolarHBondContact O-N 3.15Å; D580-T584 PolarHBondContact O-N 3.37Å; D580-T584 VanDerWaalsContact O-N 3.14Å
581	A	81.7	Confident	86.7	Confident	57 Å²	57	40 Å²	40	47%	0.471	21%	0.213	S	C	.	.	H	α-helix	trans	-64.3	-33.2	172.7	0	0	0	0	0	112.6	N579 T584 S585	N579-A581 VanDerWaalsContact C-N 3.33Å; N579-A581 PolarHBondContact O-N 2.79Å; A581-T584 PolarHBondContact O-OG1 3.16Å; A581-S585 PolarHBondContact O-N 3.27Å; A581-S585 PolarHBondContact O-OG 3.34Å
582	D	82.5	Confident	86.3	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.011	24%	0.24	C	C	.	.	H	α-helix	trans	-75.8	-37.7	179.7	-55.4	-30.3	0	0	0	110.2	A539 L542 M578 N579 D580 T584 S585 I586	A539-D582 WeakPolarHBondContact CA-OD1 3.44Å; A539-D582 WeakPolarHBondContact CB-OD1 3.41Å; A539-D582 PolarHBondContact N-OD1 3.3Å; L542-D582 HydrophobicContact CD1-CB 3.81Å; M578-D582 HydrophobicContact CE-CB 3.31Å; N579-D582 WeakPolarHBondContact CB-OD2 3.42Å; N579-D582 PolarHBondContact ND2-OD2 3.18Å; N579-D582 WeakPolarHBondContact O-CB 3.35Å; N579-D582 PolarHBondContact O-N 2.99Å; D580-D582 VanDerWaalsContact C-N 3.28Å; D580-D582 PolarHBondContact O-N 2.84Å; D582-T584 PolarHBondContact O-N 3.02Å; D582-S585 PolarHBondContact O-N 3.4Å; D582-I586 WeakPolarHBondContact O-CG1 3.39Å; D582-I586 PolarHBondContact O-N 3.2Å
583	R	83.8	Confident	86.1	Confident	33 Å²	33	46.8 Å²	46.8	13%	0.125	24%	0.244	C	C	.	.	H	α-helix	trans	-60.2	-41.9	174.3	-67.6	176.2	-175.8	-166.5	-5.8	111.9	D576 M578 N579 D580 H587 D634 I639	D576-R583 PolarHBondContact O-NH2 3.49Å; M578-R583 HydrophobicContact CB-CG 4.29Å; M578-R583 PolarHBondContact O-NE 3.42Å; M578-R583 VanDerWaalsContact O-NE 3.14Å; N579-R583 WeakPolarHBondContact O-CG 3.41Å; N579-R583 PolarHBondContact O-N 3.16Å; N579-R583 VanDerWaalsContact O-N 3.09Å; D580-R583 PolarHBondContact O-N 3.15Å; R583-H587 WeakPolarHBondContact O-CB 3.48Å; R583-H587 PolarHBondContact O-N 3.45Å; R583-H587 VanDerWaalsContact O-N 3.07Å; R583-D634 IonicContact NH1-OD2 3.03Å; R583-D634 PolarHBondContact NH2-O 3.36Å; R583-D634 IonicContact NH2-OD2 2.69Å; R583-D634 PolarHBondContact NH2-OD2 3.16Å; R583-I639 HydrophobicContact CB-CD1 4.07Å; R583-I639 HydrophobicContact CG-CD1 4.43Å
584	T	84.7	Confident	85.9	Confident	89 Å²	89	47 Å²	47	55%	0.546	25%	0.248	S	C	.	.	H	α-helix	trans	-67.4	-41.2	176.9	56.1	0	0	0	0	112.4	D580 A581 D582 H587 E588	D580-T584 PolarHBondContact O-N 3.37Å; D580-T584 VanDerWaalsContact O-N 3.14Å; A581-T584 PolarHBondContact O-OG1 3.16Å; D582-T584 PolarHBondContact O-N 3.02Å; T584-H587 PolarHBondContact O-N 3.1Å; T584-E588 PolarHBondContact O-N 2.99Å; T584-E588 VanDerWaalsContact O-N 3.11Å
585	S	84.3	Confident	85.8	Confident	23 Å²	23	44.9 Å²	44.9	16%	0.161	24%	0.238	C	C	.	.	H	α-helix	trans	-64.2	-43.3	178.2	-57.1	0	0	0	0	112.4	A581 D582 H587 E588 A589	A581-S585 PolarHBondContact O-N 3.27Å; A581-S585 PolarHBondContact O-OG 3.34Å; D582-S585 PolarHBondContact O-N 3.4Å; S585-H587 VanDerWaalsContact C-N 3.32Å; S585-H587 PolarHBondContact O-N 2.89Å; S585-E588 PolarHBondContact O-N 3.23Å; S585-A589 PolarHBondContact O-N 3.42Å; S585-A589 VanDerWaalsContact O-N 3.11Å
586	I	87.3	Confident	85.6	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-64.3	-39.5	174.7	-72.8	-173.6	0	0	0	111	L542 L562 I572 F575 M578 D582 E588 A589 M590	L542-I586 HydrophobicContact CD1-CD1 4.23Å; L542-I586 HydrophobicContact CD1-CG1 4.45Å; L562-I586 HydrophobicContact CD1-CG1 4.26Å; I572-I586 HydrophobicContact CD1-CD1 3.8Å; F575-I586 HydrophobicContact CE2-CD1 3.97Å; M578-I586 HydrophobicContact CE-CD1 3.39Å; M578-I586 HydrophobicContact CE-CG1 4.29Å; M578-I586 HydrophobicContact SD-CD1 3.81Å; D582-I586 WeakPolarHBondContact O-CG1 3.39Å; D582-I586 PolarHBondContact O-N 3.2Å; I586-E588 VanDerWaalsContact C-N 3.31Å; I586-E588 PolarHBondContact O-N 3.35Å; I586-A589 PolarHBondContact O-N 3.06Å; I586-M590 HydrophobicContact CG2-CG 3.94Å; I586-M590 HydrophobicContact CG2-SD 3.65Å; I586-M590 WeakPolarHBondContact O-CB 3.43Å; I586-M590 WeakPolarHBondContact O-CG 3.45Å; I586-M590 PolarHBondContact O-N 3.2Å
587	H	87.7	Confident	85.5	Confident	62 Å²	62	47.3 Å²	47.3	29%	0.287	26%	0.257	S	S	.	.	H	α-helix	trans	-62.5	-38.2	178.8	-178.1	-89.4	0	0	0	112.2	R583 T584 S585 E591	R583-H587 WeakPolarHBondContact O-CB 3.48Å; R583-H587 PolarHBondContact O-N 3.45Å; R583-H587 VanDerWaalsContact O-N 3.07Å; T584-H587 PolarHBondContact O-N 3.1Å; S585-H587 VanDerWaalsContact C-N 3.32Å; S585-H587 PolarHBondContact O-N 2.89Å; H587-E591 WeakPolarHBondContact O-CB 3.47Å; H587-E591 PolarHBondContact O-N 3.09Å
588	E	87.1	Confident	85.3	Confident	48 Å²	48	47.5 Å²	47.5	22%	0.224	27%	0.27	C	S	.	.	H	α-helix	trans	-61.7	-49.6	171.6	-173.2	-177.2	166.6	0	0	111.1	T584 S585 I586 M590 E591 Q592 S596	T584-E588 PolarHBondContact O-N 2.99Å; T584-E588 VanDerWaalsContact O-N 3.11Å; S585-E588 PolarHBondContact O-N 3.23Å; I586-E588 VanDerWaalsContact C-N 3.31Å; I586-E588 PolarHBondContact O-N 3.35Å; E588-M590 PolarHBondContact O-N 3.21Å; E588-E591 PolarHBondContact O-N 2.88Å; E588-Q592 PolarHBondContact O-N 3.43Å; E588-S596 PolarHBondContact OE1-N 3.27Å; E588-S596 PolarHBondContact OE1-OG 2.87Å
589	A	87.3	Confident	85.2	Confident	7 Å²	7	51.6 Å²	51.6	6%	0.058	29%	0.287	C	S	.	.	H	α-helix	trans	-61.7	-42	-179.3	0	0	0	0	0	112.9	L562 S585 I586 Q593 I595	L562-A589 HydrophobicContact CD1-CB 4.1Å; S585-A589 PolarHBondContact O-N 3.42Å; S585-A589 VanDerWaalsContact O-N 3.11Å; I586-A589 PolarHBondContact O-N 3.06Å; A589-Q593 WeakPolarHBondContact O-CA 3.5Å; A589-Q593 PolarHBondContact O-N 3.03Å; A589-I595 HydrophobicContact CB-CD1 4.22Å; A589-I595 HydrophobicContact CB-CG1 4.03Å
590	M	86.9	Confident	84.7	Confident	10 Å²	10	51 Å²	51	5%	0.049	30%	0.296	C	S	.	.	H	α-helix	trans	-72.6	-27.3	-179.2	-69.5	-178.9	87.9	0	0	113.8	R500 N504 I586 E588 V612 R642 F643	R500-M590 PolarHBondContact NH1-O 3.13Å; N504-M590 HydrophobicContact CB-CE 4.05Å; N504-M590 VanDerWaalsContact ND2-CE 3.3Å; N504-M590 WeakPolarHBondContact ND2-CE 3.29Å; I586-M590 HydrophobicContact CG2-CG 3.94Å; I586-M590 HydrophobicContact CG2-SD 3.65Å; I586-M590 WeakPolarHBondContact O-CB 3.43Å; I586-M590 WeakPolarHBondContact O-CG 3.45Å; I586-M590 PolarHBondContact O-N 3.2Å; E588-M590 PolarHBondContact O-N 3.21Å; M590-V612 HydrophobicContact CG-CG2 4.4Å; M590-R642 HydrophobicContact CB-CB 4.23Å; M590-R642 HydrophobicContact CB-CG 4.32Å; M590-R642 HydrophobicContact CE-CB 3.54Å; M590-R642 HydrophobicContact SD-CB 3.94Å; M590-F643 HydrophobicContact CE-CD1 4.21Å; M590-F643 HydrophobicContact CE-CD2 4.29Å; M590-F643 HydrophobicContact CE-CE1 4.01Å; M590-F643 HydrophobicContact CE-CE2 4.1Å; M590-F643 HydrophobicContact CE-CG 4.35Å; M590-F643 HydrophobicContact CE-CZ 3.95Å
591	E	82.3	Confident	84.4	Confident	94 Å²	94	49.8 Å²	49.8	44%	0.439	31%	0.309	S	S	.	.	H	α-helix	trans	-83.7	-51.6	177.4	173	65.8	129.5	0	0	111.8	H587 E588 R642	H587-E591 WeakPolarHBondContact O-CB 3.47Å; H587-E591 PolarHBondContact O-N 3.09Å; E588-E591 PolarHBondContact O-N 2.88Å; E591-R642 IonicContact OE1-CZ 3.3Å; E591-R642 IonicContact OE1-NH1 3.81Å; E591-R642 PolarHBondContact OE1-NH1 3.09Å; E591-R642 IonicContact OE1-NH2 2.9Å; E591-R642 PolarHBondContact OE1-NH2 3.4Å; E591-R642 IonicContact OE2-CZ 2.68Å; E591-R642 IonicContact OE2-NH1 2.78Å; E591-R642 PolarHBondContact OE2-NH1 2.86Å; E591-R642 IonicContact OE2-NH2 3.13Å; E591-R642 PolarHBondContact OE2-NH2 3.42Å; E591-R642 VanDerWaalsContact OE2-NH2 3.15Å
592	Q	85.3	Confident	84.4	Confident	122 Å²	122	50.1 Å²	50.1	57%	0.57	30%	0.302	S	S	*	.	H	α-helix	trans	-99.1	-16	-169.5	-60.1	-176	-2	0	0	113.1	E588 S594	E588-Q592 PolarHBondContact O-N 3.43Å; Q592-S594 WeakPolarHBondContact CB-OG 3.5Å; Q592-S594 PolarHBondContact O-N 3.18Å
593	Q	88.4	Confident	84.5	Confident	20 Å²	20	55.5 Å²	55.5	9%	0.093	34%	0.335	C	S	.	.	S	Bend	trans	55.5	27.1	-169.9	-48.7	-166.2	-62.1	0	0	113.1	D502 A589 A608 R609	D502-Q593 PolarHBondContact OD2-NE2 3.47Å; A589-Q593 WeakPolarHBondContact O-CA 3.5Å; A589-Q593 PolarHBondContact O-N 3.03Å; Q593-A608 CarbonylContact O-C 3.57Å; Q593-A608 PolarHBondContact O-N 3.2Å; Q593-R609 HydrophobicContact CB-CG 4.11Å
594	S	87.9	Confident	84.6	Confident	28 Å²	28	56.5 Å²	56.5	20%	0.196	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	145.8	177.8	57	0	0	0	0	109.2	Q592 L606	Q592-S594 WeakPolarHBondContact CB-OG 3.5Å; Q592-S594 PolarHBondContact O-N 3.18Å; S594-L606 CarbonylContact C-O 3.6Å; S594-L606 VanDerWaalsContact CA-O 3.29Å; S594-L606 WeakPolarHBondContact CA-O 3.48Å
595	I	87.3	Confident	84.7	Confident	4 Å²	4	56.2 Å²	56.2	2%	0.021	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.5	175.9	-59.4	172.1	0	0	0	107.2	T543 L562 V563 A589 I597 S605 L606 A608	T543-I595 HydrophobicContact CG2-CG2 4.37Å; L562-I595 HydrophobicContact CB-CD1 4.08Å; L562-I595 HydrophobicContact CD1-CD1 4.03Å; V563-I595 HydrophobicContact CG2-CD1 4.32Å; A589-I595 HydrophobicContact CB-CD1 4.22Å; A589-I595 HydrophobicContact CB-CG1 4.03Å; I595-I597 HydrophobicContact CG2-CD1 4.29Å; I595-I597 HydrophobicContact CG2-CG1 3.97Å; I595-S605 WeakPolarHBondContact O-CA 3.09Å; I595-L606 PolarHBondContact N-O 3.07Å; I595-L606 PolarHBondContact O-N 3.25Å; I595-A608 HydrophobicContact CD1-CB 3.96Å; I595-A608 HydrophobicContact CG1-CB 4.11Å
596	S	85.5	Confident	84.9	Confident	78 Å²	78	57.3 Å²	57.3	55%	0.545	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	129.4	174.3	60.6	0	0	0	0	111	E588	E588-S596 PolarHBondContact OE1-N 3.27Å; E588-S596 PolarHBondContact OE1-OG 2.87Å
597	I	84.6	Confident	84.9	Confident	10 Å²	10	62.5 Å²	62.5	5%	0.051	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	123.2	-177.2	-55.6	-178.9	0	0	0	109	A544 I595 K599 V603 T604 L606	A544-I597 HydrophobicContact CB-CD1 3.17Å; I595-I597 HydrophobicContact CG2-CD1 4.29Å; I595-I597 HydrophobicContact CG2-CG1 3.97Å; I597-K599 HydrophobicContact CG2-CB 4.19Å; I597-K599 HydrophobicContact CG2-CD 4.23Å; I597-K599 HydrophobicContact CG2-CG 4.09Å; I597-V603 WeakPolarHBondContact O-CA 3.42Å; I597-T604 PolarHBondContact N-O 3.4Å; I597-T604 PolarHBondContact O-N 3.4Å; I597-T604 VanDerWaalsContact O-O 3.12Å; I597-L606 HydrophobicContact CD1-CD1 3.93Å
598	S	83.8	Confident	84.9	Confident	94 Å²	94	59.6 Å²	59.6	66%	0.657	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.7	75.5	175.1	177.1	0	0	0	0	109	I602	S598-I602 WeakPolarHBondContact CA-O 3.41Å
599	K	82	Confident	85	Confident	92 Å²	92	59.6 Å²	59.6	40%	0.4	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	144	-178.6	-68.5	-179.6	-177.5	170	0	110.1	V546 I597 G601 I602	V546-K599 HydrophobicContact CG2-CB 4.33Å; I597-K599 HydrophobicContact CG2-CB 4.19Å; I597-K599 HydrophobicContact CG2-CD 4.23Å; I597-K599 HydrophobicContact CG2-CG 4.09Å; K599-G601 VanDerWaalsContact C-N 3.26Å; K599-G601 PolarHBondContact O-N 3.2Å; K599-G601 VanDerWaalsContact O-N 3.14Å; K599-I602 PolarHBondContact N-O 2.94Å; K599-I602 PolarHBondContact O-N 3.44Å
600	A	75.8	Confident	85.1	Confident	85 Å²	85	59.8 Å²	59.8	70%	0.702	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	35.2	175.6	0	0	0	0	0	115.7	V546 I602	V546-A600 HydrophobicContact CG1-CB 4.22Å; V546-A600 HydrophobicContact CG2-CB 4.02Å; A600-I602 PolarHBondContact O-N 3.47Å
601	G	77.3	Confident	85.4	Confident	85 Å²	85	59.6 Å²	59.6	88%	0.876	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	0.1	179.6	0	0	0	0	0	115	K599	K599-G601 VanDerWaalsContact C-N 3.26Å; K599-G601 PolarHBondContact O-N 3.2Å; K599-G601 VanDerWaalsContact O-N 3.14Å
602	I	79.8	Confident	85.9	Confident	64 Å²	64	55.3 Å²	55.3	33%	0.328	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	114.5	174.5	-58.4	172.4	0	0	0	107.9	S598 K599 A600 T604	S598-I602 WeakPolarHBondContact CA-O 3.41Å; K599-I602 PolarHBondContact N-O 2.94Å; K599-I602 PolarHBondContact O-N 3.44Å; A600-I602 PolarHBondContact O-N 3.47Å; I602-T604 HydrophobicContact CG2-CG2 3.51Å
603	V	86.2	Confident	86.3	Confident	115 Å²	115	49.6 Å²	49.6	70%	0.697	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.8	102.6	171.2	-175.5	0	0	0	0	107.5	I597	I597-V603 WeakPolarHBondContact O-CA 3.42Å
604	T	85.6	Confident	86.5	Confident	54 Å²	54	48.6 Å²	48.6	33%	0.331	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	151.6	-179.6	54.9	0	0	0	0	110.7	I597 I602	I597-T604 PolarHBondContact N-O 3.4Å; I597-T604 PolarHBondContact O-N 3.4Å; I597-T604 VanDerWaalsContact O-O 3.12Å; I602-T604 HydrophobicContact CG2-CG2 3.51Å
605	S	86.6	Confident	86.7	Confident	84 Å²	84	47.3 Å²	47.3	59%	0.587	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.4	171.1	-178.9	0	0	0	0	108.4	I595	I595-S605 WeakPolarHBondContact O-CA 3.09Å
606	L	87.8	Confident	87	Confident	45 Å²	45	47.1 Å²	47.1	24%	0.236	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	142.5	179.2	-62.7	172.2	0	0	0	109.3	A544 L557 V563 S594 I595 I597	A544-L606 HydrophobicContact CB-CD1 3.6Å; L557-L606 HydrophobicContact CD2-CD1 4.18Å; V563-L606 HydrophobicContact CG1-CB 4.36Å; V563-L606 HydrophobicContact CG1-CD1 4.41Å; V563-L606 HydrophobicContact CG2-CB 4.11Å; V563-L606 HydrophobicContact CG2-CD1 4.15Å; S594-L606 CarbonylContact C-O 3.6Å; S594-L606 VanDerWaalsContact CA-O 3.29Å; S594-L606 WeakPolarHBondContact CA-O 3.48Å; I595-L606 PolarHBondContact N-O 3.07Å; I595-L606 PolarHBondContact O-N 3.25Å; I597-L606 HydrophobicContact CD1-CD1 3.93Å
607	Q	88.6	Confident	87.3	Confident	111 Å²	111	45.7 Å²	45.7	52%	0.519	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	138.3	174.4	-65.4	-175.3	-1.9	0	0	110
608	A	88	Confident	87.6	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.008	29%	0.285	C	S	.	.			trans	-136.5	64.9	179.3	0	0	0	0	0	109.6	L562 Q593 I595 C610	L562-A608 HydrophobicContact CB-CB 4.42Å; Q593-A608 CarbonylContact O-C 3.57Å; Q593-A608 PolarHBondContact O-N 3.2Å; I595-A608 HydrophobicContact CD1-CB 3.96Å; I595-A608 HydrophobicContact CG1-CB 4.11Å; A608-C610 VanDerWaalsContact C-N 3.32Å; A608-C610 PolarHBondContact O-N 2.93Å; A608-C610 VanDerWaalsContact O-N 3.11Å
609	R	88.9	Confident	87.8	Confident	48 Å²	48	45.8 Å²	45.8	18%	0.181	28%	0.278	C	S	.	.			trans	-86.4	76.4	179.6	-51.2	165.2	-68.1	-160	-6.4	108.8	D566 R567 Q593	D566-R609 WeakPolarHBondContact OD1-CA 3.47Å; D566-R609 WeakPolarHBondContact OD1-CB 3.49Å; D566-R609 WeakPolarHBondContact OD1-CG 3.46Å; D566-R609 IonicContact OD1-CZ 3.42Å; D566-R609 PolarHBondContact OD1-N 2.92Å; D566-R609 IonicContact OD1-NE 2.71Å; D566-R609 PolarHBondContact OD1-NE 2.71Å; D566-R609 IonicContact OD1-NH2 3.15Å; D566-R609 IonicContact OD2-CZ 2.55Å; D566-R609 IonicContact OD2-NE 3.42Å; D566-R609 IonicContact OD2-NH2 3.03Å; D566-R609 PolarHBondContact OD2-NH2 3.43Å; R567-R609 WeakPolarHBondContact CA-O 3.48Å; R567-R609 PolarHBondContact N-O 2.89Å; R567-R609 VanDerWaalsContact NE-NH2 3.19Å; Q593-R609 HydrophobicContact CB-CG 4.11Å
610	C	89.4	Confident	88	Confident	11 Å²	11	45.3 Å²	45.3	7%	0.074	30%	0.298	C	S	.	.			trans	-117.8	150.1	180	59.3	0	0	0	0	110.5	A565 C570 A608	A565-C610 HydrophobicContact CB-CB 4.01Å; A565-C610 VanDerWaalsContact O-CB 3.31Å; A565-C610 WeakPolarHBondContact O-CB 3.26Å; C570-C610 HydrophobicContact CB-CB 4.38Å; A608-C610 VanDerWaalsContact C-N 3.32Å; A608-C610 PolarHBondContact O-N 2.93Å; A608-C610 VanDerWaalsContact O-N 3.11Å
611	T	91.7	Very high	88.5	Confident	7 Å²	7	42.9 Å²	42.9	4%	0.043	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	126	165.2	-70.1	0	0	0	0	108.7	S484 D502 I503 G568 V569 C570 M613	S484-T611 WeakPolarHBondContact OG-CG2 3.27Å; D502-T611 WeakPolarHBondContact CB-OG1 3.42Å; D502-T611 PolarHBondContact OD1-OG1 2.98Å; D502-T611 VanDerWaalsContact OD1-OG1 3.11Å; I503-T611 WeakPolarHBondContact O-CG2 3.41Å; G568-T611 PolarHBondContact O-N 3.11Å; G568-T611 VanDerWaalsContact O-N 3.1Å; V569-T611 CarbonylContact C-O 3.56Å; V569-T611 WeakPolarHBondContact CA-O 3.27Å; C570-T611 PolarHBondContact N-O 2.92Å; T611-M613 HydrophobicContact CG2-CE 4.47Å; T611-M613 HydrophobicContact CG2-CG 4.49Å
612	V	92.9	Very high	89	Confident	3 Å²	3	48 Å²	48	2%	0.018	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.2	178.7	-177.9	0	0	0	0	109.6	N504 V505 I572 M590 F643	N504-V612 VanDerWaalsContact CA-O 3.31Å; N504-V612 WeakPolarHBondContact CA-O 3.12Å; N504-V612 PolarHBondContact OD1-N 2.71Å; V505-V612 PolarHBondContact N-O 3.08Å; I572-V612 HydrophobicContact CD1-CG1 3.91Å; I572-V612 HydrophobicContact CG1-CG1 4.47Å; M590-V612 HydrophobicContact CG-CG2 4.4Å; V612-F643 HydrophobicContact CG1-CE1 4.25Å; V612-F643 HydrophobicContact CG1-CZ 4.47Å
613	M	94.1	Very high	89.4	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	115.5	167.9	-57.6	-178.3	-176	0	0	108.9	L481 S484 L485 V505 L519 V522 V569 C570 L571 I572 T611	L481-M613 HydrophobicContact CD2-SD 3.89Å; S484-M613 WeakPolarHBondContact OG-CE 3.42Å; L485-M613 HydrophobicContact CD2-CE 4.38Å; L485-M613 HydrophobicContact CG-CE 4.34Å; V505-M613 WeakPolarHBondContact O-CA 3.2Å; L519-M613 HydrophobicContact CD2-CB 4.02Å; V522-M613 HydrophobicContact CB-SD 4.44Å; V522-M613 HydrophobicContact CG1-CE 4.14Å; V522-M613 HydrophobicContact CG1-SD 3.73Å; V522-M613 HydrophobicContact CG2-SD 4.22Å; V569-M613 HydrophobicContact CG1-CB 4.49Å; V569-M613 HydrophobicContact CG1-CE 3.83Å; V569-M613 HydrophobicContact CG1-CG 3.84Å; V569-M613 HydrophobicContact CG1-SD 3.78Å; V569-M613 HydrophobicContact CG2-CE 4.4Å; C570-M613 PolarHBondContact O-N 3.39Å; L571-M613 WeakPolarHBondContact CA-O 3.08Å; L571-M613 HydrophobicContact CD2-CB 3.89Å; L571-M613 HydrophobicContact CD2-CG 4.33Å; L571-M613 HydrophobicContact CD2-SD 3.96Å; I572-M613 PolarHBondContact N-O 2.87Å; T611-M613 HydrophobicContact CG2-CE 4.47Å; T611-M613 HydrophobicContact CG2-CG 4.49Å
614	A	93.1	Very high	89.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	145.1	-175	0	0	0	0	0	111.6	V505 L506 L507 I572 F575 F643	V505-A614 PolarHBondContact O-N 3.46Å; L506-A614 WeakPolarHBondContact CA-O 3.11Å; L506-A614 HydrophobicContact CD1-CB 3.7Å; L507-A614 PolarHBondContact N-O 2.86Å; I572-A614 HydrophobicContact CB-CB 4.39Å; I572-A614 CarbonylContact O-C 3.58Å; I572-A614 VanDerWaalsContact O-CA 3.23Å; I572-A614 WeakPolarHBondContact O-CA 3.32Å; F575-A614 HydrophobicContact CB-CB 4.15Å; F575-A614 HydrophobicContact CD2-CB 3.9Å; F575-A614 HydrophobicContact CG-CB 4Å; A614-F643 HydrophobicContact CB-CE1 4.22Å; A614-F643 HydrophobicContact CB-CZ 4.15Å
615	A	93	Very high	89.4	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.008	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	133.4	165.6	0	0	0	0	0	109.9	L507 K515 L519 I572 E574 F575	L507-A615 HydrophobicContact CB-CB 4.5Å; L507-A615 CarbonylContact O-C 3.52Å; L507-A615 WeakPolarHBondContact O-CA 3.46Å; K515-A615 HydrophobicContact CB-CB 4.3Å; L519-A615 HydrophobicContact CD1-CB 3.78Å; I572-A615 PolarHBondContact O-N 2.88Å; E574-A615 PolarHBondContact N-O 3.02Å; F575-A615 WeakPolarHBondContact CB-O 3.32Å; F575-A615 PolarHBondContact N-O 2.74Å
616	A	92.1	Very high	89.3	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	151.6	178.1	0	0	0	0	0	110.6	L506 L507 C508 K515 F575	L506-A616 HydrophobicContact CD1-CB 4.12Å; L507-A616 PolarHBondContact O-N 3.41Å; C508-A616 WeakPolarHBondContact CA-O 3.31Å; K515-A616 PolarHBondContact NZ-O 3.44Å; F575-A616 HydrophobicContact CB-CB 4.35Å
617	N	91.4	Very high	89.2	Confident	47 Å²	47	45.9 Å²	45.9	25%	0.251	26%	0.259	S	S	.	.			trans	-105.5	145.7	174.2	-64.7	-37	0	0	0	111	K515 D576	K515-N617 PolarHBondContact NZ-OD1 3.47Å; D576-N617 PolarHBondContact OD1-N 3.24Å
618	P	91.4	Very high	88.9	Confident	8 Å²	8	41.6 Å²	41.6	5%	0.052	24%	0.241	C	C	.	.			trans	-72.4	151.8	175.8	31	-36	0	0	0	110.4	G509 G621 Y623 N632	G509-P618 WeakPolarHBondContact O-CD 3.38Å; P618-G621 PolarHBondContact O-N 2.94Å; P618-Y623 HydrophobicContact CB-CD2 4.23Å; P618-N632 WeakPolarHBondContact CA-O 3.4Å
619	I	88.7	Confident	88.7	Confident	99 Å²	99	41.6 Å²	41.6	51%	0.508	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-61.8	138.7	173.1	-59.8	167.8	0	0	0	108.9	G621 N632 D634	I619-G621 PolarHBondContact O-N 3.25Å; I619-N632 PolarHBondContact N-O 2.95Å; I619-D634 HydrophobicContact CD1-CB 4.07Å; I619-D634 HydrophobicContact CG1-CB 4.38Å
620	G	85.9	Confident	88.4	Confident	81 Å²	81	41.4 Å²	41.4	84%	0.835	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	75.9	4.7	-179.4	0	0	0	0	0	114.8	R622	G620-R622 PolarHBondContact O-N 3.06Å
621	G	86.1	Confident	88.2	Confident	34 Å²	34	45.9 Å²	45.9	35%	0.351	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	75.7	0.5	172.7	0	0	0	0	0	115.2	P511 P618 I619	P511-G621 WeakPolarHBondContact CD-O 3.16Å; P618-G621 PolarHBondContact O-N 2.94Å; I619-G621 PolarHBondContact O-N 3.25Å
622	R	88.4	Confident	87.9	Confident	194 Å²	194	46 Å²	46	73%	0.732	27%	0.267	S	S	*	.	S	Bend	trans	-138.6	142.5	170.1	-75.2	-169.9	178.7	-155.6	-3.7	110.8	D510 G620	D510-R622 VanDerWaalsContact OD1-CA 3.27Å; D510-R622 WeakPolarHBondContact OD1-CA 3.38Å; G620-R622 PolarHBondContact O-N 3.06Å
623	Y	88.4	Confident	87.6	Confident	13 Å²	13	46 Å²	46	5%	0.051	27%	0.267	C	S	.	.			trans	-83.2	115.9	179.4	-170.9	-84.1	0	0	0	111.5	D510 P618 P625 F629 N632 V648 R650	D510-Y623 PolarHBondContact OD1-N 2.81Å; P618-Y623 HydrophobicContact CB-CD2 4.23Å; Y623-P625 WeakPolarHBondContact O-CD 3.22Å; Y623-F629 HydrophobicContact CE2-CD2 4.06Å; Y623-N632 HydrophobicContact CD2-CB 4.21Å; Y623-N632 HydrophobicContact CE2-CB 3.91Å; Y623-V648 HydrophobicContact CD1-CG1 3.94Å; Y623-V648 HydrophobicContact CD2-CG1 3.89Å; Y623-V648 HydrophobicContact CE1-CG1 3.78Å; Y623-V648 HydrophobicContact CE2-CG1 3.71Å; Y623-V648 HydrophobicContact CE2-CG2 4.37Å; Y623-V648 HydrophobicContact CG-CG1 4Å; Y623-R650 HydrophobicContact CD1-CG 4.45Å
624	D	87	Confident	87.2	Confident	93 Å²	93	50.2 Å²	50.2	50%	0.497	29%	0.29	S	S	.	.			trans	-94.1	113.4	178.6	-81.3	-23	0	0	0	112.4	S626 L627 N632	D624-S626 PolarHBondContact O-N 3.39Å; D624-S626 VanDerWaalsContact O-N 3.17Å; D624-L627 PolarHBondContact O-N 3.03Å; D624-N632 PolarHBondContact O-ND2 3.03Å
625	P	83.5	Confident	86.7	Confident	40 Å²	40	50.8 Å²	50.8	26%	0.26	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-3.9	-175.9	32.6	-37.5	0	0	0	114.3	Y623 F790	Y623-P625 WeakPolarHBondContact O-CD 3.22Å; P625-F790 PolarHBondContact O-N 3.17Å
626	S	85.6	Confident	86.3	Confident	91 Å²	91	53.6 Å²	53.6	64%	0.636	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-30.6	176.9	-62	0	0	0	0	112	D624	D624-S626 PolarHBondContact O-N 3.39Å; D624-S626 VanDerWaalsContact O-N 3.17Å
627	L	84.8	Confident	85.9	Confident	79 Å²	79	58.9 Å²	58.9	41%	0.414	34%	0.335	S	S	.	.	S	Bend	trans	-90.3	167	177.8	-61.2	179.6	0	0	0	110.6	D624 E631	D624-L627 PolarHBondContact O-N 3.03Å; L627-E631 HydrophobicContact CB-CB 4.3Å
628	T	82.8	Confident	85.6	Confident	21 Å²	21	60 Å²	60	13%	0.129	34%	0.344	C	S	.	.			trans	-75.5	156.6	172.2	62.1	0	0	0	0	111	S630 E631 N632 K789	T628-S630 PolarHBondContact O-N 2.99Å; T628-E631 PolarHBondContact N-OE2 3.04Å; T628-E631 PolarHBondContact O-N 3.08Å; T628-E631 VanDerWaalsContact O-N 3.08Å; T628-E631 VanDerWaalsContact OG1-CG 3.31Å; T628-E631 WeakPolarHBondContact OG1-CG 3.21Å; T628-E631 PolarHBondContact OG1-N 3.42Å; T628-E631 PolarHBondContact OG1-OE2 3.44Å; T628-N632 PolarHBondContact O-N 3.26Å; T628-N632 VanDerWaalsContact O-N 3.17Å; T628-K789 HydrophobicContact CG2-CD 4.29Å; T628-K789 HydrophobicContact CG2-CG 4.08Å
629	F	83.9	Confident	85.4	Confident	1 Å²	1	59.8 Å²	59.8	0%	0.004	34%	0.343	C	S	.	.	H	α-helix	trans	-53.9	-38	173.6	178.9	-94.1	0	0	0	113.6	L506 C508 Y623 E631 N632 V633 V640 L646 V648 I742 T787	L506-F629 HydrophobicContact CD2-CE1 4.4Å; L506-F629 HydrophobicContact CD2-CZ 4.02Å; C508-F629 HydrophobicContact CB-CE2 3.65Å; C508-F629 HydrophobicContact CB-CZ 4.09Å; Y623-F629 HydrophobicContact CE2-CD2 4.06Å; F629-E631 VanDerWaalsContact C-N 3.28Å; F629-E631 PolarHBondContact O-N 3.49Å; F629-N632 PolarHBondContact O-N 3.1Å; F629-V633 HydrophobicContact CE2-CG2 4.24Å; F629-V633 HydrophobicContact CZ-CG2 4.19Å; F629-V633 PolarHBondContact O-N 3.16Å; F629-V640 HydrophobicContact CD1-CG1 4.33Å; F629-V640 HydrophobicContact CE1-CG1 4.07Å; F629-V640 HydrophobicContact CE1-CG2 4.38Å; F629-L646 HydrophobicContact CE1-CD1 4.39Å; F629-L646 HydrophobicContact CE1-CD2 4.48Å; F629-V648 HydrophobicContact CD2-CG2 3.83Å; F629-V648 HydrophobicContact CE2-CG2 3.9Å; F629-I742 HydrophobicContact CB-CD1 4.46Å; F629-T787 HydrophobicContact CB-CG2 4.27Å; F629-T787 WeakPolarHBondContact CB-O 3.5Å; F629-T787 HydrophobicContact CD2-CG2 3.98Å; F629-T787 HydrophobicContact CG-CG2 4.05Å; F629-T787 PolarHBondContact N-O 2.97Å
630	S	82.3	Confident	85.3	Confident	45 Å²	45	55.6 Å²	55.6	32%	0.315	32%	0.322	S	S	.	.	H	α-helix	trans	-70.4	-22.1	-179.8	-167.3	0	0	0	0	113.8	T628	T628-S630 PolarHBondContact O-N 2.99Å
631	E	84.6	Confident	85.2	Confident	104 Å²	104	53 Å²	53	49%	0.486	29%	0.29	S	S	.	.	H	α-helix	trans	-87	-29.6	175.8	-69.6	161.2	153.3	0	0	111.1	L627 T628 F629 V633	L627-E631 HydrophobicContact CB-CB 4.3Å; T628-E631 PolarHBondContact N-OE2 3.04Å; T628-E631 PolarHBondContact O-N 3.08Å; T628-E631 VanDerWaalsContact O-N 3.08Å; T628-E631 VanDerWaalsContact OG1-CG 3.31Å; T628-E631 WeakPolarHBondContact OG1-CG 3.21Å; T628-E631 PolarHBondContact OG1-N 3.42Å; T628-E631 PolarHBondContact OG1-OE2 3.44Å; F629-E631 VanDerWaalsContact C-N 3.28Å; F629-E631 PolarHBondContact O-N 3.49Å; E631-V633 VanDerWaalsContact C-N 3.29Å
632	N	86.8	Confident	85.3	Confident	9 Å²	9	51.9 Å²	51.9	5%	0.048	28%	0.276	C	S	.	.	H	α-helix	trans	-75.7	-18	178.3	-74.8	-24	0	0	0	113.5	P618 I619 Y623 D624 T628 F629	P618-N632 WeakPolarHBondContact CA-O 3.4Å; I619-N632 PolarHBondContact N-O 2.95Å; Y623-N632 HydrophobicContact CD2-CB 4.21Å; Y623-N632 HydrophobicContact CE2-CB 3.91Å; D624-N632 PolarHBondContact O-ND2 3.03Å; T628-N632 PolarHBondContact O-N 3.26Å; T628-N632 VanDerWaalsContact O-N 3.17Å; F629-N632 PolarHBondContact O-N 3.1Å
633	V	86.1	Confident	85.4	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.018	24%	0.242	C	C	.	.	S	Bend	trans	-126.5	130.9	-175.3	169.8	0	0	0	0	109.3	C508 F629 E631 L635	C508-V633 HydrophobicContact CB-CG2 4.48Å; C508-V633 WeakPolarHBondContact SG-CG2 3.45Å; F629-V633 HydrophobicContact CE2-CG2 4.24Å; F629-V633 HydrophobicContact CZ-CG2 4.19Å; F629-V633 PolarHBondContact O-N 3.16Å; E631-V633 VanDerWaalsContact C-N 3.29Å; V633-L635 HydrophobicContact CG1-CB 3.85Å; V633-L635 HydrophobicContact CG1-CD1 3.47Å; V633-L635 VanDerWaalsContact CG1-CD1 3.47Å; V633-L635 HydrophobicContact CG1-CG 3.44Å; V633-L635 VanDerWaalsContact CG1-CG 3.44Å; V633-L635 PolarHBondContact O-N 3.14Å
634	D	84.4	Confident	85.5	Confident	92 Å²	92	42.6 Å²	42.6	49%	0.492	24%	0.241	S	C	.	.			trans	-79.2	60.3	178.4	-173.4	40.6	0	0	0	112	R583 I619	R583-D634 IonicContact NH1-OD2 3.03Å; R583-D634 PolarHBondContact NH2-O 3.36Å; R583-D634 IonicContact NH2-OD2 2.69Å; R583-D634 PolarHBondContact NH2-OD2 3.16Å; I619-D634 HydrophobicContact CD1-CB 4.07Å; I619-D634 HydrophobicContact CG1-CB 4.38Å
635	L	83.9	Confident	85.6	Confident	11 Å²	11	38.2 Å²	38.2	6%	0.058	22%	0.218	C	C	.	.			trans	-125.3	147.6	177	-68.2	175.1	0	0	0	111.3	L506 F575 V633 V640	L506-L635 HydrophobicContact CD2-CD1 4.05Å; F575-L635 HydrophobicContact CD1-CD1 3.71Å; F575-L635 HydrophobicContact CD1-CD2 3.55Å; F575-L635 HydrophobicContact CD1-CG 4.25Å; F575-L635 HydrophobicContact CE1-CD1 3.8Å; F575-L635 HydrophobicContact CE1-CD2 3.45Å; F575-L635 VanDerWaalsContact CE1-CD2 3.45Å; F575-L635 HydrophobicContact CE1-CG 4.28Å; V633-L635 HydrophobicContact CG1-CB 3.85Å; V633-L635 HydrophobicContact CG1-CD1 3.47Å; V633-L635 VanDerWaalsContact CG1-CD1 3.47Å; V633-L635 HydrophobicContact CG1-CG 3.44Å; V633-L635 VanDerWaalsContact CG1-CG 3.44Å; V633-L635 PolarHBondContact O-N 3.14Å; L635-V640 HydrophobicContact CB-CG2 4.14Å
636	T	85	Confident	86	Confident	61 Å²	61	37.3 Å²	37.3	37%	0.374	21%	0.211	S	C	.	.			trans	-74.7	139.7	176.5	62.1	0	0	0	0	110.7	P638 I639 V640	T636-P638 VanDerWaalsContact C-N 3.32Å; T636-I639 WeakPolarHBondContact O-CB 3.3Å; T636-I639 PolarHBondContact O-N 3.46Å; T636-I639 VanDerWaalsContact OG1-CD1 3.28Å; T636-I639 WeakPolarHBondContact OG1-CD1 3.31Å; T636-I639 WeakPolarHBondContact OG1-CG1 3.46Å; T636-V640 PolarHBondContact O-N 2.95Å
637	E	82.4	Confident	86.2	Confident	110 Å²	110	33.6 Å²	33.6	51%	0.514	19%	0.185	S	C	.	.	H	α-helix	trans	-53.3	-38.1	179.9	-170.4	178.7	-173.1	0	0	114.2	I639 V640 S641	E637-I639 VanDerWaalsContact C-N 3.26Å; E637-I639 PolarHBondContact O-N 2.89Å; E637-V640 PolarHBondContact O-N 2.94Å; E637-S641 PolarHBondContact O-N 3.31Å; E637-S641 VanDerWaalsContact O-N 3.09Å
638	P	84.9	Confident	86.4	Confident	70 Å²	70	30.7 Å²	30.7	46%	0.455	17%	0.171	S	C	.	.	H	α-helix	trans	-59.1	-34.5	175.3	-25.7	36.2	0	0	0	113.7	T636 R642	T636-P638 VanDerWaalsContact C-N 3.32Å; P638-R642 WeakPolarHBondContact O-CG 3.03Å
639	I	87.8	Confident	86.7	Confident	5 Å²	5	30 Å²	30	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-73	-46	178.9	-66.9	175.2	0	0	0	110.3	F575 R583 T636 E637 S641 R642 F643	F575-I639 HydrophobicContact CE1-CG2 3.98Å; F575-I639 HydrophobicContact CZ-CG2 4.05Å; R583-I639 HydrophobicContact CB-CD1 4.07Å; R583-I639 HydrophobicContact CG-CD1 4.43Å; T636-I639 WeakPolarHBondContact O-CB 3.3Å; T636-I639 PolarHBondContact O-N 3.46Å; T636-I639 VanDerWaalsContact OG1-CD1 3.28Å; T636-I639 WeakPolarHBondContact OG1-CD1 3.31Å; T636-I639 WeakPolarHBondContact OG1-CG1 3.46Å; E637-I639 VanDerWaalsContact C-N 3.26Å; E637-I639 PolarHBondContact O-N 2.89Å; I639-S641 PolarHBondContact O-N 3.27Å; I639-R642 VanDerWaalsContact O-CB 3.31Å; I639-R642 WeakPolarHBondContact O-CB 3.44Å; I639-R642 PolarHBondContact O-N 3.14Å; I639-F643 HydrophobicContact CG2-CD2 4.46Å; I639-F643 HydrophobicContact CG2-CE2 3.83Å; I639-F643 WeakPolarHBondContact O-CD2 3.18Å
640	V	86.2	Confident	86.8	Confident	11 Å²	11	33.2 Å²	33.2	7%	0.067	18%	0.178	C	C	.	.	H	α-helix	trans	-58	-38.5	178.2	179.4	0	0	0	0	110.8	F629 L635 T636 E637 R642 F643 L646	F629-V640 HydrophobicContact CD1-CG1 4.33Å; F629-V640 HydrophobicContact CE1-CG1 4.07Å; F629-V640 HydrophobicContact CE1-CG2 4.38Å; L635-V640 HydrophobicContact CB-CG2 4.14Å; T636-V640 PolarHBondContact O-N 2.95Å; E637-V640 PolarHBondContact O-N 2.94Å; V640-R642 PolarHBondContact O-N 3.35Å; V640-R642 VanDerWaalsContact O-N 3.12Å; V640-F643 PolarHBondContact O-N 3.34Å; V640-L646 HydrophobicContact CG1-CD1 3.82Å; V640-L646 HydrophobicContact CG1-CD2 4.26Å
641	S	84.9	Confident	87	Confident	25 Å²	25	36.3 Å²	36.3	18%	0.175	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-10	175.6	-172.8	0	0	0	0	114.8	E637 I639 R747	E637-S641 PolarHBondContact O-N 3.31Å; E637-S641 VanDerWaalsContact O-N 3.09Å; I639-S641 PolarHBondContact O-N 3.27Å; S641-R747 WeakPolarHBondContact O-CD 3.48Å; S641-R747 PolarHBondContact O-NH1 3.46Å; S641-R747 PolarHBondContact OG-NH1 2.86Å
642	R	87.6	Confident	86.9	Confident	12 Å²	12	35.7 Å²	35.7	5%	0.045	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-16.3	176.7	-62.4	-66.9	177.2	-167.2	3.5	113.7	R500 N504 M590 E591 P638 I639 V640 R747	R500-R642 PolarHBondContact NH1-O 3.4Å; R500-R642 PolarHBondContact NH2-O 3.38Å; N504-R642 PolarHBondContact ND2-O 3.34Å; M590-R642 HydrophobicContact CB-CB 4.23Å; M590-R642 HydrophobicContact CB-CG 4.32Å; M590-R642 HydrophobicContact CE-CB 3.54Å; M590-R642 HydrophobicContact SD-CB 3.94Å; E591-R642 IonicContact OE1-CZ 3.3Å; E591-R642 IonicContact OE1-NH1 3.81Å; E591-R642 PolarHBondContact OE1-NH1 3.09Å; E591-R642 IonicContact OE1-NH2 2.9Å; E591-R642 PolarHBondContact OE1-NH2 3.4Å; E591-R642 IonicContact OE2-CZ 2.68Å; E591-R642 IonicContact OE2-NH1 2.78Å; E591-R642 PolarHBondContact OE2-NH1 2.86Å; E591-R642 IonicContact OE2-NH2 3.13Å; E591-R642 PolarHBondContact OE2-NH2 3.42Å; E591-R642 VanDerWaalsContact OE2-NH2 3.15Å; P638-R642 WeakPolarHBondContact O-CG 3.03Å; I639-R642 VanDerWaalsContact O-CB 3.31Å; I639-R642 WeakPolarHBondContact O-CB 3.44Å; I639-R642 PolarHBondContact O-N 3.14Å; V640-R642 PolarHBondContact O-N 3.35Å; V640-R642 VanDerWaalsContact O-N 3.12Å; R642-R747 VanDerWaalsContact CZ-NH1 3.27Å; R642-R747 VanDerWaalsContact NH1-NE 3.18Å
643	F	89.9	Confident	86.6	Confident	3 Å²	3	41.3 Å²	41.3	1%	0.013	23%	0.229	C	C	.	.			trans	-80.6	134.9	172.9	-71.8	-79.5	0	0	0	109.8	N504 L506 F575 M590 V612 A614 I639 V640 L646	N504-F643 HydrophobicContact CB-CD1 3.74Å; N504-F643 HydrophobicContact CB-CE1 4.25Å; L506-F643 HydrophobicContact CB-CB 4.36Å; L506-F643 HydrophobicContact CB-CD1 3.73Å; L506-F643 HydrophobicContact CB-CD2 4.26Å; L506-F643 HydrophobicContact CB-CE1 4.03Å; L506-F643 HydrophobicContact CB-CG 3.86Å; L506-F643 HydrophobicContact CB-CZ 4.41Å; L506-F643 HydrophobicContact CD1-CZ 4.4Å; L506-F643 HydrophobicContact CD2-CD2 4.24Å; L506-F643 HydrophobicContact CD2-CE2 4.36Å; F575-F643 HydrophobicContact CE1-CE2 4.32Å; F575-F643 HydrophobicContact CE1-CZ 4.43Å; F575-F643 HydrophobicContact CZ-CE2 4.38Å; F575-F643 HydrophobicContact CZ-CZ 4.25Å; M590-F643 HydrophobicContact CE-CD1 4.21Å; M590-F643 HydrophobicContact CE-CD2 4.29Å; M590-F643 HydrophobicContact CE-CE1 4.01Å; M590-F643 HydrophobicContact CE-CE2 4.1Å; M590-F643 HydrophobicContact CE-CG 4.35Å; M590-F643 HydrophobicContact CE-CZ 3.95Å; V612-F643 HydrophobicContact CG1-CE1 4.25Å; V612-F643 HydrophobicContact CG1-CZ 4.47Å; A614-F643 HydrophobicContact CB-CE1 4.22Å; A614-F643 HydrophobicContact CB-CZ 4.15Å; I639-F643 HydrophobicContact CG2-CD2 4.46Å; I639-F643 HydrophobicContact CG2-CE2 3.83Å; I639-F643 WeakPolarHBondContact O-CD2 3.18Å; V640-F643 PolarHBondContact O-N 3.34Å; F643-L646 HydrophobicContact CB-CD2 3.76Å; F643-L646 HydrophobicContact CG-CD2 4.48Å
644	D	90.3	Very high	86.3	Confident	8 Å²	8	43 Å²	43	4%	0.043	24%	0.238	C	C	.	.	S	Bend	trans	-85.8	-34.9	-179.1	-76.6	-16.1	0	0	0	110.4	R500 I503 N504 S751 R754	R500-D644 IonicContact CZ-OD1 3.77Å; R500-D644 IonicContact NH2-OD1 3.42Å; R500-D644 PolarHBondContact NH2-OD1 2.86Å; R500-D644 IonicContact NH2-OD2 3.6Å; I503-D644 HydrophobicContact CG2-CB 4Å; N504-D644 PolarHBondContact O-N 3.06Å; D644-S751 WeakPolarHBondContact OD1-CB 3.4Å; D644-S751 PolarHBondContact OD1-OG 2.9Å; D644-R754 IonicContact OD1-NH1 3.36Å; D644-R754 PolarHBondContact OD1-NH1 2.92Å; D644-R754 IonicContact OD2-NH1 2.75Å; D644-R754 PolarHBondContact OD2-NH1 3.45Å; D644-R754 VanDerWaalsContact OD2-NH1 3.17Å
645	V	90	Very high	86.1	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	128.5	178	-172.6	0	0	0	0	110.5	A480 I503 N504 V505 L506 M755	A480-V645 HydrophobicContact CB-CG1 3.89Å; I503-V645 HydrophobicContact CG2-CG2 4.45Å; N504-V645 PolarHBondContact O-N 3.02Å; N504-V645 VanDerWaalsContact O-N 3.15Å; V505-V645 WeakPolarHBondContact CA-O 3.11Å; V505-V645 HydrophobicContact CG2-CB 4.39Å; L506-V645 PolarHBondContact N-O 3.36Å; V645-M755 HydrophobicContact CG2-CE 4.33Å; V645-M755 HydrophobicContact CG2-SD 3.79Å
646	L	91.3	Very high	85.9	Confident	20 Å²	20	41.2 Å²	41.2	11%	0.105	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	108.1	174.9	-57.4	176.8	0	0	0	108.9	L506 F629 V640 F643 S783 T787	L506-L646 HydrophobicContact CB-CD2 3.89Å; L506-L646 HydrophobicContact CD2-CD2 3.94Å; L506-L646 HydrophobicContact CG-CD2 4.45Å; F629-L646 HydrophobicContact CE1-CD1 4.39Å; F629-L646 HydrophobicContact CE1-CD2 4.48Å; V640-L646 HydrophobicContact CG1-CD1 3.82Å; V640-L646 HydrophobicContact CG1-CD2 4.26Å; F643-L646 HydrophobicContact CB-CD2 3.76Å; F643-L646 HydrophobicContact CG-CD2 4.48Å; L646-S783 VanDerWaalsContact C-OG 3.26Å; L646-S783 WeakPolarHBondContact CA-OG 3.36Å; L646-S783 PolarHBondContact N-OG 2.84Å; L646-S783 WeakPolarHBondContact O-CA 3.12Å; L646-S783 WeakPolarHBondContact O-CB 3.3Å; L646-S783 PolarHBondContact O-OG 3.1Å; L646-T787 HydrophobicContact CB-CG2 3.77Å; L646-T787 HydrophobicContact CD1-CG2 3.93Å
647	C	90.7	Very high	85.7	Confident	14 Å²	14	42.4 Å²	42.4	10%	0.095	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	119.1	177.6	-64.1	0	0	0	0	109.4	I477 L506 L507 C508	I477-C647 HydrophobicContact CG1-CB 4.19Å; L506-C647 PolarHBondContact O-N 3.19Å; L507-C647 HydrophobicContact CD2-CB 3.66Å; C508-C647 PolarHBondContact N-O 3.26Å
648	V	89.6	Confident	85.8	Confident	18 Å²	18	40.4 Å²	40.4	11%	0.109	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	115.5	174	-175.8	0	0	0	0	109.1	C508 Y623 F629 R650 T787	C508-V648 CarbonylContact O-C 3.58Å; C508-V648 WeakPolarHBondContact O-CA 3.14Å; Y623-V648 HydrophobicContact CD1-CG1 3.94Å; Y623-V648 HydrophobicContact CD2-CG1 3.89Å; Y623-V648 HydrophobicContact CE1-CG1 3.78Å; Y623-V648 HydrophobicContact CE2-CG1 3.71Å; Y623-V648 HydrophobicContact CE2-CG2 4.37Å; Y623-V648 HydrophobicContact CG-CG1 4Å; F629-V648 HydrophobicContact CD2-CG2 3.83Å; F629-V648 HydrophobicContact CE2-CG2 3.9Å; V648-R650 HydrophobicContact CG1-CG 4.03Å; V648-T787 HydrophobicContact CG2-CG2 4.12Å
649	V	88.2	Confident	85.7	Confident	5 Å²	5	39.7 Å²	39.7	3%	0.03	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	123.7	174	-160.4	0	0	0	0	108.5	H474 I477 C508 G509 D510 T513	H474-V649 VanDerWaalsContact CE1-CG1 3.44Å; H474-V649 WeakPolarHBondContact CE1-CG1 3.4Å; I477-V649 HydrophobicContact CD1-CG1 4.48Å; I477-V649 HydrophobicContact CD1-CG2 3.45Å; I477-V649 VanDerWaalsContact CD1-CG2 3.45Å; C508-V649 PolarHBondContact O-N 3.43Å; G509-V649 WeakPolarHBondContact CA-O 3.39Å; D510-V649 PolarHBondContact N-O 2.92Å; T513-V649 HydrophobicContact CG2-CG1 3.97Å
650	R	86	Confident	85.5	Confident	69 Å²	69	40.2 Å²	40.2	26%	0.26	22%	0.219	S	C	.	.			trans	-118.8	135	178.7	-60.9	-178.9	-178.6	169.6	0.9	108.6	Y623 V648 D786 M793	Y623-R650 HydrophobicContact CD1-CG 4.45Å; V648-R650 HydrophobicContact CG1-CG 4.03Å; R650-D786 PolarHBondContact NH2-O 3.22Å; R650-M793 VanDerWaalsContact NH2-CE 3.26Å
651	D	85.6	Confident	85.5	Confident	111 Å²	111	43.4 Å²	43.4	59%	0.594	24%	0.235	S	C	*	.			trans	-86.1	109.5	169.2	-172.1	17.4	0	0	0	109.3	D510 T513	D510-D651 PolarHBondContact OD2-N 3.41Å; D510-D651 VanDerWaalsContact OD2-N 3.09Å; T513-D651 HydrophobicContact CG2-CB 4.49Å
652	T	82.7	Confident	85.6	Confident	91 Å²	91	44.8 Å²	44.8	56%	0.558	25%	0.249	S	C	*	.			trans	-115.5	126.6	175.3	58.1	0	0	0	0	109.6	D654	T652-D654 PolarHBondContact O-N 3.47Å; T652-D654 VanDerWaalsContact O-N 3.08Å
653	V	81.9	Confident	85.6	Confident	126 Å²	126	50.1 Å²	50.1	76%	0.764	27%	0.269	S	S	*	.			trans	-72.4	101.5	-179.1	-171.7	0	0	0	0	110.3
654	D	79.9	Confident	85.3	Confident	40 Å²	40	52 Å²	52	21%	0.214	28%	0.277	C	S	.	.			trans	-122.3	111.5	172.2	-178.1	2.3	0	0	0	109.6	T652 V656 Q657 D658 K819	T652-D654 PolarHBondContact O-N 3.47Å; T652-D654 VanDerWaalsContact O-N 3.08Å; D654-V656 PolarHBondContact O-N 3.37Å; D654-V656 VanDerWaalsContact O-N 3.1Å; D654-V656 PolarHBondContact OD1-N 3.39Å; D654-Q657 HydrophobicContact CB-CB 4.16Å; D654-Q657 HydrophobicContact CB-CG 4.21Å; D654-Q657 PolarHBondContact O-N 3Å; D654-Q657 VanDerWaalsContact O-N 3.08Å; D654-D658 VanDerWaalsContact O-CG 3.28Å; D654-D658 PolarHBondContact O-N 2.89Å; D654-K819 IonicContact OD2-NZ 3.83Å
655	P	79.1	Confident	85.1	Confident	60 Å²	60	54.6 Å²	54.6	39%	0.39	29%	0.293	S	S	.	.	H	α-helix	trans	-54.2	-34.8	-175.2	-26.5	33.4	0	0	0	114.8	E659 F886	P655-E659 PolarHBondContact O-N 3.33Å; P655-E659 VanDerWaalsContact O-N 3.09Å; P655-F886 HydrophobicContact CB-CD1 3.73Å; P655-F886 HydrophobicContact CB-CE1 3.88Å; P655-F886 HydrophobicContact CB-CG 4.5Å; P655-F886 HydrophobicContact CG-CD1 4.3Å; P655-F886 HydrophobicContact CG-CE1 3.98Å; P655-F886 HydrophobicContact CG-CZ 4.45Å
656	V	79.8	Confident	85.1	Confident	5 Å²	5	58.6 Å²	58.6	3%	0.03	32%	0.317	C	S	.	.	H	α-helix	trans	-72.4	-41.5	-178.4	-179.5	0	0	0	0	110.7	D654 M660 F886	D654-V656 PolarHBondContact O-N 3.37Å; D654-V656 VanDerWaalsContact O-N 3.1Å; D654-V656 PolarHBondContact OD1-N 3.39Å; V656-M660 HydrophobicContact CG1-CE 3.64Å; V656-M660 HydrophobicContact CG1-SD 4.27Å; V656-M660 VanDerWaalsContact O-CG 3.27Å; V656-M660 WeakPolarHBondContact O-CG 3.4Å; V656-M660 PolarHBondContact O-N 3.01Å; V656-F886 HydrophobicContact CG2-CD1 3.99Å; V656-F886 HydrophobicContact CG2-CE1 4.09Å
657	Q	80.2	Confident	84.8	Confident	85 Å²	85	58.9 Å²	58.9	40%	0.397	33%	0.325	S	S	.	.	H	α-helix	trans	-69.8	-37.1	177.6	-68.4	-177.6	-24.6	0	0	111.2	D654 M660 L661	D654-Q657 HydrophobicContact CB-CB 4.16Å; D654-Q657 HydrophobicContact CB-CG 4.21Å; D654-Q657 PolarHBondContact O-N 3Å; D654-Q657 VanDerWaalsContact O-N 3.08Å; Q657-M660 PolarHBondContact O-N 3.46Å; Q657-L661 VanDerWaalsContact O-CB 3.3Å; Q657-L661 WeakPolarHBondContact O-CB 3.39Å; Q657-L661 PolarHBondContact O-N 3.02Å
658	D	84.9	Confident	84.5	Confident	68 Å²	68	59.8 Å²	59.8	36%	0.364	33%	0.332	S	S	.	.	H	α-helix	trans	-62.5	-42.8	176	-68	-17	0	0	0	111.5	D654 L661 A662	D654-D658 VanDerWaalsContact O-CG 3.28Å; D654-D658 PolarHBondContact O-N 2.89Å; D658-L661 PolarHBondContact O-N 2.79Å; D658-A662 WeakPolarHBondContact O-CB 3.12Å; D658-A662 PolarHBondContact O-N 2.54Å
659	E	84.1	Confident	84.2	Confident	55 Å²	55	65.7 Å²	65.7	26%	0.257	36%	0.358	S	S	.	.	H	α-helix	trans	-64	-42.9	176.2	-162.5	-161.7	-165.8	0	0	111.6	P655 A662 R663	P655-E659 PolarHBondContact O-N 3.33Å; P655-E659 VanDerWaalsContact O-N 3.09Å; E659-A662 PolarHBondContact O-N 3.2Å; E659-R663 VanDerWaalsContact CD-CZ 3.44Å; E659-R663 WeakPolarHBondContact O-CB 3.4Å; E659-R663 WeakPolarHBondContact O-CG 3.46Å; E659-R663 PolarHBondContact O-N 3.48Å; E659-R663 IonicContact OE1-CZ 2.78Å; E659-R663 IonicContact OE1-NH1 3.17Å; E659-R663 PolarHBondContact OE1-NH1 2.8Å; E659-R663 VanDerWaalsContact OE1-NH1 3.11Å; E659-R663 IonicContact OE1-NH2 2.86Å; E659-R663 PolarHBondContact OE1-NH2 3.08Å; E659-R663 IonicContact OE2-CZ 3.75Å; E659-R663 IonicContact OE2-NH1 3.63Å; E659-R663 PolarHBondContact OE2-NH1 2.9Å; E659-R663 IonicContact OE2-NH2 3.91Å
660	M	82.3	Confident	84.1	Confident	16 Å²	16	70.7 Å²	70.7	8%	0.079	38%	0.383	C	S	.	.	H	α-helix	trans	-63.4	-44.9	177	-69.8	171.2	179.1	0	0	111.6	Y472 V656 Q657 R663 F664 N690	Y472-M660 HydrophobicContact CE1-CB 3.91Å; Y472-M660 PolarHBondContact OH-SD 3.01Å; V656-M660 HydrophobicContact CG1-CE 3.64Å; V656-M660 HydrophobicContact CG1-SD 4.27Å; V656-M660 VanDerWaalsContact O-CG 3.27Å; V656-M660 WeakPolarHBondContact O-CG 3.4Å; V656-M660 PolarHBondContact O-N 3.01Å; Q657-M660 PolarHBondContact O-N 3.46Å; M660-R663 PolarHBondContact O-N 3.33Å; M660-F664 WeakPolarHBondContact O-CB 3.36Å; M660-F664 PolarHBondContact O-N 3.3Å; M660-N690 WeakPolarHBondContact CE-ND2 3.22Å; M660-N690 PolarHBondContact SD-ND2 2.75Å
661	L	85.8	Confident	83.8	Confident	78 Å²	78	74 Å²	74	41%	0.408	40%	0.4	S	S	.	.	H	α-helix	trans	-63.5	-45.4	176.6	-179.6	64	0	0	0	110.9	Q657 D658 F664 V665	Q657-L661 VanDerWaalsContact O-CB 3.3Å; Q657-L661 WeakPolarHBondContact O-CB 3.39Å; Q657-L661 PolarHBondContact O-N 3.02Å; D658-L661 PolarHBondContact O-N 2.79Å; L661-F664 WeakPolarHBondContact O-CB 3.34Å; L661-F664 PolarHBondContact O-N 2.79Å; L661-V665 HydrophobicContact CD1-CG2 4.22Å; L661-V665 HydrophobicContact CG-CG2 4.44Å; L661-V665 VanDerWaalsContact O-CG2 3.3Å; L661-V665 WeakPolarHBondContact O-CG2 3.47Å; L661-V665 PolarHBondContact O-N 3.28Å
662	A	87.2	Confident	83.5	Confident	55 Å²	55	75.8 Å²	75.8	46%	0.455	40%	0.404	S	S	.	.	H	α-helix	trans	-61	-46.9	178.5	0	0	0	0	0	111.6	D658 E659 F664 V665 V666	D658-A662 WeakPolarHBondContact O-CB 3.12Å; D658-A662 PolarHBondContact O-N 2.54Å; E659-A662 PolarHBondContact O-N 3.2Å; A662-F664 VanDerWaalsContact C-N 3.31Å; A662-F664 PolarHBondContact O-N 3.35Å; A662-V665 PolarHBondContact O-N 2.95Å; A662-V666 WeakPolarHBondContact O-CB 3.49Å; A662-V666 VanDerWaalsContact O-CG2 3.24Å; A662-V666 WeakPolarHBondContact O-CG2 2.93Å; A662-V666 PolarHBondContact O-N 3.14Å
663	R	87.4	Confident	83.5	Confident	123 Å²	123	76.7 Å²	76.7	46%	0.464	40%	0.402	S	S	.	.	H	α-helix	trans	-58.6	-43.4	174.6	-77.8	-174.9	174.5	123.8	7.5	111.8	E659 M660 G667	E659-R663 VanDerWaalsContact CD-CZ 3.44Å; E659-R663 WeakPolarHBondContact O-CB 3.4Å; E659-R663 WeakPolarHBondContact O-CG 3.46Å; E659-R663 PolarHBondContact O-N 3.48Å; E659-R663 IonicContact OE1-CZ 2.78Å; E659-R663 IonicContact OE1-NH1 3.17Å; E659-R663 PolarHBondContact OE1-NH1 2.8Å; E659-R663 VanDerWaalsContact OE1-NH1 3.11Å; E659-R663 IonicContact OE1-NH2 2.86Å; E659-R663 PolarHBondContact OE1-NH2 3.08Å; E659-R663 IonicContact OE2-CZ 3.75Å; E659-R663 IonicContact OE2-NH1 3.63Å; E659-R663 PolarHBondContact OE2-NH1 2.9Å; E659-R663 IonicContact OE2-NH2 3.91Å; M660-R663 PolarHBondContact O-N 3.33Å; R663-G667 PolarHBondContact O-N 2.78Å
664	F	84.9	Confident	83.6	Confident	43 Å²	43	75.4 Å²	75.4	19%	0.189	40%	0.396	C	S	.	.	H	α-helix	trans	-63.6	-46.5	179	178.2	-93.1	0	0	0	112.1	P469 S470 M660 L661 A662 G667 S668 L688	P469-F664 VanDerWaalsContact O-CZ 3.28Å; P469-F664 WeakPolarHBondContact O-CZ 3.12Å; S470-F664 VanDerWaalsContact O-CE1 3.24Å; S470-F664 WeakPolarHBondContact O-CE1 3.44Å; M660-F664 WeakPolarHBondContact O-CB 3.36Å; M660-F664 PolarHBondContact O-N 3.3Å; L661-F664 WeakPolarHBondContact O-CB 3.34Å; L661-F664 PolarHBondContact O-N 2.79Å; A662-F664 VanDerWaalsContact C-N 3.31Å; A662-F664 PolarHBondContact O-N 3.35Å; F664-G667 PolarHBondContact O-N 3.39Å; F664-S668 WeakPolarHBondContact O-CB 3.39Å; F664-S668 PolarHBondContact O-N 3.44Å; F664-L688 HydrophobicContact CB-CD1 4.38Å; F664-L688 HydrophobicContact CD2-CD1 3.59Å; F664-L688 HydrophobicContact CE2-CD1 4.43Å; F664-L688 HydrophobicContact CG-CD1 4.47Å
665	V	86.6	Confident	83.5	Confident	63 Å²	63	78.3 Å²	78.3	38%	0.382	42%	0.42	S	S	.	.	H	α-helix	trans	-63.5	-45.4	178.4	171.2	0	0	0	0	111	L661 A662 G667 S668 H669	L661-V665 HydrophobicContact CD1-CG2 4.22Å; L661-V665 HydrophobicContact CG-CG2 4.44Å; L661-V665 VanDerWaalsContact O-CG2 3.3Å; L661-V665 WeakPolarHBondContact O-CG2 3.47Å; L661-V665 PolarHBondContact O-N 3.28Å; A662-V665 PolarHBondContact O-N 2.95Å; V665-G667 VanDerWaalsContact C-N 3.35Å; V665-G667 PolarHBondContact O-N 3.07Å; V665-S668 WeakPolarHBondContact O-CB 3.4Å; V665-S668 PolarHBondContact O-N 2.94Å; V665-H669 PolarHBondContact O-CD2 2.9Å; V665-H669 VanDerWaalsContact O-CD2 3.27Å; V665-H669 PolarHBondContact O-N 2.82Å
666	V	88.9	Confident	82.9	Confident	85 Å²	85	79.4 Å²	79.4	52%	0.515	42%	0.422	S	S	.	.	H	α-helix	trans	-60.8	-45.2	176.2	171.6	0	0	0	0	110.7	A662 S668 H669 I670	A662-V666 WeakPolarHBondContact O-CB 3.49Å; A662-V666 VanDerWaalsContact O-CG2 3.24Å; A662-V666 WeakPolarHBondContact O-CG2 2.93Å; A662-V666 PolarHBondContact O-N 3.14Å; V666-S668 VanDerWaalsContact C-N 3.32Å; V666-S668 PolarHBondContact O-N 2.84Å; V666-H669 PolarHBondContact O-N 3.47Å; V666-I670 HydrophobicContact CG1-CD1 3.81Å; V666-I670 HydrophobicContact CG1-CG1 4.49Å; V666-I670 VanDerWaalsContact O-CG1 3.28Å; V666-I670 WeakPolarHBondContact O-CG1 3.47Å; V666-I670 PolarHBondContact O-N 2.92Å
667	G	86.3	Confident	81.8	Confident	27 Å²	27	88.2 Å²	88.2	28%	0.278	46%	0.46	S	S	.	.	H	α-helix	trans	-59.3	-40.9	175.7	0	0	0	0	0	112.9	R663 F664 V665 I670 K671	R663-G667 PolarHBondContact O-N 2.78Å; F664-G667 PolarHBondContact O-N 3.39Å; V665-G667 VanDerWaalsContact C-N 3.35Å; V665-G667 PolarHBondContact O-N 3.07Å; G667-I670 PolarHBondContact O-N 3.28Å; G667-K671 WeakPolarHBondContact O-CG 3.28Å; G667-K671 PolarHBondContact O-N 3.13Å; G667-K671 VanDerWaalsContact O-N 3.16Å
668	S	83.1	Confident	80.3	Confident	33 Å²	33	93.4 Å²	93.4	23%	0.231	48%	0.484	C	S	.	.	H	α-helix	trans	-62.5	-47.1	175.5	-176.8	0	0	0	0	112	F664 V665 V666 I670 K671 H672	F664-S668 WeakPolarHBondContact O-CB 3.39Å; F664-S668 PolarHBondContact O-N 3.44Å; V665-S668 WeakPolarHBondContact O-CB 3.4Å; V665-S668 PolarHBondContact O-N 2.94Å; V666-S668 VanDerWaalsContact C-N 3.32Å; V666-S668 PolarHBondContact O-N 2.84Å; S668-I670 VanDerWaalsContact C-N 3.32Å; S668-I670 PolarHBondContact O-N 3.38Å; S668-K671 PolarHBondContact O-N 2.72Å; S668-K671 VanDerWaalsContact O-N 3.15Å; S668-H672 PolarHBondContact O-CD2 2.9Å; S668-H672 PolarHBondContact O-N 3.04Å; S668-H672 VanDerWaalsContact O-N 3.1Å; S668-H672 PolarHBondContact OG-CD2 3.38Å
669	H	84.4	Confident	78.1	Confident	141 Å²	141	92.1 Å²	92.1	65%	0.653	49%	0.487	S	S	*	.	H	α-helix	trans	-63.3	-35.9	177.9	-83.2	-72.6	0	0	0	113.3	V665 V666 K671 H672	V665-H669 PolarHBondContact O-CD2 2.9Å; V665-H669 VanDerWaalsContact O-CD2 3.27Å; V665-H669 PolarHBondContact O-N 2.82Å; V666-H669 PolarHBondContact O-N 3.47Å; H669-K671 VanDerWaalsContact C-N 3.33Å; H669-H672 PolarHBondContact O-N 3.41Å
670	I	84.8	Confident	76.1	Confident	111 Å²	111	93.5 Å²	93.5	57%	0.569	52%	0.516	S	S	*	.	H	α-helix	trans	-64.2	-39.6	175.1	-68.3	165.4	0	0	0	110.9	V666 G667 S668	V666-I670 HydrophobicContact CG1-CD1 3.81Å; V666-I670 HydrophobicContact CG1-CG1 4.49Å; V666-I670 VanDerWaalsContact O-CG1 3.28Å; V666-I670 WeakPolarHBondContact O-CG1 3.47Å; V666-I670 PolarHBondContact O-N 2.92Å; G667-I670 PolarHBondContact O-N 3.28Å; S668-I670 VanDerWaalsContact C-N 3.32Å; S668-I670 PolarHBondContact O-N 3.38Å
671	K	81	Confident	73.9	Confident	139 Å²	139	98.5 Å²	98.5	60%	0.604	55%	0.547	S	S	*	.	H	α-helix	trans	-69.3	-35.3	179.2	-71.1	179.7	-178.4	-168.9	0	112.7	G667 S668 H669 H673	G667-K671 WeakPolarHBondContact O-CG 3.28Å; G667-K671 PolarHBondContact O-N 3.13Å; G667-K671 VanDerWaalsContact O-N 3.16Å; S668-K671 PolarHBondContact O-N 2.72Å; S668-K671 VanDerWaalsContact O-N 3.15Å; H669-K671 VanDerWaalsContact C-N 3.33Å; K671-H673 VanDerWaalsContact C-N 3.28Å; K671-H673 PolarHBondContact O-N 3.16Å
672	H	78.8	Confident	71.7	Confident	147 Å²	147	99 Å²	99	68%	0.681	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	25.7	-171.3	-69.5	-53.2	0	0	0	115.8	S668 H669	S668-H672 PolarHBondContact O-CD2 2.9Å; S668-H672 PolarHBondContact O-N 3.04Å; S668-H672 VanDerWaalsContact O-N 3.1Å; S668-H672 PolarHBondContact OG-CD2 3.38Å; H669-H672 PolarHBondContact O-N 3.41Å
673	H	83.1	Confident	69.4	Low	110 Å²	110	103.8 Å²	103.8	51%	0.509	58%	0.58	S	S	.	*			trans	-87.4	135.9	177.9	-168.5	65.1	0	0	0	112.6	K671 S675 N676	K671-H673 VanDerWaalsContact C-N 3.28Å; K671-H673 PolarHBondContact O-N 3.16Å; H673-S675 VanDerWaalsContact C-N 3.27Å; H673-S675 PolarHBondContact NE2-OG 3.36Å; H673-S675 PolarHBondContact O-N 3.12Å; H673-N676 PolarHBondContact O-N 2.77Å
674	P	82.2	Confident	66.9	Low	99 Å²	99	106.2 Å²	106.2	64%	0.643	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-55.7	-34.7	-178.6	-27.3	35.3	0	0	0	114.9	N676	P674-N676 VanDerWaalsContact C-N 3.25Å; P674-N676 PolarHBondContact O-N 2.78Å
675	S	78.1	Confident	64.8	Low	102 Å²	102	110.3 Å²	110.3	71%	0.713	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-74.3	-10.9	179.3	-47.8	0	0	0	0	114.2	H673	H673-S675 VanDerWaalsContact C-N 3.27Å; H673-S675 PolarHBondContact NE2-OG 3.36Å; H673-S675 PolarHBondContact O-N 3.12Å
676	N	67.2	Low	62.6	Low	83 Å²	83	113.2 Å²	113.2	44%	0.444	64%	0.638	S	S	.	*	G	3₁₀ helix	trans	-95.2	7.8	-177.6	-148.3	18.6	0	0	0	113.2	H673 P674 E678	H673-N676 PolarHBondContact O-N 2.77Å; P674-N676 VanDerWaalsContact C-N 3.25Å; P674-N676 PolarHBondContact O-N 2.78Å; N676-E678 VanDerWaalsContact C-N 3.35Å; N676-E678 PolarHBondContact O-N 2.85Å
677	K	56.7	Low	60.3	Low	189 Å²	189	114 Å²	114	82%	0.822	64%	0.643	S	S	*	*	S	Bend	trans	-72.6	-18.3	-177.4	-83.7	-175.3	173	-177.2	0	115
678	E	48.8	Very low	58.1	Low	194 Å²	194	114.8 Å²	114.8	91%	0.907	64%	0.64	S	S	*	*	S	Bend	trans	-105.9	-5.9	-178.7	-68.7	-176.6	163	0	0	113.7	N676 G680	N676-E678 VanDerWaalsContact C-N 3.35Å; N676-E678 PolarHBondContact O-N 2.85Å; E678-G680 PolarHBondContact O-N 2.81Å; E678-G680 VanDerWaalsContact O-N 3.16Å
679	G	39.6	Very low	56	Low	41 Å²	41	117.5 Å²	117.5	42%	0.423	66%	0.657	S	S	.	*			trans	-88	76.5	179.9	0	0	0	0	0	112.3	V681	G679-V681 PolarHBondContact O-N 2.87Å
680	G	40.8	Very low	54	Low	84 Å²	84	112.8 Å²	112.8	87%	0.866	64%	0.637	S	S	*	*			trans	-65.3	27.6	165	0	0	0	0	0	114.1	E678 A682	E678-G680 PolarHBondContact O-N 2.81Å; E678-G680 VanDerWaalsContact O-N 3.16Å; G680-A682 PolarHBondContact O-N 2.8Å
681	V	36.2	Very low	52.1	Low	121 Å²	121	111.1 Å²	111.1	73%	0.733	64%	0.635	S	S	*	*			trans	-86.4	101.2	166.3	-169.8	0	0	0	0	105.4	G679 L683	G679-V681 PolarHBondContact O-N 2.87Å; V681-L683 PolarHBondContact O-N 2.8Å
682	A	39.7	Very low	50.5	Low	90 Å²	90	107.7 Å²	107.7	74%	0.744	63%	0.628	S	S	*	*			trans	-53.5	86.8	159.8	0	0	0	0	0	108.2	G680 E684	G680-A682 PolarHBondContact O-N 2.8Å; A682-E684 VanDerWaalsContact C-N 3.29Å; A682-E684 PolarHBondContact O-N 3.1Å
683	L	38.2	Very low	49.1	Very low	154 Å²	154	108.4 Å²	108.4	81%	0.806	64%	0.637	S	S	*	*			trans	-52.1	112.1	143.6	-82.1	160.1	0	0	0	103.3	V681 D685	V681-L683 PolarHBondContact O-N 2.8Å; L683-D685 PolarHBondContact O-N 2.96Å
684	E	35.8	Very low	47.9	Very low	174 Å²	174	104.2 Å²	104.2	81%	0.813	62%	0.619	S	S	*	*			trans	-26	124.4	179.5	-74	171.9	146.4	0	0	108.6	A682 V686	A682-E684 VanDerWaalsContact C-N 3.29Å; A682-E684 PolarHBondContact O-N 3.1Å; E684-V686 VanDerWaalsContact C-N 3.33Å; E684-V686 PolarHBondContact O-N 3.03Å
685	D	40.8	Very low	47.1	Very low	129 Å²	129	103.4 Å²	103.4	69%	0.69	61%	0.614	S	S	*	*			trans	-38.3	111.5	165.6	-79.6	-45.6	0	0	0	105.6	L683 V687	L683-D685 PolarHBondContact O-N 2.96Å; D685-V687 HydrophobicContact CB-CG2 4.08Å; D685-V687 WeakPolarHBondContact O-CG2 3.25Å; D685-V687 PolarHBondContact O-N 3.36Å
686	V	39.5	Very low	46.7	Very low	124 Å²	124	102 Å²	102	75%	0.752	60%	0.604	S	S	*	*			trans	-66.5	85.4	165.8	179.3	0	0	0	0	101.5	E684 L688	E684-V686 VanDerWaalsContact C-N 3.33Å; E684-V686 PolarHBondContact O-N 3.03Å; V686-L688 PolarHBondContact O-N 3.1Å
687	V	40.6	Very low	47.3	Very low	102 Å²	102	98.7 Å²	98.7	62%	0.618	59%	0.587	S	S	*	*			trans	-59.1	92.7	170.2	176.6	0	0	0	0	101.8	D685 P689	D685-V687 HydrophobicContact CB-CG2 4.08Å; D685-V687 WeakPolarHBondContact O-CG2 3.25Å; D685-V687 PolarHBondContact O-N 3.36Å; V687-P689 WeakPolarHBondContact O-CD 3.42Å; V687-P689 VanDerWaalsContact O-N 3.16Å
688	L	40.7	Very low	48.7	Very low	44 Å²	44	94 Å²	94	23%	0.23	58%	0.575	C	S	.	*			trans	-55.6	121.4	164.1	-82.7	140.5	0	0	0	104.2	F664 V686 N690 S691	F664-L688 HydrophobicContact CB-CD1 4.38Å; F664-L688 HydrophobicContact CD2-CD1 3.59Å; F664-L688 HydrophobicContact CE2-CD1 4.43Å; F664-L688 HydrophobicContact CG-CD1 4.47Å; V686-L688 PolarHBondContact O-N 3.1Å; L688-N690 PolarHBondContact O-N 3.01Å; L688-S691 PolarHBondContact O-N 3Å
689	P	39.6	Very low	50.3	Low	90 Å²	90	88 Å²	88	58%	0.584	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	16.2	-167.9	-19.8	32	0	0	0	115.2	V687	V687-P689 WeakPolarHBondContact O-CD 3.42Å; V687-P689 VanDerWaalsContact O-N 3.16Å
690	N	42.4	Very low	52.3	Low	42 Å²	42	93.1 Å²	93.1	23%	0.225	56%	0.56	C	S	.	*	T	Hydrogen-bonded Turn	trans	-124.1	-2.2	-170.8	-69.6	-10.8	0	0	0	113.9	Y472 M660 L688 S870	Y472-N690 PolarHBondContact OH-ND2 2.69Å; M660-N690 WeakPolarHBondContact CE-ND2 3.22Å; M660-N690 PolarHBondContact SD-ND2 2.75Å; L688-N690 PolarHBondContact O-N 3.01Å; N690-S870 PolarHBondContact OD1-OG 3.16Å
691	S	43.8	Very low	54.4	Low	76 Å²	76	90.8 Å²	90.8	53%	0.531	53%	0.528	S	S	.	.	S	Bend	trans	-80.2	119.1	155.4	55.3	0	0	0	0	106	L688	L688-S691 PolarHBondContact O-N 3Å
692	S	47.6	Very low	56.8	Low	66 Å²	66	85.1 Å²	85.1	46%	0.462	49%	0.493	S	S	.	.			trans	-36.3	145.4	159.5	45.7	0	0	0	0	110	V694	S692-V694 PolarHBondContact O-N 3.04Å
693	D	49.9	Very low	59	Low	162 Å²	162	84.4 Å²	84.4	87%	0.866	47%	0.471	S	S	*	.	S	Bend	trans	-58.8	45.4	-177.8	-64.5	-51.9	0	0	0	114.5
694	V	57.9	Low	61.3	Low	22 Å²	22	79.5 Å²	79.5	13%	0.133	44%	0.444	C	S	.	.			trans	-123.3	106	-159.4	177.8	0	0	0	0	105.6	R462 S692 S696	R462-V694 HydrophobicContact CB-CG1 4.12Å; R462-V694 HydrophobicContact CG-CG1 3.15Å; S692-V694 PolarHBondContact O-N 3.04Å; V694-S696 PolarHBondContact O-N 2.63Å
695	P	66.2	Low	63.8	Low	82 Å²	82	71.5 Å²	71.5	53%	0.532	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-62.3	130.2	-177.9	23.6	-32.1	0	0	0	110.1
696	S	68.4	Low	66.1	Low	72 Å²	72	65.7 Å²	65.7	50%	0.503	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-67.8	146.4	174.6	-174.7	0	0	0	0	110.7	V694	V694-S696 PolarHBondContact O-N 2.63Å
697	I	80.9	Confident	68.2	Low	15 Å²	15	60.4 Å²	60.4	8%	0.077	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-85.4	134.8	178.7	-56	175.5	0	0	0	109	I459 R462 I463 L701 L702	I459-I697 HydrophobicContact CD1-CD1 3.87Å; R462-I697 HydrophobicContact CB-CD1 4.1Å; R462-I697 HydrophobicContact CB-CG1 4.32Å; I463-I697 HydrophobicContact CG1-CD1 4.01Å; I697-L701 HydrophobicContact CG2-CB 4.26Å; I697-L701 HydrophobicContact CG2-CD2 3.56Å; I697-L702 HydrophobicContact CG2-CB 4.4Å
698	P	84.6	Confident	70.5	Confident	90 Å²	90	57 Å²	57	58%	0.584	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-56.3	140.9	171.1	-25.1	34.4	0	0	0	112.3	E700 L701 L702	P698-E700 VanDerWaalsContact C-N 3.33Å; P698-E700 PolarHBondContact O-N 3.23Å; P698-L701 PolarHBondContact O-N 3.32Å; P698-L701 VanDerWaalsContact O-N 3.15Å; P698-L702 PolarHBondContact O-N 2.75Å
699	Q	83.2	Confident	72.7	Confident	67 Å²	67	55 Å²	55	31%	0.313	31%	0.308	S	S	.	.	H	α-helix	trans	-61.2	-38.5	-173.2	-66.5	-62.8	-19.5	0	0	113.4	S466 Y521 L701 L702 R703	S466-Q699 PolarHBondContact O-NE2 3.18Å; Y521-Q699 VanDerWaalsContact OH-CD 3.27Å; Y521-Q699 PolarHBondContact OH-NE2 3.24Å; Y521-Q699 PolarHBondContact OH-OE1 3.27Å; Q699-L701 VanDerWaalsContact C-N 3.33Å; Q699-L701 PolarHBondContact O-N 2.89Å; Q699-L702 PolarHBondContact O-N 3.33Å; Q699-R703 WeakPolarHBondContact O-CB 3.4Å; Q699-R703 PolarHBondContact O-N 3.24Å
700	E	82.1	Confident	74.9	Confident	149 Å²	149	54.1 Å²	54.1	70%	0.696	30%	0.295	S	S	*	.	H	α-helix	trans	-61.9	-42.7	177.5	-66.6	-175.6	171.9	0	0	111.9	P698 R703 K704	P698-E700 VanDerWaalsContact C-N 3.33Å; P698-E700 PolarHBondContact O-N 3.23Å; E700-R703 WeakPolarHBondContact O-CB 3.37Å; E700-R703 PolarHBondContact O-N 2.81Å; E700-K704 WeakPolarHBondContact O-CG 3.43Å; E700-K704 PolarHBondContact O-N 3.49Å
701	L	84.8	Confident	76.9	Confident	36 Å²	36	57.4 Å²	57.4	19%	0.188	31%	0.309	C	S	.	.	H	α-helix	trans	-70	-39.7	179.2	-169.7	144.7	0	0	0	111	A449 L453 I697 P698 Q699 R703 K704 Y705	A449-L701 HydrophobicContact CB-CD1 4.34Å; L453-L701 HydrophobicContact CD1-CD1 3.9Å; L453-L701 HydrophobicContact CD1-CD2 3.28Å; L453-L701 HydrophobicContact CD1-CG 4.24Å; I697-L701 HydrophobicContact CG2-CB 4.26Å; I697-L701 HydrophobicContact CG2-CD2 3.56Å; P698-L701 PolarHBondContact O-N 3.32Å; P698-L701 VanDerWaalsContact O-N 3.15Å; Q699-L701 VanDerWaalsContact C-N 3.33Å; Q699-L701 PolarHBondContact O-N 2.89Å; L701-R703 VanDerWaalsContact C-N 3.3Å; L701-R703 PolarHBondContact O-N 3.34Å; L701-K704 PolarHBondContact O-N 2.9Å; L701-Y705 VanDerWaalsContact O-CB 3.25Å; L701-Y705 WeakPolarHBondContact O-CB 3.4Å; L701-Y705 PolarHBondContact O-N 3.44Å
702	L	86.9	Confident	78.9	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-59.3	-42.6	174.1	-178.6	69.7	0	0	0	111.4	I463 I467 V525 I697 P698 Q699 Y705 I706	I463-L702 HydrophobicContact CG1-CD1 4.34Å; I463-L702 HydrophobicContact CG2-CD1 4.3Å; I467-L702 HydrophobicContact CG1-CD2 4.34Å; V525-L702 HydrophobicContact CG1-CD2 4.43Å; I697-L702 HydrophobicContact CG2-CB 4.4Å; P698-L702 PolarHBondContact O-N 2.75Å; Q699-L702 PolarHBondContact O-N 3.33Å; L702-Y705 WeakPolarHBondContact O-CB 3.37Å; L702-Y705 PolarHBondContact O-N 2.68Å; L702-I706 HydrophobicContact CG-CD1 4.13Å; L702-I706 WeakPolarHBondContact O-CG1 2.82Å; L702-I706 PolarHBondContact O-N 3.45Å
703	R	85.4	Confident	80.8	Confident	75 Å²	75	58.8 Å²	58.8	28%	0.283	29%	0.293	S	S	.	.	H	α-helix	trans	-61.6	-50.4	177.9	-161.8	179.7	89.2	-176	-5.2	111.5	E435 Q699 E700 L701 Y705 I706 I707	E435-R703 VanDerWaalsContact CD-NE 3.34Å; E435-R703 VanDerWaalsContact OE1-CD 3.31Å; E435-R703 WeakPolarHBondContact OE1-CD 3.49Å; E435-R703 IonicContact OE1-CZ 3.55Å; E435-R703 IonicContact OE1-NE 2.77Å; E435-R703 PolarHBondContact OE1-NE 2.96Å; E435-R703 IonicContact OE1-NH1 3.72Å; E435-R703 PolarHBondContact OE1-NH1 2.75Å; E435-R703 WeakPolarHBondContact OE2-CD 3.38Å; E435-R703 IonicContact OE2-CZ 3.05Å; E435-R703 IonicContact OE2-NE 3.11Å; E435-R703 PolarHBondContact OE2-NE 3.27Å; E435-R703 IonicContact OE2-NH1 2.62Å; Q699-R703 WeakPolarHBondContact O-CB 3.4Å; Q699-R703 PolarHBondContact O-N 3.24Å; E700-R703 WeakPolarHBondContact O-CB 3.37Å; E700-R703 PolarHBondContact O-N 2.81Å; L701-R703 VanDerWaalsContact C-N 3.3Å; L701-R703 PolarHBondContact O-N 3.34Å; R703-Y705 VanDerWaalsContact C-N 3.26Å; R703-Y705 PolarHBondContact O-N 2.73Å; R703-I706 PolarHBondContact O-N 3.45Å; R703-I707 WeakPolarHBondContact O-CG1 3.4Å; R703-I707 PolarHBondContact O-N 3.36Å
704	K	85.7	Confident	82.7	Confident	52 Å²	52	55.6 Å²	55.6	23%	0.226	27%	0.273	C	S	.	.	H	α-helix	trans	-58.4	-38.9	173.7	-68.7	-177.6	-174.2	-176.4	0	111.5	D446 I450 E700 L701 I707 Y708	D446-K704 HydrophobicContact CB-CD 4.38Å; D446-K704 IonicContact OD1-NZ 2.75Å; D446-K704 PolarHBondContact OD1-NZ 3.5Å; D446-K704 IonicContact OD2-NZ 3.91Å; D446-K704 PolarHBondContact OD2-NZ 3.36Å; I450-K704 HydrophobicContact CD1-CB 4.32Å; E700-K704 WeakPolarHBondContact O-CG 3.43Å; E700-K704 PolarHBondContact O-N 3.49Å; L701-K704 PolarHBondContact O-N 2.9Å; K704-I707 PolarHBondContact O-N 3.48Å; K704-Y708 VanDerWaalsContact O-CB 3.3Å; K704-Y708 WeakPolarHBondContact O-CB 3.45Å; K704-Y708 PolarHBondContact O-N 2.97Å
705	Y	88.4	Confident	84.2	Confident	6 Å²	6	54.9 Å²	54.9	2%	0.024	27%	0.269	C	S	.	.	H	α-helix	trans	-63.7	-46.2	178.8	-171	-87.9	0	0	0	112.7	I450 I463 F486 L701 L702 R703 I707 Y708 A709 M762 L764	I450-Y705 HydrophobicContact CB-CD2 4.27Å; I450-Y705 HydrophobicContact CG1-CD2 4.17Å; I450-Y705 HydrophobicContact CG2-CD2 3.61Å; I450-Y705 HydrophobicContact CG2-CE2 3.82Å; I463-Y705 HydrophobicContact CD1-CD1 4.43Å; I463-Y705 HydrophobicContact CD1-CE1 3.92Å; F486-Y705 AromaticContact CE1-CD1 3.64Å; F486-Y705 HydrophobicContact CE1-CD1 3.64Å; F486-Y705 AromaticContact CE1-CE1 3.71Å; F486-Y705 HydrophobicContact CE1-CE1 3.71Å; F486-Y705 AromaticContact CZ-CD1 3.68Å; F486-Y705 HydrophobicContact CZ-CD1 3.68Å; F486-Y705 AromaticContact CZ-CE1 3.81Å; F486-Y705 HydrophobicContact CZ-CE1 3.81Å; L701-Y705 VanDerWaalsContact O-CB 3.25Å; L701-Y705 WeakPolarHBondContact O-CB 3.4Å; L701-Y705 PolarHBondContact O-N 3.44Å; L702-Y705 WeakPolarHBondContact O-CB 3.37Å; L702-Y705 PolarHBondContact O-N 2.68Å; R703-Y705 VanDerWaalsContact C-N 3.26Å; R703-Y705 PolarHBondContact O-N 2.73Å; Y705-I707 VanDerWaalsContact C-N 3.33Å; Y705-I707 PolarHBondContact O-N 2.69Å; Y705-Y708 PolarHBondContact O-N 3.32Å; Y705-A709 VanDerWaalsContact O-CB 3.26Å; Y705-A709 WeakPolarHBondContact O-CB 3.2Å; Y705-A709 PolarHBondContact O-N 3.02Å; Y705-M762 WeakPolarHBondContact CE1-O 3.42Å; Y705-M762 PolarHBondContact OH-O 3.23Å; Y705-L764 HydrophobicContact CE2-CD1 4.14Å; Y705-L764 HydrophobicContact CE2-CG 4.47Å
706	I	88.7	Confident	85.2	Confident	6 Å²	6	56.5 Å²	56.5	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-62	-44.3	178.5	-66.1	162.5	0	0	0	110.4	F486 V525 L702 R703 A709 K710	F486-I706 HydrophobicContact CE1-CB 4.37Å; F486-I706 HydrophobicContact CE1-CG1 3.91Å; F486-I706 HydrophobicContact CE2-CG1 4.21Å; F486-I706 HydrophobicContact CZ-CG1 3.7Å; V525-I706 HydrophobicContact CG1-CD1 3.75Å; L702-I706 HydrophobicContact CG-CD1 4.13Å; L702-I706 WeakPolarHBondContact O-CG1 2.82Å; L702-I706 PolarHBondContact O-N 3.45Å; R703-I706 PolarHBondContact O-N 3.45Å; I706-A709 PolarHBondContact O-N 3.13Å; I706-K710 HydrophobicContact CG2-CD 4.45Å; I706-K710 WeakPolarHBondContact O-CG 3.5Å; I706-K710 PolarHBondContact O-N 2.89Å
707	I	85	Confident	85.9	Confident	14 Å²	14	55.2 Å²	55.2	7%	0.072	26%	0.255	C	S	.	.	H	α-helix	trans	-60.6	-51.6	177.6	-68.3	172.1	0	0	0	110.2	A438 V439 R703 K704 Y705 A709 K710 E711	A438-I707 HydrophobicContact CB-CD1 3.99Å; V439-I707 HydrophobicContact CB-CG2 4.4Å; V439-I707 HydrophobicContact CG2-CG2 3.22Å; R703-I707 WeakPolarHBondContact O-CG1 3.4Å; R703-I707 PolarHBondContact O-N 3.36Å; K704-I707 PolarHBondContact O-N 3.48Å; Y705-I707 VanDerWaalsContact C-N 3.33Å; Y705-I707 PolarHBondContact O-N 2.69Å; I707-A709 PolarHBondContact O-N 2.96Å; I707-K710 PolarHBondContact O-N 3.42Å; I707-E711 PolarHBondContact O-N 3.45Å
708	Y	87.4	Confident	85.4	Confident	31 Å²	31	60.2 Å²	60.2	12%	0.122	28%	0.281	C	S	.	.	H	α-helix	trans	-58.7	-44.9	179.1	-177	-89.7	0	0	0	112.5	L442 V447 I450 K704 Y705 E711 R712 L764	L442-Y708 HydrophobicContact CD2-CD2 4.47Å; V447-Y708 HydrophobicContact CG1-CE2 3.91Å; V447-Y708 HydrophobicContact CG2-CE2 4.17Å; I450-Y708 HydrophobicContact CD1-CG 4.33Å; I450-Y708 HydrophobicContact CG2-CD1 3.78Å; I450-Y708 HydrophobicContact CG2-CE1 4.11Å; I450-Y708 HydrophobicContact CG2-CG 4.24Å; K704-Y708 VanDerWaalsContact O-CB 3.3Å; K704-Y708 WeakPolarHBondContact O-CB 3.45Å; K704-Y708 PolarHBondContact O-N 2.97Å; Y705-Y708 PolarHBondContact O-N 3.32Å; Y708-E711 PolarHBondContact O-N 3.4Å; Y708-R712 VanDerWaalsContact CE2-CD 3.5Å; Y708-R712 HydrophobicContact CE2-CG 4.4Å; Y708-R712 PolarHBondContact O-N 2.95Å; Y708-R712 VanDerWaalsContact O-N 3.15Å; Y708-R712 PolarHBondContact OH-NH1 2.8Å; Y708-L764 HydrophobicContact CD1-CD1 4.18Å; Y708-L764 HydrophobicContact CD1-CD2 4.03Å; Y708-L764 HydrophobicContact CE1-CD1 3.98Å; Y708-L764 HydrophobicContact CE1-CD2 4.26Å
709	A	88.8	Confident	84.4	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.9	-39.6	-179.2	0	0	0	0	0	112.5	F486 Y705 I706 I707 E711 V713 L764	F486-A709 HydrophobicContact CD1-CB 3.86Å; F486-A709 HydrophobicContact CE1-CB 3.83Å; Y705-A709 VanDerWaalsContact O-CB 3.26Å; Y705-A709 WeakPolarHBondContact O-CB 3.2Å; Y705-A709 PolarHBondContact O-N 3.02Å; I706-A709 PolarHBondContact O-N 3.13Å; I707-A709 PolarHBondContact O-N 2.96Å; A709-E711 PolarHBondContact O-N 3.24Å; A709-V713 WeakPolarHBondContact O-CB 3.47Å; A709-V713 PolarHBondContact O-N 3.01Å; A709-L764 HydrophobicContact CB-CD2 3.62Å
710	K	84.8	Confident	83.7	Confident	72 Å²	72	60.4 Å²	60.4	31%	0.313	28%	0.275	S	S	.	.	H	α-helix	trans	-66.5	-35.1	179.5	-83.2	-173.8	174.3	177.5	0	113.6	L485 F486 I706 I707	L485-K710 WeakPolarHBondContact O-CE 3.21Å; L485-K710 PolarHBondContact O-NZ 2.91Å; F486-K710 VanDerWaalsContact O-CE 3.25Å; F486-K710 WeakPolarHBondContact O-CE 3.42Å; I706-K710 HydrophobicContact CG2-CD 4.45Å; I706-K710 WeakPolarHBondContact O-CG 3.5Å; I706-K710 PolarHBondContact O-N 2.89Å; I707-K710 PolarHBondContact O-N 3.42Å
711	E	83.6	Confident	83.1	Confident	112 Å²	112	57.1 Å²	57.1	52%	0.523	26%	0.262	S	S	.	.	H	α-helix	trans	-91.7	-36.1	-170.7	-169.4	160.6	-165.2	0	0	113.5	V439 I707 Y708 A709	V439-E711 WeakPolarHBondContact CG1-OE2 3.49Å; V439-E711 WeakPolarHBondContact CG2-OE2 3.44Å; I707-E711 PolarHBondContact O-N 3.45Å; Y708-E711 PolarHBondContact O-N 3.4Å; A709-E711 PolarHBondContact O-N 3.24Å
712	R	86.1	Confident	82.9	Confident	161 Å²	161	61.9 Å²	61.9	61%	0.608	28%	0.283	S	S	*	.	H	α-helix	trans	-95.2	-23.1	-176	-68.8	-161.1	179.7	-172.9	-4.3	115	Y708	Y708-R712 VanDerWaalsContact CE2-CD 3.5Å; Y708-R712 HydrophobicContact CE2-CG 4.4Å; Y708-R712 PolarHBondContact O-N 2.95Å; Y708-R712 VanDerWaalsContact O-N 3.15Å; Y708-R712 PolarHBondContact OH-NH1 2.8Å
713	V	88.1	Confident	82.7	Confident	9 Å²	9	67.2 Å²	67.2	6%	0.055	31%	0.312	C	S	.	.			trans	-108.6	120.4	-170.5	-175.6	0	0	0	0	111.3	A709 K761 L764	A709-V713 WeakPolarHBondContact O-CB 3.47Å; A709-V713 PolarHBondContact O-N 3.01Å; V713-K761 HydrophobicContact CG1-CG 4.3Å; V713-K761 VanDerWaalsContact O-CE 3.31Å; V713-K761 WeakPolarHBondContact O-CE 3.47Å; V713-L764 HydrophobicContact CG2-CB 4.21Å; V713-L764 HydrophobicContact CG2-CD2 3.64Å
714	H	89.1	Confident	82.7	Confident	96 Å²	96	65.7 Å²	65.7	44%	0.444	31%	0.307	S	S	.	.			trans	-124	92.4	178.1	-61.6	-68.7	0	0	0	109.9	E489	E489-H714 IonicContact OE1-CE1 2.55Å; E489-H714 IonicContact OE1-CG 3.91Å; E489-H714 IonicContact OE1-ND1 3.4Å; E489-H714 PolarHBondContact OE1-ND1 2.81Å; E489-H714 IonicContact OE2-ND1 3.96Å; E489-H714 PolarHBondContact OE2-ND1 3.03Å
715	P	89.9	Confident	82.7	Confident	6 Å²	6	63.7 Å²	63.7	4%	0.039	30%	0.3	C	S	.	.			trans	-69.9	143.2	-171.3	28.6	-35.6	0	0	0	112.7	E757 A760 K761 D766 V768	P715-E757 HydrophobicContact CG-CB 3.81Å; P715-E757 HydrophobicContact CG-CG 4.05Å; P715-A760 HydrophobicContact CB-CB 4.13Å; P715-K761 HydrophobicContact CG-CG 4.05Å; P715-D766 CarbonylContact C-O 3.55Å; P715-D766 WeakPolarHBondContact CA-O 3.24Å; P715-V768 HydrophobicContact CB-CG2 4.34Å
716	K	87.7	Confident	82.5	Confident	117 Å²	117	66 Å²	66	51%	0.509	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-111	144	179.1	-62.4	176.9	-174.6	169.9	0	111.5	N718 D766 Y767 V768	K716-N718 PolarHBondContact O-N 2.93Å; K716-D766 PolarHBondContact N-O 2.84Å; K716-Y767 HydrophobicContact CB-CD1 4.32Å; K716-V768 PolarHBondContact O-N 2.8Å
717	L	82.3	Confident	82.4	Confident	45 Å²	45	73.5 Å²	73.5	24%	0.236	35%	0.348	C	S	.	.			trans	-96.5	54.3	-177.4	-61.7	-178.5	0	0	0	112.9	M720 I753 E757 V768	L717-M720 HydrophobicContact CB-SD 3.99Å; L717-M720 HydrophobicContact CD1-SD 4.06Å; L717-M720 HydrophobicContact CD2-SD 4.21Å; L717-M720 HydrophobicContact CG-SD 4.33Å; L717-I753 HydrophobicContact CD1-CG2 3.66Å; L717-I753 HydrophobicContact CD2-CG2 4.23Å; L717-E757 HydrophobicContact CD2-CG 4.11Å; L717-V768 HydrophobicContact CD2-CB 4.2Å; L717-V768 HydrophobicContact CD2-CG2 3.75Å
718	N	71.8	Confident	82.4	Confident	119 Å²	119	73 Å²	73	64%	0.636	35%	0.345	S	S	*	.	S	Bend	trans	-90.8	-20.6	-172.6	-69.2	-4.5	0	0	0	114.5	K716	K716-N718 PolarHBondContact O-N 2.93Å
719	Q	62.8	Low	82.3	Confident	130 Å²	130	73.4 Å²	73.4	61%	0.607	35%	0.347	S	S	*	.	S	Bend	trans	-129.4	33.4	-170.3	-71.5	169.8	-12.3	0	0	112.7
720	M	68.4	Low	82.2	Confident	32 Å²	32	76.3 Å²	76.3	16%	0.158	37%	0.367	C	S	.	.			trans	-90.9	135.9	177.1	66.4	-179.2	-68.1	0	0	111.7	L717 Q722 V725 I753	L717-M720 HydrophobicContact CB-SD 3.99Å; L717-M720 HydrophobicContact CD1-SD 4.06Å; L717-M720 HydrophobicContact CD2-SD 4.21Å; L717-M720 HydrophobicContact CG-SD 4.33Å; M720-Q722 VanDerWaalsContact C-N 3.31Å; M720-Q722 HydrophobicContact CE-CG 4.48Å; M720-Q722 HydrophobicContact CG-CG 3.96Å; M720-Q722 PolarHBondContact O-N 3.4Å; M720-Q722 HydrophobicContact SD-CG 4.48Å; M720-V725 HydrophobicContact CE-CG2 4.35Å; M720-I753 HydrophobicContact CE-CG1 4.38Å
721	D	68.8	Low	82.2	Confident	79 Å²	79	76.5 Å²	76.5	42%	0.422	37%	0.371	S	S	.	.			trans	-70.1	85.3	167.3	-80.9	-15.4	0	0	0	110.4	D723 K724 V725	D721-D723 PolarHBondContact O-N 3.36Å; D721-K724 HydrophobicContact CB-CB 3.74Å; D721-K724 HydrophobicContact CB-CD 4.36Å; D721-K724 WeakPolarHBondContact O-CB 3.41Å; D721-K724 PolarHBondContact O-N 2.97Å; D721-K724 VanDerWaalsContact O-N 3.08Å; D721-V725 PolarHBondContact O-N 2.58Å
722	Q	80.3	Confident	82.1	Confident	137 Å²	137	71.2 Å²	71.2	64%	0.64	35%	0.347	S	S	*	.	H	α-helix	trans	-57	-36.5	178.1	-61.7	-179	2.2	0	0	111.8	M720 K724 V725 A726	M720-Q722 VanDerWaalsContact C-N 3.31Å; M720-Q722 HydrophobicContact CE-CG 4.48Å; M720-Q722 HydrophobicContact CG-CG 3.96Å; M720-Q722 PolarHBondContact O-N 3.4Å; M720-Q722 HydrophobicContact SD-CG 4.48Å; Q722-K724 VanDerWaalsContact C-N 3.29Å; Q722-K724 PolarHBondContact O-N 3.12Å; Q722-V725 PolarHBondContact O-N 2.83Å; Q722-A726 PolarHBondContact O-N 3.3Å; Q722-A726 VanDerWaalsContact O-N 3.1Å
723	D	84.6	Confident	82	Confident	113 Å²	113	68.9 Å²	68.9	60%	0.604	34%	0.338	S	S	*	.	H	α-helix	trans	-63.7	-34.1	178.5	-72.5	-15.9	0	0	0	112.8	D721 A726 R727	D721-D723 PolarHBondContact O-N 3.36Å; D723-A726 PolarHBondContact O-N 2.91Å; D723-R727 VanDerWaalsContact O-CG 3.29Å; D723-R727 WeakPolarHBondContact O-CG 3.38Å; D723-R727 PolarHBondContact O-N 2.76Å
724	K	84.4	Confident	81.9	Confident	43 Å²	43	75.4 Å²	75.4	19%	0.187	37%	0.366	C	S	.	.	H	α-helix	trans	-67.7	-44.5	-179.5	-174.3	177	179.1	-179.3	0	110.9	D721 Q722 A726 R727 I728 N774	D721-K724 HydrophobicContact CB-CB 3.74Å; D721-K724 HydrophobicContact CB-CD 4.36Å; D721-K724 WeakPolarHBondContact O-CB 3.41Å; D721-K724 PolarHBondContact O-N 2.97Å; D721-K724 VanDerWaalsContact O-N 3.08Å; Q722-K724 VanDerWaalsContact C-N 3.29Å; Q722-K724 PolarHBondContact O-N 3.12Å; K724-A726 VanDerWaalsContact C-N 3.33Å; K724-A726 PolarHBondContact O-N 3.38Å; K724-R727 PolarHBondContact O-N 2.79Å; K724-I728 HydrophobicContact CG-CD1 4.33Å; K724-I728 WeakPolarHBondContact O-CG1 3.48Å; K724-I728 PolarHBondContact O-N 2.77Å; K724-I728 VanDerWaalsContact O-N 3.09Å; K724-N774 VanDerWaalsContact CE-OD1 3.27Å; K724-N774 WeakPolarHBondContact CE-OD1 3.48Å; K724-N774 PolarHBondContact NZ-OD1 3.35Å
725	V	84.9	Confident	81.4	Confident	10 Å²	10	73.8 Å²	73.8	6%	0.061	36%	0.358	C	S	.	.	H	α-helix	trans	-60.2	-44.3	174	169.1	0	0	0	0	111	M720 D721 Q722 R727 I728 Y729 I749 M752 V773	M720-V725 HydrophobicContact CE-CG2 4.35Å; D721-V725 PolarHBondContact O-N 2.58Å; Q722-V725 PolarHBondContact O-N 2.83Å; V725-R727 PolarHBondContact O-N 2.77Å; V725-I728 PolarHBondContact O-N 2.63Å; V725-Y729 WeakPolarHBondContact O-CB 3.48Å; V725-Y729 PolarHBondContact O-N 2.98Å; V725-I749 HydrophobicContact CG1-CG2 3.71Å; V725-M752 HydrophobicContact CB-CE 3.78Å; V725-M752 HydrophobicContact CG1-CE 3.22Å; V725-M752 HydrophobicContact CG2-CE 3.44Å; V725-M752 VanDerWaalsContact CG2-CE 3.44Å; V725-V773 HydrophobicContact CG2-CG1 4.15Å
726	A	85.9	Confident	80.8	Confident	55 Å²	55	73.6 Å²	73.6	46%	0.455	36%	0.357	S	S	.	.	H	α-helix	trans	-61.9	-43.5	178.9	0	0	0	0	0	112.5	Q722 D723 K724 Y729 S730	Q722-A726 PolarHBondContact O-N 3.3Å; Q722-A726 VanDerWaalsContact O-N 3.1Å; D723-A726 PolarHBondContact O-N 2.91Å; K724-A726 VanDerWaalsContact C-N 3.33Å; K724-A726 PolarHBondContact O-N 3.38Å; A726-Y729 PolarHBondContact O-N 3.3Å; A726-S730 PolarHBondContact O-N 2.96Å; A726-S730 PolarHBondContact O-OG 3.06Å
727	R	86.6	Confident	80.4	Confident	163 Å²	163	74.4 Å²	74.4	62%	0.615	36%	0.364	S	S	*	.	H	α-helix	trans	-61.9	-48.1	177	-72	174.5	-162.1	-179.3	7.9	111.7	D723 K724 V725 Y729 S730 D731	D723-R727 VanDerWaalsContact O-CG 3.29Å; D723-R727 WeakPolarHBondContact O-CG 3.38Å; D723-R727 PolarHBondContact O-N 2.76Å; K724-R727 PolarHBondContact O-N 2.79Å; V725-R727 PolarHBondContact O-N 2.77Å; R727-Y729 VanDerWaalsContact C-N 3.33Å; R727-Y729 PolarHBondContact O-N 2.91Å; R727-S730 WeakPolarHBondContact CA-OG 3.32Å; R727-S730 PolarHBondContact O-N 3.41Å; R727-S730 PolarHBondContact O-OG 3.05Å; R727-D731 PolarHBondContact O-N 2.95Å
728	I	84.5	Confident	80	Confident	3 Å²	3	76.3 Å²	76.3	2%	0.015	39%	0.387	C	S	.	.	H	α-helix	trans	-60.3	-46.3	178.9	-69.3	168.8	0	0	0	110.3	K724 V725 S730 D731 L732 I777 Y803	K724-I728 HydrophobicContact CG-CD1 4.33Å; K724-I728 WeakPolarHBondContact O-CG1 3.48Å; K724-I728 PolarHBondContact O-N 2.77Å; K724-I728 VanDerWaalsContact O-N 3.09Å; V725-I728 PolarHBondContact O-N 2.63Å; I728-S730 VanDerWaalsContact C-N 3.34Å; I728-S730 PolarHBondContact O-N 3.07Å; I728-D731 PolarHBondContact O-N 3.43Å; I728-L732 VanDerWaalsContact O-CB 3.28Å; I728-L732 WeakPolarHBondContact O-CB 3.29Å; I728-L732 PolarHBondContact O-N 3.02Å; I728-I777 HydrophobicContact CD1-CD1 3.32Å; I728-I777 HydrophobicContact CD1-CG1 3.94Å; I728-I777 HydrophobicContact CD1-CG2 4.06Å; I728-Y803 HydrophobicContact CD1-CD1 4.37Å; I728-Y803 HydrophobicContact CD1-CE1 3.91Å; I728-Y803 HydrophobicContact CG1-CE1 4.35Å; I728-Y803 HydrophobicContact CG1-CE2 4.47Å
729	Y	85.3	Confident	79.8	Confident	40 Å²	40	73.3 Å²	73.3	16%	0.157	37%	0.373	C	S	.	.	H	α-helix	trans	-60	-42.7	177.1	176.3	-101.6	0	0	0	112.5	V725 A726 R727 R733 I744 I749	V725-Y729 WeakPolarHBondContact O-CB 3.48Å; V725-Y729 PolarHBondContact O-N 2.98Å; A726-Y729 PolarHBondContact O-N 3.3Å; R727-Y729 VanDerWaalsContact C-N 3.33Å; R727-Y729 PolarHBondContact O-N 2.91Å; Y729-R733 VanDerWaalsContact O-CB 3.28Å; Y729-R733 WeakPolarHBondContact O-CB 3.46Å; Y729-R733 PolarHBondContact O-N 2.8Å; Y729-R733 PolarHBondContact OH-NH1 3.12Å; Y729-I744 HydrophobicContact CD2-CG2 3.92Å; Y729-I744 HydrophobicContact CE2-CB 4.47Å; Y729-I744 HydrophobicContact CE2-CG2 3.61Å; Y729-I744 PolarHBondContact OH-O 2.96Å; Y729-I749 HydrophobicContact CD1-CD1 3.97Å; Y729-I749 HydrophobicContact CD2-CD1 3.49Å; Y729-I749 VanDerWaalsContact CD2-CD1 3.49Å; Y729-I749 HydrophobicContact CD2-CG1 3.53Å; Y729-I749 HydrophobicContact CE1-CD1 4.29Å; Y729-I749 HydrophobicContact CE2-CD1 3.83Å; Y729-I749 HydrophobicContact CE2-CG1 4.01Å; Y729-I749 HydrophobicContact CG-CD1 3.56Å; Y729-I749 HydrophobicContact CG-CG1 4.01Å
730	S	85.9	Confident	79.9	Confident	60 Å²	60	70.1 Å²	70.1	42%	0.42	38%	0.375	S	S	.	.	H	α-helix	trans	-64.2	-41.4	177.8	60	0	0	0	0	112.9	A726 R727 I728 K734	A726-S730 PolarHBondContact O-N 2.96Å; A726-S730 PolarHBondContact O-OG 3.06Å; R727-S730 WeakPolarHBondContact CA-OG 3.32Å; R727-S730 PolarHBondContact O-N 3.41Å; R727-S730 PolarHBondContact O-OG 3.05Å; I728-S730 VanDerWaalsContact C-N 3.34Å; I728-S730 PolarHBondContact O-N 3.07Å; S730-K734 WeakPolarHBondContact O-CB 3.45Å; S730-K734 PolarHBondContact O-N 2.98Å
731	D	84.6	Confident	79.8	Confident	76 Å²	76	69.4 Å²	69.4	41%	0.406	37%	0.373	S	S	.	.	H	α-helix	trans	-68.4	-45.6	178.3	-72.7	-19	0	0	0	110.8	R727 I728 R733 K734 E735 F800	R727-D731 PolarHBondContact O-N 2.95Å; I728-D731 PolarHBondContact O-N 3.43Å; D731-R733 VanDerWaalsContact C-N 3.33Å; D731-R733 PolarHBondContact O-N 2.88Å; D731-K734 PolarHBondContact O-N 3.2Å; D731-E735 WeakPolarHBondContact O-CG 2.92Å; D731-E735 PolarHBondContact O-N 3.36Å; D731-F800 HydrophobicContact CB-CE1 4.16Å; D731-F800 HydrophobicContact CB-CZ 4.23Å
732	L	82.2	Confident	79.8	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.01	36%	0.362	C	S	.	.	H	α-helix	trans	-57.8	-47.6	177.5	-150.4	89.7	0	0	0	110.3	I728 K734 E735 S736 I744 M780 L781 F784 F800	I728-L732 VanDerWaalsContact O-CB 3.28Å; I728-L732 WeakPolarHBondContact O-CB 3.29Å; I728-L732 PolarHBondContact O-N 3.02Å; L732-K734 PolarHBondContact O-N 2.72Å; L732-E735 PolarHBondContact O-N 2.79Å; L732-S736 VanDerWaalsContact O-CB 3.3Å; L732-S736 WeakPolarHBondContact O-CB 3.3Å; L732-S736 PolarHBondContact O-N 3.03Å; L732-S736 PolarHBondContact O-OG 3.28Å; L732-I744 VanDerWaalsContact C-CD1 3.42Å; L732-I744 HydrophobicContact CB-CD1 3.74Å; L732-I744 HydrophobicContact CD2-CB 4.45Å; L732-I744 HydrophobicContact CD2-CD1 3.24Å; L732-I744 HydrophobicContact CD2-CG1 3.7Å; L732-I744 HydrophobicContact CD2-CG2 3.97Å; L732-I744 HydrophobicContact CG-CD1 3.38Å; L732-I744 HydrophobicContact CG-CG1 4.37Å; L732-I744 WeakPolarHBondContact O-CD1 3.25Å; L732-M780 HydrophobicContact CD2-CE 4.46Å; L732-M780 HydrophobicContact CD2-SD 4.25Å; L732-L781 HydrophobicContact CD1-CD1 3.57Å; L732-L781 HydrophobicContact CD1-CG 4.37Å; L732-F784 HydrophobicContact CD2-CD1 4.46Å; L732-F800 HydrophobicContact CD1-CE1 4.38Å; L732-F800 HydrophobicContact CD1-CE2 4.21Å; L732-F800 HydrophobicContact CD1-CZ 4.02Å
733	R	84.4	Confident	79.2	Confident	111 Å²	111	64.5 Å²	64.5	42%	0.419	36%	0.355	S	S	.	.	H	α-helix	trans	-64.5	-39.8	179.8	-173.7	170.9	-178.9	165.9	-2.1	112.4	Y729 D731 M737	Y729-R733 VanDerWaalsContact O-CB 3.28Å; Y729-R733 WeakPolarHBondContact O-CB 3.46Å; Y729-R733 PolarHBondContact O-N 2.8Å; Y729-R733 PolarHBondContact OH-NH1 3.12Å; D731-R733 VanDerWaalsContact C-N 3.33Å; D731-R733 PolarHBondContact O-N 2.88Å; R733-M737 HydrophobicContact CG-CG 4.48Å; R733-M737 HydrophobicContact CG-SD 4.17Å; R733-M737 WeakPolarHBondContact O-CB 3.46Å; R733-M737 VanDerWaalsContact O-CG 3.3Å; R733-M737 WeakPolarHBondContact O-CG 3.42Å; R733-M737 PolarHBondContact O-N 3.14Å
734	K	84.8	Confident	78.9	Confident	147 Å²	147	59.4 Å²	59.4	64%	0.639	33%	0.327	S	S	*	.	H	α-helix	trans	-64	-47.5	178.6	-175.7	-176.7	177.4	-172.3	0	111.7	S730 D731 L732 A738	S730-K734 WeakPolarHBondContact O-CB 3.45Å; S730-K734 PolarHBondContact O-N 2.98Å; D731-K734 PolarHBondContact O-N 3.2Å; L732-K734 PolarHBondContact O-N 2.72Å; K734-A738 PolarHBondContact O-N 3.34Å
735	E	78.8	Confident	78.8	Confident	61 Å²	61	59.5 Å²	59.5	29%	0.285	33%	0.332	S	S	.	.	H	α-helix	trans	-67.3	-38.6	178.8	-69.1	-64.5	141.5	0	0	111.9	D731 L732 A738 T739 M796 F800	D731-E735 WeakPolarHBondContact O-CG 2.92Å; D731-E735 PolarHBondContact O-N 3.36Å; L732-E735 PolarHBondContact O-N 2.79Å; E735-A738 PolarHBondContact O-N 3.47Å; E735-T739 PolarHBondContact O-N 3.09Å; E735-T739 PolarHBondContact O-OG1 3.26Å; E735-M796 HydrophobicContact CB-CE 3.97Å; E735-F800 HydrophobicContact CG-CE2 4.34Å; E735-F800 HydrophobicContact CG-CZ 4.42Å
736	S	77.9	Confident	78.8	Confident	3 Å²	3	63.3 Å²	63.3	2%	0.021	36%	0.355	C	S	.	.	H	α-helix	trans	-66.4	-43	176.1	-78.9	0	0	0	0	113.5	L732 A738 T739 G740 S741 I744 F784	L732-S736 VanDerWaalsContact O-CB 3.3Å; L732-S736 WeakPolarHBondContact O-CB 3.3Å; L732-S736 PolarHBondContact O-N 3.03Å; L732-S736 PolarHBondContact O-OG 3.28Å; S736-A738 VanDerWaalsContact C-N 3.31Å; S736-A738 PolarHBondContact O-N 3.38Å; S736-T739 PolarHBondContact O-N 3.44Å; S736-G740 PolarHBondContact O-N 3.49Å; S736-S741 WeakPolarHBondContact CA-OG 3.22Å; S736-S741 WeakPolarHBondContact CB-OG 3.29Å; S736-S741 PolarHBondContact O-N 3.4Å; S736-S741 PolarHBondContact O-OG 2.89Å; S736-S741 VanDerWaalsContact O-OG 3.06Å; S736-S741 PolarHBondContact OG-OG 3.03Å; S736-S741 VanDerWaalsContact OG-OG 3.09Å; S736-I744 WeakPolarHBondContact OG-CD1 3.46Å; S736-F784 WeakPolarHBondContact OG-CE1 3.42Å; S736-F784 WeakPolarHBondContact OG-CZ 3.46Å
737	M	78.9	Confident	78.6	Confident	134 Å²	134	63.8 Å²	63.8	66%	0.66	35%	0.345	S	S	*	.	H	α-helix	trans	-64.2	-36.6	177.1	-78.6	-177.7	147.8	0	0	112.4	R733 T739	R733-M737 HydrophobicContact CG-CG 4.48Å; R733-M737 HydrophobicContact CG-SD 4.17Å; R733-M737 WeakPolarHBondContact O-CB 3.46Å; R733-M737 VanDerWaalsContact O-CG 3.3Å; R733-M737 WeakPolarHBondContact O-CG 3.42Å; R733-M737 PolarHBondContact O-N 3.14Å; M737-T739 PolarHBondContact O-N 3.16Å
738	A	73.6	Confident	78.5	Confident	85 Å²	85	57.2 Å²	57.2	70%	0.702	32%	0.321	S	S	*	.	H	α-helix	trans	-64	-24.7	177.7	0	0	0	0	0	112.8	K734 E735 S736	K734-A738 PolarHBondContact O-N 3.34Å; E735-A738 PolarHBondContact O-N 3.47Å; S736-A738 VanDerWaalsContact C-N 3.31Å; S736-A738 PolarHBondContact O-N 3.38Å
739	T	67.8	Low	78.7	Confident	56 Å²	56	58.8 Å²	58.8	34%	0.344	33%	0.329	S	S	.	.	H	α-helix	trans	-112.6	-4.3	-167	-34.3	0	0	0	0	114.2	E735 S736 M737 S741 V792	E735-T739 PolarHBondContact O-N 3.09Å; E735-T739 PolarHBondContact O-OG1 3.26Å; S736-T739 PolarHBondContact O-N 3.44Å; M737-T739 PolarHBondContact O-N 3.16Å; T739-S741 VanDerWaalsContact C-N 3.31Å; T739-V792 HydrophobicContact CG2-CB 3.87Å; T739-V792 HydrophobicContact CG2-CG1 3.54Å; T739-V792 HydrophobicContact CG2-CG2 3.15Å
740	G	64.9	Low	78.8	Confident	63 Å²	63	60.4 Å²	60.4	65%	0.649	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.8	29.1	-179.4	0	0	0	0	0	113.3	S736	S736-G740 PolarHBondContact O-N 3.49Å
741	S	67.9	Low	78.9	Confident	16 Å²	16	57.5 Å²	57.5	11%	0.112	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-78.2	169.7	173.2	58.3	0	0	0	0	112.1	S736 T739	S736-S741 WeakPolarHBondContact CA-OG 3.22Å; S736-S741 WeakPolarHBondContact CB-OG 3.29Å; S736-S741 PolarHBondContact O-N 3.4Å; S736-S741 PolarHBondContact O-OG 2.89Å; S736-S741 VanDerWaalsContact O-OG 3.06Å; S736-S741 PolarHBondContact OG-OG 3.03Å; S736-S741 VanDerWaalsContact OG-OG 3.09Å; T739-S741 VanDerWaalsContact C-N 3.31Å
742	I	68.5	Low	79.1	Confident	37 Å²	37	54.1 Å²	54.1	19%	0.19	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-48.1	128.2	170.8	-59.5	172.1	0	0	0	110.1	F629 I744	F629-I742 HydrophobicContact CB-CD1 4.46Å; I742-I744 PolarHBondContact O-N 3.48Å
743	P	67.3	Low	79.5	Confident	76 Å²	76	56.2 Å²	56.2	49%	0.494	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-69.5	130.4	-176.6	26.9	-33.6	0	0	0	111.8	T745	P743-T745 PolarHBondContact O-N 3.48Å
744	I	78.9	Confident	79.8	Confident	7 Å²	7	51.3 Å²	51.3	4%	0.036	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-78.9	117.4	177.1	-59.3	142.5	0	0	0	109.4	Y729 L732 S736 I742 H748 F784	Y729-I744 HydrophobicContact CD2-CG2 3.92Å; Y729-I744 HydrophobicContact CE2-CB 4.47Å; Y729-I744 HydrophobicContact CE2-CG2 3.61Å; Y729-I744 PolarHBondContact OH-O 2.96Å; L732-I744 VanDerWaalsContact C-CD1 3.42Å; L732-I744 HydrophobicContact CB-CD1 3.74Å; L732-I744 HydrophobicContact CD2-CB 4.45Å; L732-I744 HydrophobicContact CD2-CD1 3.24Å; L732-I744 HydrophobicContact CD2-CG1 3.7Å; L732-I744 HydrophobicContact CD2-CG2 3.97Å; L732-I744 HydrophobicContact CG-CD1 3.38Å; L732-I744 HydrophobicContact CG-CG1 4.37Å; L732-I744 WeakPolarHBondContact O-CD1 3.25Å; S736-I744 WeakPolarHBondContact OG-CD1 3.46Å; I742-I744 PolarHBondContact O-N 3.48Å; I744-H748 HydrophobicContact CG2-CB 4.19Å; I744-H748 WeakPolarHBondContact CG2-ND1 3.09Å; I744-F784 HydrophobicContact CD1-CE1 4.17Å; I744-F784 HydrophobicContact CD1-CZ 3.9Å; I744-F784 HydrophobicContact CG1-CE1 4.38Å; I744-F784 HydrophobicContact CG1-CE2 3.89Å; I744-F784 HydrophobicContact CG1-CZ 3.71Å
745	T	82.1	Confident	80.1	Confident	45 Å²	45	44.3 Å²	44.3	28%	0.276	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-95	171.5	178.9	69	0	0	0	0	111.6	P743 R747 H748	P743-T745 PolarHBondContact O-N 3.48Å; T745-R747 PolarHBondContact O-N 3.45Å; T745-R747 WeakPolarHBondContact OG1-CB 3.26Å; T745-R747 PolarHBondContact OG1-N 2.86Å; T745-H748 PolarHBondContact O-N 3.02Å
746	V	84	Confident	80.7	Confident	90 Å²	90	41.5 Å²	41.5	55%	0.545	25%	0.249	S	C	.	.	H	α-helix	trans	-59.9	-24.4	173.6	-177.6	0	0	0	0	111.5	H748 I749 E750	V746-H748 VanDerWaalsContact C-N 3.29Å; V746-H748 PolarHBondContact O-N 3.05Å; V746-I749 VanDerWaalsContact O-CB 3.31Å; V746-I749 WeakPolarHBondContact O-CB 3.46Å; V746-I749 PolarHBondContact O-N 2.87Å; V746-E750 PolarHBondContact O-N 3.38Å
747	R	82.6	Confident	81.4	Confident	64 Å²	64	41.5 Å²	41.5	24%	0.242	25%	0.248	C	C	.	.	H	α-helix	trans	-58.9	-39.3	178.9	-62.3	-178.6	-172.8	161.1	4.6	112.4	S641 R642 T745 I749 E750 S751	S641-R747 WeakPolarHBondContact O-CD 3.48Å; S641-R747 PolarHBondContact O-NH1 3.46Å; S641-R747 PolarHBondContact OG-NH1 2.86Å; R642-R747 VanDerWaalsContact CZ-NH1 3.27Å; R642-R747 VanDerWaalsContact NH1-NE 3.18Å; T745-R747 PolarHBondContact O-N 3.45Å; T745-R747 WeakPolarHBondContact OG1-CB 3.26Å; T745-R747 PolarHBondContact OG1-N 2.86Å; R747-I749 PolarHBondContact O-N 3.16Å; R747-E750 CarbonylContact O-C 3.54Å; R747-E750 WeakPolarHBondContact O-CA 3.47Å; R747-E750 WeakPolarHBondContact O-CB 3.47Å; R747-E750 PolarHBondContact O-N 3.21Å; R747-S751 PolarHBondContact O-N 3.43Å; R747-S751 PolarHBondContact O-OG 3.48Å
748	H	84.8	Confident	82	Confident	26 Å²	26	35.1 Å²	35.1	12%	0.12	22%	0.217	C	C	.	.	H	α-helix	trans	-64.4	-28.7	177.9	-55.7	147.5	0	0	0	112.5	I744 T745 V746 M752 M780	I744-H748 HydrophobicContact CG2-CB 4.19Å; I744-H748 WeakPolarHBondContact CG2-ND1 3.09Å; T745-H748 PolarHBondContact O-N 3.02Å; V746-H748 VanDerWaalsContact C-N 3.29Å; V746-H748 PolarHBondContact O-N 3.05Å; H748-M752 WeakPolarHBondContact O-CB 3.45Å; H748-M752 PolarHBondContact O-N 3.35Å; H748-M780 HydrophobicContact CB-CE 4.49Å
749	I	87.3	Confident	82.8	Confident	36 Å²	36	32 Å²	32	19%	0.185	19%	0.188	C	C	.	.	H	α-helix	trans	-68.7	-44.2	172.4	-52.9	177.6	0	0	0	109.6	V725 Y729 V746 R747 S751 M752 I753	V725-I749 HydrophobicContact CG1-CG2 3.71Å; Y729-I749 HydrophobicContact CD1-CD1 3.97Å; Y729-I749 HydrophobicContact CD2-CD1 3.49Å; Y729-I749 VanDerWaalsContact CD2-CD1 3.49Å; Y729-I749 HydrophobicContact CD2-CG1 3.53Å; Y729-I749 HydrophobicContact CE1-CD1 4.29Å; Y729-I749 HydrophobicContact CE2-CD1 3.83Å; Y729-I749 HydrophobicContact CE2-CG1 4.01Å; Y729-I749 HydrophobicContact CG-CD1 3.56Å; Y729-I749 HydrophobicContact CG-CG1 4.01Å; V746-I749 VanDerWaalsContact O-CB 3.31Å; V746-I749 WeakPolarHBondContact O-CB 3.46Å; V746-I749 PolarHBondContact O-N 2.87Å; R747-I749 PolarHBondContact O-N 3.16Å; I749-S751 VanDerWaalsContact C-N 3.34Å; I749-S751 PolarHBondContact O-N 3.15Å; I749-M752 WeakPolarHBondContact O-CB 3.29Å; I749-M752 PolarHBondContact O-N 2.89Å; I749-I753 HydrophobicContact CG2-CD1 4.29Å; I749-I753 WeakPolarHBondContact O-CG1 3.23Å; I749-I753 PolarHBondContact O-N 2.83Å
750	E	87.1	Confident	83.9	Confident	73 Å²	73	29.3 Å²	29.3	34%	0.341	17%	0.171	S	C	.	.	H	α-helix	trans	-61.6	-42.9	175.2	-58.7	177.3	178.6	0	0	111.5	V746 R747 M752 I753 R754	V746-E750 PolarHBondContact O-N 3.38Å; R747-E750 CarbonylContact O-C 3.54Å; R747-E750 WeakPolarHBondContact O-CA 3.47Å; R747-E750 WeakPolarHBondContact O-CB 3.47Å; R747-E750 PolarHBondContact O-N 3.21Å; E750-M752 VanDerWaalsContact C-N 3.28Å; E750-M752 PolarHBondContact O-N 2.83Å; E750-I753 PolarHBondContact O-N 2.87Å; E750-R754 WeakPolarHBondContact O-CG 3.06Å; E750-R754 PolarHBondContact O-N 3.02Å; E750-R754 IonicContact OE2-CZ 2.76Å; E750-R754 IonicContact OE2-NH2 3.9Å; E750-R754 PolarHBondContact OE2-NH2 3.35Å
751	S	89.1	Confident	85.1	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-56.9	-43	175.1	-45.8	0	0	0	0	111.4	D644 R747 I749 R754 M755	D644-S751 WeakPolarHBondContact OD1-CB 3.4Å; D644-S751 PolarHBondContact OD1-OG 2.9Å; R747-S751 PolarHBondContact O-N 3.43Å; R747-S751 PolarHBondContact O-OG 3.48Å; I749-S751 VanDerWaalsContact C-N 3.34Å; I749-S751 PolarHBondContact O-N 3.15Å; S751-R754 PolarHBondContact O-N 3.09Å; S751-M755 WeakPolarHBondContact O-CE 3.41Å; S751-M755 WeakPolarHBondContact O-CG 3.3Å; S751-M755 PolarHBondContact O-N 2.98Å
752	M	88.9	Confident	86.2	Confident	5 Å²	5	26 Å²	26	3%	0.025	14%	0.137	C	C	.	.	H	α-helix	trans	-65.1	-39.8	178.1	-169.6	176.1	69.2	0	0	112.4	V725 H748 I749 E750 M755 A756 A776 I777 M780	V725-M752 HydrophobicContact CB-CE 3.78Å; V725-M752 HydrophobicContact CG1-CE 3.22Å; V725-M752 HydrophobicContact CG2-CE 3.44Å; V725-M752 VanDerWaalsContact CG2-CE 3.44Å; H748-M752 WeakPolarHBondContact O-CB 3.45Å; H748-M752 PolarHBondContact O-N 3.35Å; I749-M752 WeakPolarHBondContact O-CB 3.29Å; I749-M752 PolarHBondContact O-N 2.89Å; E750-M752 VanDerWaalsContact C-N 3.28Å; E750-M752 PolarHBondContact O-N 2.83Å; M752-M755 PolarHBondContact O-N 2.91Å; M752-A756 PolarHBondContact O-N 2.85Å; M752-A776 HydrophobicContact CG-CB 3.98Å; M752-A776 WeakPolarHBondContact O-CB 3.43Å; M752-I777 HydrophobicContact CE-CG1 4.41Å; M752-I777 HydrophobicContact CG-CG1 4.28Å; M752-I777 HydrophobicContact SD-CB 4.26Å; M752-I777 HydrophobicContact SD-CD1 4.41Å; M752-I777 HydrophobicContact SD-CG1 3.3Å; M752-I777 WeakPolarHBondContact SD-CG1 3.36Å; M752-M780 HydrophobicContact SD-CE 4.16Å
753	I	90.1	Very high	87.2	Confident	45 Å²	45	25.1 Å²	25.1	23%	0.231	13%	0.132	C	C	.	.	H	α-helix	trans	-65.7	-44	175.2	-66.7	169.1	0	0	0	110.5	L717 M720 I749 E750 M755 A756 E757	L717-I753 HydrophobicContact CD1-CG2 3.66Å; L717-I753 HydrophobicContact CD2-CG2 4.23Å; M720-I753 HydrophobicContact CE-CG1 4.38Å; I749-I753 HydrophobicContact CG2-CD1 4.29Å; I749-I753 WeakPolarHBondContact O-CG1 3.23Å; I749-I753 PolarHBondContact O-N 2.83Å; E750-I753 PolarHBondContact O-N 2.87Å; I753-M755 VanDerWaalsContact C-N 3.35Å; I753-M755 PolarHBondContact O-N 3.39Å; I753-A756 PolarHBondContact O-N 2.78Å; I753-E757 WeakPolarHBondContact O-CG 3.4Å; I753-E757 PolarHBondContact O-N 2.8Å
754	R	91.4	Very high	88.3	Confident	8 Å²	8	23 Å²	23	3%	0.03	12%	0.117	C	C	.	.	H	α-helix	trans	-60.2	-42.9	176	-68.9	176.4	-164	121.7	16.1	112	R500 I503 D644 E750 S751 A756 E757 A758	R500-R754 VanDerWaalsContact CG-NH2 3.27Å; R500-R754 PolarHBondContact O-NE 3.48Å; I503-R754 HydrophobicContact CD1-CB 4.16Å; I503-R754 HydrophobicContact CG1-CB 3.92Å; D644-R754 IonicContact OD1-NH1 3.36Å; D644-R754 PolarHBondContact OD1-NH1 2.92Å; D644-R754 IonicContact OD2-NH1 2.75Å; D644-R754 PolarHBondContact OD2-NH1 3.45Å; D644-R754 VanDerWaalsContact OD2-NH1 3.17Å; E750-R754 WeakPolarHBondContact O-CG 3.06Å; E750-R754 PolarHBondContact O-N 3.02Å; E750-R754 IonicContact OE2-CZ 2.76Å; E750-R754 IonicContact OE2-NH2 3.9Å; E750-R754 PolarHBondContact OE2-NH2 3.35Å; S751-R754 PolarHBondContact O-N 3.09Å; R754-A756 VanDerWaalsContact C-N 3.35Å; R754-E757 WeakPolarHBondContact O-CB 3.42Å; R754-E757 PolarHBondContact O-N 2.83Å; R754-A758 WeakPolarHBondContact O-CB 3.12Å; R754-A758 PolarHBondContact O-N 2.84Å
755	M	91.3	Very high	88.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.3	-36.7	177	-77.2	-173.8	-80.2	0	0	112.6	I503 V645 S751 M752 I753 E757 A758 H759 A776 V779 M780	I503-M755 HydrophobicContact CD1-CG 4.05Å; V645-M755 HydrophobicContact CG2-CE 4.33Å; V645-M755 HydrophobicContact CG2-SD 3.79Å; S751-M755 WeakPolarHBondContact O-CE 3.41Å; S751-M755 WeakPolarHBondContact O-CG 3.3Å; S751-M755 PolarHBondContact O-N 2.98Å; M752-M755 PolarHBondContact O-N 2.91Å; I753-M755 VanDerWaalsContact C-N 3.35Å; I753-M755 PolarHBondContact O-N 3.39Å; M755-E757 VanDerWaalsContact C-N 3.35Å; M755-A758 PolarHBondContact O-N 2.92Å; M755-H759 PolarHBondContact O-N 2.84Å; M755-A776 HydrophobicContact CB-CB 3.78Å; M755-V779 HydrophobicContact SD-CB 4.26Å; M755-V779 HydrophobicContact SD-CG1 3.83Å; M755-M780 HydrophobicContact CE-CB 3.87Å; M755-M780 HydrophobicContact CE-CG 4.41Å
756	A	91.2	Very high	89.1	Confident	3 Å²	3	28.5 Å²	28.5	3%	0.025	14%	0.138	C	C	.	.	H	α-helix	trans	-65.3	-40	175.1	0	0	0	0	0	111.5	M752 I753 R754 H759 A760 V768 V773 A776	M752-A756 PolarHBondContact O-N 2.85Å; I753-A756 PolarHBondContact O-N 2.78Å; R754-A756 VanDerWaalsContact C-N 3.35Å; A756-H759 PolarHBondContact O-N 2.75Å; A756-A760 PolarHBondContact O-N 2.97Å; A756-V768 HydrophobicContact CB-CG1 3.84Å; A756-V773 HydrophobicContact CB-CG2 4.16Å; A756-A776 HydrophobicContact CB-CB 4.13Å
757	E	91.1	Very high	89.4	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.009	13%	0.133	C	C	.	.	H	α-helix	trans	-65.4	-41.9	173.1	-70.7	165.9	-171.8	0	0	112.5	E489 K491 P715 L717 I753 R754 M755 H759 A760 K761 V768	E489-E757 PolarHBondContact N-OE2 2.86Å; K491-E757 WeakPolarHBondContact CE-OE1 3.42Å; K491-E757 IonicContact NZ-OE1 2.8Å; K491-E757 PolarHBondContact NZ-OE1 2.86Å; P715-E757 HydrophobicContact CG-CB 3.81Å; P715-E757 HydrophobicContact CG-CG 4.05Å; L717-E757 HydrophobicContact CD2-CG 4.11Å; I753-E757 WeakPolarHBondContact O-CG 3.4Å; I753-E757 PolarHBondContact O-N 2.8Å; R754-E757 WeakPolarHBondContact O-CB 3.42Å; R754-E757 PolarHBondContact O-N 2.83Å; M755-E757 VanDerWaalsContact C-N 3.35Å; E757-H759 VanDerWaalsContact C-N 3.29Å; E757-H759 PolarHBondContact O-N 2.79Å; E757-A760 PolarHBondContact O-N 3.06Å; E757-K761 PolarHBondContact O-N 3.37Å; E757-V768 HydrophobicContact CG-CG2 4.15Å
758	A	92.1	Very high	89.7	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.2	-40.2	176.2	0	0	0	0	0	111.7	L483 G487 I503 R754 M755 K761 M762	L483-A758 HydrophobicContact CB-CB 4.36Å; L483-A758 HydrophobicContact CD2-CB 4.2Å; L483-A758 WeakPolarHBondContact O-CB 3.3Å; G487-A758 WeakPolarHBondContact O-CA 3.38Å; G487-A758 WeakPolarHBondContact O-CB 3.37Å; I503-A758 HydrophobicContact CD1-CB 3.88Å; R754-A758 WeakPolarHBondContact O-CB 3.12Å; R754-A758 PolarHBondContact O-N 2.84Å; M755-A758 PolarHBondContact O-N 2.92Å; A758-K761 PolarHBondContact O-N 3.37Å; A758-M762 PolarHBondContact O-N 2.94Å
759	H	90.8	Very high	89.9	Confident	19 Å²	19	28.4 Å²	28.4	9%	0.088	13%	0.132	C	C	.	.	H	α-helix	trans	-66.7	-40.1	175.2	-165	-95.3	0	0	0	111.9	L483 M755 A756 E757 K761 M762 H763 D772 M775	L483-H759 HydrophobicContact CD2-CB 4.01Å; M755-H759 PolarHBondContact O-N 2.84Å; A756-H759 PolarHBondContact O-N 2.75Å; E757-H759 VanDerWaalsContact C-N 3.29Å; E757-H759 PolarHBondContact O-N 2.79Å; H759-K761 PolarHBondContact O-N 2.76Å; H759-M762 WeakPolarHBondContact CD2-CE 3.31Å; H759-M762 WeakPolarHBondContact NE2-CE 3.46Å; H759-M762 WeakPolarHBondContact O-CB 3.34Å; H759-M762 PolarHBondContact O-N 3.34Å; H759-H763 AromaticContact CE1-CD2 3.5Å; H759-H763 PolarHBondContact CE1-CD2 3.31Å; H759-H763 VanDerWaalsContact CE1-CD2 3.5Å; H759-H763 AromaticContact CE1-NE2 3.21Å; H759-H763 PolarHBondContact CE1-NE2 3.18Å; H759-H763 AromaticContact ND1-CD2 3.66Å; H759-H763 AromaticContact ND1-NE2 3.87Å; H759-H763 AromaticContact NE2-NE2 3.74Å; H759-H763 PolarHBondContact O-CD2 3.07Å; H759-H763 PolarHBondContact O-N 2.94Å; H759-D772 HydrophobicContact CB-CB 4.26Å; H759-D772 IonicContact CE1-OD1 3.63Å; H759-D772 PolarHBondContact CE1-OD1 2.95Å; H759-D772 IonicContact CG-OD1 2.81Å; H759-D772 IonicContact ND1-OD1 2.85Å; H759-D772 PolarHBondContact ND1-OD1 3.17Å; H759-M775 HydrophobicContact CB-CE 3.96Å
760	A	90.4	Very high	89.8	Confident	0 Å²	0	31 Å²	31	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.1	-42.1	173.1	0	0	0	0	0	112	P715 A756 E757 M762 H763 L764 R765 V768	P715-A760 HydrophobicContact CB-CB 4.13Å; A756-A760 PolarHBondContact O-N 2.97Å; E757-A760 PolarHBondContact O-N 3.06Å; A760-M762 VanDerWaalsContact C-N 3.32Å; A760-M762 PolarHBondContact O-N 2.91Å; A760-H763 CarbonylContact O-C 3.55Å; A760-H763 PolarHBondContact O-N 3.12Å; A760-H763 VanDerWaalsContact O-N 3.14Å; A760-L764 PolarHBondContact O-N 3.11Å; A760-R765 HydrophobicContact CB-CB 4.47Å; A760-R765 PolarHBondContact O-N 3.19Å; A760-V768 HydrophobicContact CB-CG2 4.06Å
761	K	90.4	Very high	89.7	Confident	9 Å²	9	31.1 Å²	31.1	4%	0.039	15%	0.146	C	C	.	.	H	α-helix	trans	-60.1	-40.6	173.2	-76.4	-173.4	-178.5	-175.2	0	112.2	G488 E489 V713 P715 E757 A758 H759 H763 L764	G488-K761 PolarHBondContact O-NZ 3.08Å; E489-K761 WeakPolarHBondContact OE2-CE 3.49Å; E489-K761 IonicContact OE2-NZ 2.64Å; E489-K761 PolarHBondContact OE2-NZ 2.72Å; V713-K761 HydrophobicContact CG1-CG 4.3Å; V713-K761 VanDerWaalsContact O-CE 3.31Å; V713-K761 WeakPolarHBondContact O-CE 3.47Å; P715-K761 HydrophobicContact CG-CG 4.05Å; E757-K761 PolarHBondContact O-N 3.37Å; A758-K761 PolarHBondContact O-N 3.37Å; H759-K761 PolarHBondContact O-N 2.76Å; K761-H763 PolarHBondContact O-N 3.38Å; K761-L764 PolarHBondContact O-N 2.7Å
762	M	90.7	Very high	89.7	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.2	-31.3	176.7	-173.1	-179.3	64.7	0	0	112.4	G460 I463 F464 F486 Y705 A758 H759 A760	G460-M762 VanDerWaalsContact CA-CE 3.45Å; I463-M762 HydrophobicContact CB-SD 4.26Å; I463-M762 HydrophobicContact CD1-CG 3.4Å; I463-M762 HydrophobicContact CD1-SD 4.02Å; I463-M762 HydrophobicContact CG2-SD 4.13Å; F464-M762 HydrophobicContact CE1-CE 4.33Å; F464-M762 HydrophobicContact CE1-SD 3.84Å; F464-M762 HydrophobicContact CZ-CE 3.99Å; F464-M762 HydrophobicContact CZ-SD 4.13Å; F486-M762 HydrophobicContact CD2-CB 4.28Å; F486-M762 HydrophobicContact CD2-CG 4.29Å; F486-M762 HydrophobicContact CE2-CB 4.38Å; F486-M762 HydrophobicContact CE2-CG 3.96Å; F486-M762 HydrophobicContact CG-CB 4.45Å; F486-M762 HydrophobicContact CZ-CG 4.19Å; Y705-M762 WeakPolarHBondContact CE1-O 3.42Å; Y705-M762 PolarHBondContact OH-O 3.23Å; A758-M762 PolarHBondContact O-N 2.94Å; H759-M762 WeakPolarHBondContact CD2-CE 3.31Å; H759-M762 WeakPolarHBondContact NE2-CE 3.46Å; H759-M762 WeakPolarHBondContact O-CB 3.34Å; H759-M762 PolarHBondContact O-N 3.34Å; A760-M762 VanDerWaalsContact C-N 3.32Å; A760-M762 PolarHBondContact O-N 2.91Å
763	H	90.5	Very high	89.6	Confident	19 Å²	19	31.5 Å²	31.5	9%	0.088	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	4.6	174.1	-74.1	-76.7	0	0	0	114.2	I459 H759 A760 K761 R765	I459-H763 WeakPolarHBondContact CG2-CE1 3.33Å; I459-H763 WeakPolarHBondContact CG2-ND1 3.39Å; H759-H763 AromaticContact CE1-CD2 3.5Å; H759-H763 PolarHBondContact CE1-CD2 3.31Å; H759-H763 VanDerWaalsContact CE1-CD2 3.5Å; H759-H763 AromaticContact CE1-NE2 3.21Å; H759-H763 PolarHBondContact CE1-NE2 3.18Å; H759-H763 AromaticContact ND1-CD2 3.66Å; H759-H763 AromaticContact ND1-NE2 3.87Å; H759-H763 AromaticContact NE2-NE2 3.74Å; H759-H763 PolarHBondContact O-CD2 3.07Å; H759-H763 PolarHBondContact O-N 2.94Å; A760-H763 CarbonylContact O-C 3.55Å; A760-H763 PolarHBondContact O-N 3.12Å; A760-H763 VanDerWaalsContact O-N 3.14Å; K761-H763 PolarHBondContact O-N 3.38Å; H763-R765 HydrophobicContact CB-CG 3.8Å; H763-R765 PolarHBondContact O-N 3.23Å
764	L	90.3	Very high	89.5	Confident	32 Å²	32	30.2 Å²	30.2	17%	0.168	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	36.8	-169.9	-57.3	177.2	0	0	0	113.3	I450 Y705 Y708 A709 V713 A760 K761	I450-L764 HydrophobicContact CG2-CD1 3.93Å; Y705-L764 HydrophobicContact CE2-CD1 4.14Å; Y705-L764 HydrophobicContact CE2-CG 4.47Å; Y708-L764 HydrophobicContact CD1-CD1 4.18Å; Y708-L764 HydrophobicContact CD1-CD2 4.03Å; Y708-L764 HydrophobicContact CE1-CD1 3.98Å; Y708-L764 HydrophobicContact CE1-CD2 4.26Å; A709-L764 HydrophobicContact CB-CD2 3.62Å; V713-L764 HydrophobicContact CG2-CB 4.21Å; V713-L764 HydrophobicContact CG2-CD2 3.64Å; A760-L764 PolarHBondContact O-N 3.11Å; K761-L764 PolarHBondContact O-N 2.7Å
765	R	88.9	Confident	89.2	Confident	86 Å²	86	30.7 Å²	30.7	33%	0.325	15%	0.145	S	C	.	.			trans	-97.2	134.3	178.9	-68	175.4	-177.1	171.8	-1.6	110.8	A760 H763 Y767	A760-R765 HydrophobicContact CB-CB 4.47Å; A760-R765 PolarHBondContact O-N 3.19Å; H763-R765 HydrophobicContact CB-CG 3.8Å; H763-R765 PolarHBondContact O-N 3.23Å; R765-Y767 VanDerWaalsContact C-N 3.28Å; R765-Y767 PolarHBondContact O-N 3.45Å
766	D	88	Confident	89.1	Confident	82 Å²	82	30.7 Å²	30.7	44%	0.439	15%	0.145	S	C	.	.	S	Bend	trans	-79.9	-8.6	176.3	-64.4	-34.2	0	0	0	113.6	P715 K716	P715-D766 CarbonylContact C-O 3.55Å; P715-D766 WeakPolarHBondContact CA-O 3.24Å; K716-D766 PolarHBondContact N-O 2.84Å
767	Y	89.9	Confident	88.9	Confident	113 Å²	113	30.7 Å²	30.7	44%	0.443	15%	0.145	S	C	.	.	B	Isolated β-bridge	trans	-131.1	137.3	-177.2	-55.7	-80.1	0	0	0	110.1	K716 R765	K716-Y767 HydrophobicContact CB-CD1 4.32Å; R765-Y767 VanDerWaalsContact C-N 3.28Å; R765-Y767 PolarHBondContact O-N 3.45Å
768	V	89.6	Confident	88.7	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.012	15%	0.151	C	C	.	.			trans	-80.4	129.8	174.4	-179.6	0	0	0	0	109.5	P715 K716 L717 A756 E757 A760 D772 V773	P715-V768 HydrophobicContact CB-CG2 4.34Å; K716-V768 PolarHBondContact O-N 2.8Å; L717-V768 HydrophobicContact CD2-CB 4.2Å; L717-V768 HydrophobicContact CD2-CG2 3.75Å; A756-V768 HydrophobicContact CB-CG1 3.84Å; E757-V768 HydrophobicContact CG-CG2 4.15Å; A760-V768 HydrophobicContact CB-CG2 4.06Å; V768-D772 HydrophobicContact CG1-CB 4.05Å; V768-V773 HydrophobicContact CG1-CG2 3.97Å
769	L	88.5	Confident	88.5	Confident	62 Å²	62	32.5 Å²	32.5	33%	0.325	15%	0.152	S	C	.	.			trans	-99.2	166.3	175	-61.3	-179.6	0	0	0	111.7	D771 D772 V773	L769-D771 PolarHBondContact O-N 3.4Å; L769-D772 PolarHBondContact N-OD2 3.26Å; L769-D772 WeakPolarHBondContact O-CB 3.17Å; L769-D772 PolarHBondContact O-N 3.26Å; L769-V773 PolarHBondContact O-N 3.37Å
770	E	86	Confident	88.3	Confident	92 Å²	92	32.4 Å²	32.4	43%	0.43	15%	0.152	S	C	.	.	H	α-helix	trans	-59.5	-32.2	173.9	-73.1	-177	-141.8	0	0	113.1	D772 V773 N774	E770-D772 VanDerWaalsContact C-N 3.33Å; E770-D772 PolarHBondContact O-N 3.27Å; E770-V773 PolarHBondContact O-N 2.9Å; E770-N774 PolarHBondContact O-N 2.93Å; E770-N774 PolarHBondContact O-ND2 2.89Å; E770-N774 VanDerWaalsContact O-ND2 3.11Å
771	D	85	Confident	88.1	Confident	75 Å²	75	32.4 Å²	32.4	40%	0.401	15%	0.152	S	C	.	.	H	α-helix	trans	-63.8	-39.3	177.9	-73.2	-19.7	0	0	0	112	L769 V773 N774 M775	L769-D771 PolarHBondContact O-N 3.4Å; D771-V773 VanDerWaalsContact C-N 3.32Å; D771-N774 PolarHBondContact O-N 3.36Å; D771-M775 WeakPolarHBondContact O-CB 3.49Å; D771-M775 PolarHBondContact O-N 2.96Å
772	D	87.8	Confident	87.8	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-66.4	-39.2	177.5	-53.5	-38.1	0	0	0	110.3	H759 V768 L769 E770 M775 A776	H759-D772 HydrophobicContact CB-CB 4.26Å; H759-D772 IonicContact CE1-OD1 3.63Å; H759-D772 PolarHBondContact CE1-OD1 2.95Å; H759-D772 IonicContact CG-OD1 2.81Å; H759-D772 IonicContact ND1-OD1 2.85Å; H759-D772 PolarHBondContact ND1-OD1 3.17Å; V768-D772 HydrophobicContact CG1-CB 4.05Å; L769-D772 PolarHBondContact N-OD2 3.26Å; L769-D772 WeakPolarHBondContact O-CB 3.17Å; L769-D772 PolarHBondContact O-N 3.26Å; E770-D772 VanDerWaalsContact C-N 3.33Å; E770-D772 PolarHBondContact O-N 3.27Å; D772-M775 PolarHBondContact O-N 3.49Å; D772-A776 WeakPolarHBondContact O-CB 3.43Å; D772-A776 PolarHBondContact O-N 3.16Å
773	V	87.9	Confident	87.5	Confident	11 Å²	11	33.4 Å²	33.4	7%	0.067	16%	0.158	C	C	.	.	H	α-helix	trans	-66.6	-42.3	175.2	-179.5	0	0	0	0	110.8	V725 A756 V768 L769 E770 D771 M775 A776 I777	V725-V773 HydrophobicContact CG2-CG1 4.15Å; A756-V773 HydrophobicContact CB-CG2 4.16Å; V768-V773 HydrophobicContact CG1-CG2 3.97Å; L769-V773 PolarHBondContact O-N 3.37Å; E770-V773 PolarHBondContact O-N 2.9Å; D771-V773 VanDerWaalsContact C-N 3.32Å; V773-M775 VanDerWaalsContact C-N 3.31Å; V773-M775 PolarHBondContact O-N 3.3Å; V773-A776 PolarHBondContact O-N 3.47Å; V773-I777 HydrophobicContact CG1-CD1 3.81Å; V773-I777 HydrophobicContact CG1-CG1 4.35Å; V773-I777 WeakPolarHBondContact O-CB 3.35Å; V773-I777 WeakPolarHBondContact O-CD1 3.33Å; V773-I777 WeakPolarHBondContact O-CG1 3.45Å; V773-I777 PolarHBondContact O-N 2.99Å
774	N	87.6	Confident	87.2	Confident	18 Å²	18	33.2 Å²	33.2	10%	0.096	16%	0.157	C	C	.	.	H	α-helix	trans	-61.3	-41.1	175.7	-68.3	-37.2	0	0	0	111.6	K724 E770 D771 R778 F806	K724-N774 VanDerWaalsContact CE-OD1 3.27Å; K724-N774 WeakPolarHBondContact CE-OD1 3.48Å; K724-N774 PolarHBondContact NZ-OD1 3.35Å; E770-N774 PolarHBondContact O-N 2.93Å; E770-N774 PolarHBondContact O-ND2 2.89Å; E770-N774 VanDerWaalsContact O-ND2 3.11Å; D771-N774 PolarHBondContact O-N 3.36Å; N774-R778 WeakPolarHBondContact O-CB 3.2Å; N774-R778 PolarHBondContact O-N 3.26Å; N774-F806 HydrophobicContact CB-CD1 3.67Å; N774-F806 HydrophobicContact CB-CD2 4.34Å; N774-F806 HydrophobicContact CB-CE1 3.39Å; N774-F806 HydrophobicContact CB-CE2 4.12Å; N774-F806 HydrophobicContact CB-CG 4.14Å; N774-F806 HydrophobicContact CB-CZ 3.64Å
775	M	85.1	Confident	87	Confident	19 Å²	19	31.8 Å²	31.8	9%	0.094	15%	0.15	C	C	.	.	H	α-helix	trans	-63.2	-47.4	174.9	-166.2	-59.5	-58.9	0	0	110.5	R479 L483 H759 D771 D772 V773 I777 R778 V779	R479-M775 HydrophobicContact CG-SD 4.35Å; L483-M775 HydrophobicContact CD1-CE 3.48Å; L483-M775 VanDerWaalsContact CD1-CE 3.48Å; L483-M775 HydrophobicContact CD1-SD 4.12Å; L483-M775 HydrophobicContact CD2-CE 3.7Å; L483-M775 HydrophobicContact CG-CE 4.21Å; H759-M775 HydrophobicContact CB-CE 3.96Å; D771-M775 WeakPolarHBondContact O-CB 3.49Å; D771-M775 PolarHBondContact O-N 2.96Å; D772-M775 PolarHBondContact O-N 3.49Å; V773-M775 VanDerWaalsContact C-N 3.31Å; V773-M775 PolarHBondContact O-N 3.3Å; M775-I777 PolarHBondContact O-N 3.35Å; M775-R778 WeakPolarHBondContact O-CB 3.4Å; M775-R778 PolarHBondContact O-N 3.24Å; M775-R778 VanDerWaalsContact O-N 3.11Å; M775-V779 HydrophobicContact CE-CG2 4.34Å; M775-V779 PolarHBondContact O-N 3.14Å; M775-V779 HydrophobicContact SD-CG2 3.42Å; M775-V779 WeakPolarHBondContact SD-CG2 2.95Å
776	A	88.6	Confident	86.7	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.5	-41.6	178.3	0	0	0	0	0	112.7	M752 M755 A756 D772 V773 R778 V779 M780	M752-A776 HydrophobicContact CG-CB 3.98Å; M752-A776 WeakPolarHBondContact O-CB 3.43Å; M755-A776 HydrophobicContact CB-CB 3.78Å; A756-A776 HydrophobicContact CB-CB 4.13Å; D772-A776 WeakPolarHBondContact O-CB 3.43Å; D772-A776 PolarHBondContact O-N 3.16Å; V773-A776 PolarHBondContact O-N 3.47Å; A776-R778 VanDerWaalsContact C-N 3.33Å; A776-R778 PolarHBondContact O-N 3.32Å; A776-V779 PolarHBondContact O-N 2.98Å; A776-M780 WeakPolarHBondContact O-CB 3.44Å; A776-M780 PolarHBondContact O-N 3.32Å
777	I	88.1	Confident	86.5	Confident	2 Å²	2	25.5 Å²	25.5	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-58.4	-47.6	172.9	-69.6	156.7	0	0	0	109.8	I728 M752 V773 M775 V779 M780 L781	I728-I777 HydrophobicContact CD1-CD1 3.32Å; I728-I777 HydrophobicContact CD1-CG1 3.94Å; I728-I777 HydrophobicContact CD1-CG2 4.06Å; M752-I777 HydrophobicContact CE-CG1 4.41Å; M752-I777 HydrophobicContact CG-CG1 4.28Å; M752-I777 HydrophobicContact SD-CB 4.26Å; M752-I777 HydrophobicContact SD-CD1 4.41Å; M752-I777 HydrophobicContact SD-CG1 3.3Å; M752-I777 WeakPolarHBondContact SD-CG1 3.36Å; V773-I777 HydrophobicContact CG1-CD1 3.81Å; V773-I777 HydrophobicContact CG1-CG1 4.35Å; V773-I777 WeakPolarHBondContact O-CB 3.35Å; V773-I777 WeakPolarHBondContact O-CD1 3.33Å; V773-I777 WeakPolarHBondContact O-CG1 3.45Å; V773-I777 PolarHBondContact O-N 2.99Å; M775-I777 PolarHBondContact O-N 3.35Å; I777-V779 PolarHBondContact O-N 2.83Å; I777-M780 PolarHBondContact O-N 3.14Å; I777-L781 WeakPolarHBondContact O-CB 3.25Å; I777-L781 PolarHBondContact O-N 3.28Å
778	R	86.9	Confident	86.3	Confident	35 Å²	35	20.3 Å²	20.3	13%	0.132	10%	0.102	C	C	.	.	H	α-helix	trans	-59	-50	-178.7	175.6	177	160	-166.7	-13.3	111.2	N774 M775 A776 M780 L781 E782 F806	N774-R778 WeakPolarHBondContact O-CB 3.2Å; N774-R778 PolarHBondContact O-N 3.26Å; M775-R778 WeakPolarHBondContact O-CB 3.4Å; M775-R778 PolarHBondContact O-N 3.24Å; M775-R778 VanDerWaalsContact O-N 3.11Å; A776-R778 VanDerWaalsContact C-N 3.33Å; A776-R778 PolarHBondContact O-N 3.32Å; R778-M780 PolarHBondContact O-N 3.32Å; R778-L781 PolarHBondContact O-N 3.15Å; R778-E782 HydrophobicContact CG-CG 4.35Å; R778-E782 WeakPolarHBondContact CG-OE1 3.41Å; R778-E782 IonicContact CZ-OE1 2.67Å; R778-E782 IonicContact NE-OE1 3.41Å; R778-E782 PolarHBondContact NE-OE1 2.9Å; R778-E782 IonicContact NE-OE2 3.86Å; R778-E782 IonicContact NH2-OE1 2.97Å; R778-E782 WeakPolarHBondContact O-CB 3.45Å; R778-E782 VanDerWaalsContact O-CG 3.3Å; R778-E782 WeakPolarHBondContact O-CG 3.44Å; R778-E782 PolarHBondContact O-N 2.82Å; R778-F806 PolarHBondContact NH1-O 2.88Å
779	V	86.9	Confident	86	Confident	5 Å²	5	24 Å²	24	3%	0.03	12%	0.118	C	C	.	.	H	α-helix	trans	-61.7	-45.7	-179.9	174.1	0	0	0	0	111.5	R479 L483 M755 M775 A776 I777 L781 S783	R479-V779 HydrophobicContact CG-CG2 3.93Å; L483-V779 HydrophobicContact CD1-CG1 4.43Å; L483-V779 HydrophobicContact CD1-CG2 4.12Å; M755-V779 HydrophobicContact SD-CB 4.26Å; M755-V779 HydrophobicContact SD-CG1 3.83Å; M775-V779 HydrophobicContact CE-CG2 4.34Å; M775-V779 PolarHBondContact O-N 3.14Å; M775-V779 HydrophobicContact SD-CG2 3.42Å; M775-V779 WeakPolarHBondContact SD-CG2 2.95Å; A776-V779 PolarHBondContact O-N 2.98Å; I777-V779 PolarHBondContact O-N 2.83Å; V779-L781 VanDerWaalsContact C-N 3.34Å; V779-L781 PolarHBondContact O-N 3.17Å; V779-S783 VanDerWaalsContact O-CB 3.3Å; V779-S783 WeakPolarHBondContact O-CB 3.18Å; V779-S783 PolarHBondContact O-N 3.48Å
780	M	86.8	Confident	85.7	Confident	17 Å²	17	27 Å²	27	8%	0.084	13%	0.129	C	C	.	.	H	α-helix	trans	-63.1	-42.2	178.9	-173	-96.8	-85.7	0	0	111.8	L732 H748 M752 M755 A776 I777 R778 F784	L732-M780 HydrophobicContact CD2-CE 4.46Å; L732-M780 HydrophobicContact CD2-SD 4.25Å; H748-M780 HydrophobicContact CB-CE 4.49Å; M752-M780 HydrophobicContact SD-CE 4.16Å; M755-M780 HydrophobicContact CE-CB 3.87Å; M755-M780 HydrophobicContact CE-CG 4.41Å; A776-M780 WeakPolarHBondContact O-CB 3.44Å; A776-M780 PolarHBondContact O-N 3.32Å; I777-M780 PolarHBondContact O-N 3.14Å; R778-M780 PolarHBondContact O-N 3.32Å; M780-F784 WeakPolarHBondContact O-CB 3.38Å; M780-F784 PolarHBondContact O-N 2.86Å
781	L	85.8	Confident	85.5	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-74.8	-37.3	-175.7	-162.8	129.6	0	0	0	112	L732 I777 R778 V779 F784 I785 F800 L804	L732-L781 HydrophobicContact CD1-CD1 3.57Å; L732-L781 HydrophobicContact CD1-CG 4.37Å; I777-L781 WeakPolarHBondContact O-CB 3.25Å; I777-L781 PolarHBondContact O-N 3.28Å; R778-L781 PolarHBondContact O-N 3.15Å; V779-L781 VanDerWaalsContact C-N 3.34Å; V779-L781 PolarHBondContact O-N 3.17Å; L781-F784 PolarHBondContact O-N 3.23Å; L781-I785 HydrophobicContact CD2-CD1 3.4Å; L781-I785 HydrophobicContact CD2-CG1 4.31Å; L781-I785 HydrophobicContact CG-CD1 4.12Å; L781-I785 VanDerWaalsContact O-CB 3.27Å; L781-I785 WeakPolarHBondContact O-CB 3.36Å; L781-I785 WeakPolarHBondContact O-CG1 3.45Å; L781-I785 PolarHBondContact O-N 3.36Å; L781-F800 HydrophobicContact CD1-CB 4.08Å; L781-F800 HydrophobicContact CD1-CD1 3.9Å; L781-F800 HydrophobicContact CD1-CD2 4.37Å; L781-F800 HydrophobicContact CD1-CE1 4.46Å; L781-F800 HydrophobicContact CD1-CG 3.86Å; L781-F800 HydrophobicContact CD2-CB 3.61Å; L781-F800 HydrophobicContact CD2-CG 4.21Å; L781-F800 HydrophobicContact CG-CB 4.46Å; L781-L804 HydrophobicContact CD2-CD1 4.05Å; L781-L804 HydrophobicContact CD2-CD2 3.62Å; L781-L804 HydrophobicContact CD2-CG 3.68Å
782	E	85	Confident	85.3	Confident	16 Å²	16	23.5 Å²	23.5	8%	0.075	12%	0.12	C	C	.	.	H	α-helix	trans	-59.5	-51.7	170.7	-76.1	164.9	165.1	0	0	110.5	R479 R778 F784 I785 D786 L804 R808	R479-E782 IonicContact CZ-OE2 2.86Å; R479-E782 IonicContact NH1-OE2 3.71Å; R479-E782 PolarHBondContact NH1-OE2 2.85Å; R479-E782 IonicContact NH2-OE1 2.78Å; R479-E782 IonicContact NH2-OE2 3.93Å; R479-E782 PolarHBondContact NH2-OE2 3.29Å; R778-E782 HydrophobicContact CG-CG 4.35Å; R778-E782 WeakPolarHBondContact CG-OE1 3.41Å; R778-E782 IonicContact CZ-OE1 2.67Å; R778-E782 IonicContact NE-OE1 3.41Å; R778-E782 PolarHBondContact NE-OE1 2.9Å; R778-E782 IonicContact NE-OE2 3.86Å; R778-E782 IonicContact NH2-OE1 2.97Å; R778-E782 WeakPolarHBondContact O-CB 3.45Å; R778-E782 VanDerWaalsContact O-CG 3.3Å; R778-E782 WeakPolarHBondContact O-CG 3.44Å; R778-E782 PolarHBondContact O-N 2.82Å; E782-F784 VanDerWaalsContact C-N 3.32Å; E782-F784 PolarHBondContact O-N 2.89Å; E782-I785 PolarHBondContact O-N 3.23Å; E782-D786 PolarHBondContact O-N 2.92Å; E782-D786 VanDerWaalsContact O-N 3.1Å; E782-L804 HydrophobicContact CG-CD2 3.52Å; E782-R808 IonicContact OE1-NH2 3.71Å
783	S	84.4	Confident	85	Confident	14 Å²	14	24.1 Å²	24.1	10%	0.098	12%	0.123	C	C	.	.	H	α-helix	trans	-55.1	-46.7	175.6	171.5	0	0	0	0	112.1	L646 V779 T787	L646-S783 VanDerWaalsContact C-OG 3.26Å; L646-S783 WeakPolarHBondContact CA-OG 3.36Å; L646-S783 PolarHBondContact N-OG 2.84Å; L646-S783 WeakPolarHBondContact O-CA 3.12Å; L646-S783 WeakPolarHBondContact O-CB 3.3Å; L646-S783 PolarHBondContact O-OG 3.1Å; V779-S783 VanDerWaalsContact O-CB 3.3Å; V779-S783 WeakPolarHBondContact O-CB 3.18Å; V779-S783 PolarHBondContact O-N 3.48Å; S783-T787 WeakPolarHBondContact O-CG2 3.48Å
784	F	84	Confident	84.6	Confident	14 Å²	14	31.2 Å²	31.2	6%	0.061	15%	0.149	C	C	.	.	H	α-helix	trans	-67	-45.4	-178.9	-174.1	-104.4	0	0	0	112.2	L732 S736 I744 M780 L781 E782 D786 T787 Q788 M796	L732-F784 HydrophobicContact CD2-CD1 4.46Å; S736-F784 WeakPolarHBondContact OG-CE1 3.42Å; S736-F784 WeakPolarHBondContact OG-CZ 3.46Å; I744-F784 HydrophobicContact CD1-CE1 4.17Å; I744-F784 HydrophobicContact CD1-CZ 3.9Å; I744-F784 HydrophobicContact CG1-CE1 4.38Å; I744-F784 HydrophobicContact CG1-CE2 3.89Å; I744-F784 HydrophobicContact CG1-CZ 3.71Å; M780-F784 WeakPolarHBondContact O-CB 3.38Å; M780-F784 PolarHBondContact O-N 2.86Å; L781-F784 PolarHBondContact O-N 3.23Å; E782-F784 VanDerWaalsContact C-N 3.32Å; E782-F784 PolarHBondContact O-N 2.89Å; F784-D786 VanDerWaalsContact C-N 3.27Å; F784-D786 PolarHBondContact O-N 3.36Å; F784-T787 PolarHBondContact O-N 3.49Å; F784-T787 PolarHBondContact O-OG1 3.46Å; F784-Q788 HydrophobicContact CE1-CG 4.33Å; F784-Q788 WeakPolarHBondContact O-CG 3.33Å; F784-M796 HydrophobicContact CE1-CE 4.27Å; F784-M796 HydrophobicContact CE1-SD 4.13Å
785	I	85.5	Confident	84.4	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.015	16%	0.161	C	C	.	.	H	α-helix	trans	-60	-39.8	-179.1	-77.9	175.9	0	0	0	111.2	L781 E782 T787 Q788 M793 M796 R797 L804	L781-I785 HydrophobicContact CD2-CD1 3.4Å; L781-I785 HydrophobicContact CD2-CG1 4.31Å; L781-I785 HydrophobicContact CG-CD1 4.12Å; L781-I785 VanDerWaalsContact O-CB 3.27Å; L781-I785 WeakPolarHBondContact O-CB 3.36Å; L781-I785 WeakPolarHBondContact O-CG1 3.45Å; L781-I785 PolarHBondContact O-N 3.36Å; E782-I785 PolarHBondContact O-N 3.23Å; I785-T787 PolarHBondContact O-N 2.83Å; I785-Q788 WeakPolarHBondContact O-CB 3.33Å; I785-Q788 PolarHBondContact O-N 2.78Å; I785-Q788 VanDerWaalsContact O-N 3.14Å; I785-M793 HydrophobicContact CG2-CG 3.56Å; I785-M793 WeakPolarHBondContact O-CE 2.94Å; I785-M796 HydrophobicContact CD1-CB 4.39Å; I785-M796 HydrophobicContact CG1-CB 4.2Å; I785-R797 HydrophobicContact CD1-CG 4.05Å; I785-R797 HydrophobicContact CG2-CG 3.64Å; I785-L804 HydrophobicContact CD1-CD1 3.86Å
786	D	83.5	Confident	84.2	Confident	34 Å²	34	31.9 Å²	31.9	18%	0.182	16%	0.157	C	C	.	.	H	α-helix	trans	-72.1	-19.6	-175.7	-69.4	-16.9	0	0	0	113.3	R650 E782 F784 Q788 R797	R650-D786 PolarHBondContact NH2-O 3.22Å; E782-D786 PolarHBondContact O-N 2.92Å; E782-D786 VanDerWaalsContact O-N 3.1Å; F784-D786 VanDerWaalsContact C-N 3.27Å; F784-D786 PolarHBondContact O-N 3.36Å; D786-Q788 VanDerWaalsContact C-N 3.33Å; D786-R797 IonicContact OD1-CZ 2.67Å; D786-R797 IonicContact OD1-NH2 3.81Å; D786-R797 PolarHBondContact OD1-NH2 3.27Å
787	T	83.8	Confident	83.8	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.006	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-10.3	172.9	66.7	0	0	0	0	114	F629 L646 V648 S783 F784 I785	F629-T787 HydrophobicContact CB-CG2 4.27Å; F629-T787 WeakPolarHBondContact CB-O 3.5Å; F629-T787 HydrophobicContact CD2-CG2 3.98Å; F629-T787 HydrophobicContact CG-CG2 4.05Å; F629-T787 PolarHBondContact N-O 2.97Å; L646-T787 HydrophobicContact CB-CG2 3.77Å; L646-T787 HydrophobicContact CD1-CG2 3.93Å; V648-T787 HydrophobicContact CG2-CG2 4.12Å; S783-T787 WeakPolarHBondContact O-CG2 3.48Å; F784-T787 PolarHBondContact O-N 3.49Å; F784-T787 PolarHBondContact O-OG1 3.46Å; I785-T787 PolarHBondContact O-N 2.83Å
788	Q	85.3	Confident	83.4	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.019	21%	0.212	C	C	.	.	S	Bend	trans	-86.7	158.3	-176.8	-60.6	-52.4	-34.4	0	0	113.2	F784 I785 D786 V792 M793 M796	F784-Q788 HydrophobicContact CE1-CG 4.33Å; F784-Q788 WeakPolarHBondContact O-CG 3.33Å; I785-Q788 WeakPolarHBondContact O-CB 3.33Å; I785-Q788 PolarHBondContact O-N 2.78Å; I785-Q788 VanDerWaalsContact O-N 3.14Å; D786-Q788 VanDerWaalsContact C-N 3.33Å; Q788-V792 HydrophobicContact CB-CB 4.34Å; Q788-V792 HydrophobicContact CB-CG1 4.35Å; Q788-M793 WeakPolarHBondContact O-CE 3.34Å; Q788-M796 HydrophobicContact CG-SD 4.3Å
789	K	84.4	Confident	83.1	Confident	81 Å²	81	47.2 Å²	47.2	35%	0.352	23%	0.228	S	C	.	.			trans	-56.5	146.7	171.8	-62.1	-176.7	-177.3	-176.4	0	110.7	T628 S791 V792 M793	T628-K789 HydrophobicContact CG2-CD 4.29Å; T628-K789 HydrophobicContact CG2-CG 4.08Å; K789-S791 PolarHBondContact O-N 2.71Å; K789-V792 HydrophobicContact CB-CG2 4.01Å; K789-V792 WeakPolarHBondContact O-CB 3.46Å; K789-V792 PolarHBondContact O-N 2.93Å; K789-M793 WeakPolarHBondContact O-CB 3.2Å; K789-M793 PolarHBondContact O-N 3.04Å
790	F	82.2	Confident	82.7	Confident	124 Å²	124	47.4 Å²	47.4	54%	0.544	23%	0.228	S	C	.	.	H	α-helix	trans	-51.8	-43.5	-175.2	-175.7	-101.5	0	0	0	115.6	P625 V792 R794	P625-F790 PolarHBondContact O-N 3.17Å; F790-V792 VanDerWaalsContact C-N 3.32Å; F790-V792 PolarHBondContact O-N 3.13Å; F790-R794 PolarHBondContact O-N 2.76Å
791	S	80.8	Confident	82	Confident	88 Å²	88	48.9 Å²	48.9	62%	0.615	24%	0.244	S	C	*	.	H	α-helix	trans	-64	-38.9	179.6	52.5	0	0	0	0	112.5	K789 S795	K789-S791 PolarHBondContact O-N 2.71Å; S791-S795 PolarHBondContact O-N 3.2Å
792	V	81.8	Confident	81.5	Confident	6 Å²	6	58.9 Å²	58.9	4%	0.036	28%	0.281	C	S	.	.	H	α-helix	trans	-75.9	-41.8	-178.6	-172.6	0	0	0	0	110.8	T739 Q788 K789 F790 R794 S795 M796	T739-V792 HydrophobicContact CG2-CB 3.87Å; T739-V792 HydrophobicContact CG2-CG1 3.54Å; T739-V792 HydrophobicContact CG2-CG2 3.15Å; Q788-V792 HydrophobicContact CB-CB 4.34Å; Q788-V792 HydrophobicContact CB-CG1 4.35Å; K789-V792 HydrophobicContact CB-CG2 4.01Å; K789-V792 WeakPolarHBondContact O-CB 3.46Å; K789-V792 PolarHBondContact O-N 2.93Å; F790-V792 VanDerWaalsContact C-N 3.32Å; F790-V792 PolarHBondContact O-N 3.13Å; V792-R794 PolarHBondContact O-N 2.86Å; V792-S795 PolarHBondContact O-N 2.96Å; V792-S795 VanDerWaalsContact O-N 3.15Å; V792-S795 PolarHBondContact O-OG 2.91Å; V792-M796 HydrophobicContact CG1-CE 4.04Å; V792-M796 HydrophobicContact CG1-CG 4.18Å; V792-M796 HydrophobicContact CG1-SD 4.03Å; V792-M796 WeakPolarHBondContact O-CB 3.45Å; V792-M796 WeakPolarHBondContact O-CG 3.18Å; V792-M796 PolarHBondContact O-N 2.68Å
793	M	79.9	Confident	80.8	Confident	13 Å²	13	61 Å²	61	6%	0.064	29%	0.289	C	S	.	.	H	α-helix	trans	-52.6	-43.6	173.4	-175.7	-174	-66.5	0	0	110.5	R650 I785 Q788 K789 R797	R650-M793 VanDerWaalsContact NH2-CE 3.26Å; I785-M793 HydrophobicContact CG2-CG 3.56Å; I785-M793 WeakPolarHBondContact O-CE 2.94Å; Q788-M793 WeakPolarHBondContact O-CE 3.34Å; K789-M793 WeakPolarHBondContact O-CB 3.2Å; K789-M793 PolarHBondContact O-N 3.04Å; M793-R797 VanDerWaalsContact O-CB 3.31Å; M793-R797 WeakPolarHBondContact O-CB 3.45Å; M793-R797 VanDerWaalsContact O-CG 3.24Å; M793-R797 WeakPolarHBondContact O-CG 3.39Å; M793-R797 PolarHBondContact O-N 2.88Å
794	R	80.7	Confident	80.1	Confident	160 Å²	160	61.6 Å²	61.6	60%	0.604	29%	0.291	S	S	*	.	H	α-helix	trans	-69.4	-40.2	179.2	-161.9	176.5	-166	167	5.6	113	F790 V792 K798	F790-R794 PolarHBondContact O-N 2.76Å; V792-R794 PolarHBondContact O-N 2.86Å; R794-K798 PolarHBondContact O-N 3.42Å
795	S	82.9	Confident	79.2	Confident	51 Å²	51	62.9 Å²	62.9	36%	0.357	30%	0.304	S	S	.	.	H	α-helix	trans	-67.7	-45.2	177.2	61.5	0	0	0	0	111.4	S791 V792 K798 T799	S791-S795 PolarHBondContact O-N 3.2Å; V792-S795 PolarHBondContact O-N 2.96Å; V792-S795 VanDerWaalsContact O-N 3.15Å; V792-S795 PolarHBondContact O-OG 2.91Å; S795-K798 WeakPolarHBondContact O-CB 3.17Å; S795-K798 PolarHBondContact O-N 3.44Å; S795-K798 VanDerWaalsContact O-N 3.15Å; S795-T799 PolarHBondContact O-N 3.33Å; S795-T799 VanDerWaalsContact O-N 3.07Å; S795-T799 PolarHBondContact O-OG1 3.31Å
796	M	80.7	Confident	78.1	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-65.3	-41.7	178	-72.6	-170.9	167.3	0	0	112.6	E735 F784 I785 Q788 V792 K798 T799 F800	E735-M796 HydrophobicContact CB-CE 3.97Å; F784-M796 HydrophobicContact CE1-CE 4.27Å; F784-M796 HydrophobicContact CE1-SD 4.13Å; I785-M796 HydrophobicContact CD1-CB 4.39Å; I785-M796 HydrophobicContact CG1-CB 4.2Å; Q788-M796 HydrophobicContact CG-SD 4.3Å; V792-M796 HydrophobicContact CG1-CE 4.04Å; V792-M796 HydrophobicContact CG1-CG 4.18Å; V792-M796 HydrophobicContact CG1-SD 4.03Å; V792-M796 WeakPolarHBondContact O-CB 3.45Å; V792-M796 WeakPolarHBondContact O-CG 3.18Å; V792-M796 PolarHBondContact O-N 2.68Å; M796-K798 PolarHBondContact O-N 3.43Å; M796-T799 WeakPolarHBondContact CA-OG1 3.45Å; M796-T799 PolarHBondContact O-N 2.96Å; M796-T799 PolarHBondContact O-OG1 2.85Å; M796-F800 HydrophobicContact CB-CD2 4.35Å; M796-F800 WeakPolarHBondContact O-CD2 3.44Å; M796-F800 PolarHBondContact O-N 3.44Å
797	R	81.3	Confident	77.1	Confident	104 Å²	104	71.4 Å²	71.4	39%	0.392	34%	0.335	S	S	.	.	H	α-helix	trans	-58.6	-32.9	173.7	-78.8	-178.9	-179.9	-137.7	-0.4	112	I785 D786 M793 A801 L804	I785-R797 HydrophobicContact CD1-CG 4.05Å; I785-R797 HydrophobicContact CG2-CG 3.64Å; D786-R797 IonicContact OD1-CZ 2.67Å; D786-R797 IonicContact OD1-NH2 3.81Å; D786-R797 PolarHBondContact OD1-NH2 3.27Å; M793-R797 VanDerWaalsContact O-CB 3.31Å; M793-R797 WeakPolarHBondContact O-CB 3.45Å; M793-R797 VanDerWaalsContact O-CG 3.24Å; M793-R797 WeakPolarHBondContact O-CG 3.39Å; M793-R797 PolarHBondContact O-N 2.88Å; R797-A801 WeakPolarHBondContact O-CA 3.42Å; R797-A801 WeakPolarHBondContact O-CB 3.19Å; R797-A801 PolarHBondContact O-N 3.13Å; R797-A801 VanDerWaalsContact O-N 3.1Å; R797-L804 HydrophobicContact CG-CD1 4.24Å
798	K	79.1	Confident	76.3	Confident	179 Å²	179	74.5 Å²	74.5	78%	0.778	35%	0.347	S	S	*	.	H	α-helix	trans	-74.5	-42.4	178.2	-169.9	177.1	-179.3	179.6	0	112.4	R794 S795 M796	R794-K798 PolarHBondContact O-N 3.42Å; S795-K798 WeakPolarHBondContact O-CB 3.17Å; S795-K798 PolarHBondContact O-N 3.44Å; S795-K798 VanDerWaalsContact O-N 3.15Å; M796-K798 PolarHBondContact O-N 3.43Å
799	T	81.2	Confident	75.4	Confident	75 Å²	75	79.2 Å²	79.2	46%	0.46	37%	0.372	S	S	.	.	H	α-helix	trans	-70.4	-39.8	179.6	52.1	0	0	0	0	111.8	S795 M796	S795-T799 PolarHBondContact O-N 3.33Å; S795-T799 VanDerWaalsContact O-N 3.07Å; S795-T799 PolarHBondContact O-OG1 3.31Å; M796-T799 WeakPolarHBondContact CA-OG1 3.45Å; M796-T799 PolarHBondContact O-N 2.96Å; M796-T799 PolarHBondContact O-OG1 2.85Å
800	F	78.6	Confident	74.7	Confident	9 Å²	9	80.4 Å²	80.4	4%	0.039	38%	0.382	C	S	.	.	S	Bend	trans	-98.4	11.7	-176.8	-62.1	-73.7	0	0	0	114.4	D731 L732 E735 L781 M796 R802 Y803 L804	D731-F800 HydrophobicContact CB-CE1 4.16Å; D731-F800 HydrophobicContact CB-CZ 4.23Å; L732-F800 HydrophobicContact CD1-CE1 4.38Å; L732-F800 HydrophobicContact CD1-CE2 4.21Å; L732-F800 HydrophobicContact CD1-CZ 4.02Å; E735-F800 HydrophobicContact CG-CE2 4.34Å; E735-F800 HydrophobicContact CG-CZ 4.42Å; L781-F800 HydrophobicContact CD1-CB 4.08Å; L781-F800 HydrophobicContact CD1-CD1 3.9Å; L781-F800 HydrophobicContact CD1-CD2 4.37Å; L781-F800 HydrophobicContact CD1-CE1 4.46Å; L781-F800 HydrophobicContact CD1-CG 3.86Å; L781-F800 HydrophobicContact CD2-CB 3.61Å; L781-F800 HydrophobicContact CD2-CG 4.21Å; L781-F800 HydrophobicContact CG-CB 4.46Å; M796-F800 HydrophobicContact CB-CD2 4.35Å; M796-F800 WeakPolarHBondContact O-CD2 3.44Å; M796-F800 PolarHBondContact O-N 3.44Å; F800-R802 PolarHBondContact O-N 3.33Å; F800-Y803 HydrophobicContact CD1-CD2 4.08Å; F800-Y803 HydrophobicContact CD1-CE2 4.38Å; F800-Y803 PolarHBondContact O-N 3.3Å; F800-L804 PolarHBondContact O-N 3.21Å
801	A	71.4	Confident	74.1	Confident	49 Å²	49	77 Å²	77	41%	0.405	37%	0.37	S	S	.	.	H	α-helix	trans	-51.1	-35.3	-179.7	0	0	0	0	0	113.2	R797 Y803 L804 A805	R797-A801 WeakPolarHBondContact O-CA 3.42Å; R797-A801 WeakPolarHBondContact O-CB 3.19Å; R797-A801 PolarHBondContact O-N 3.13Å; R797-A801 VanDerWaalsContact O-N 3.1Å; A801-Y803 VanDerWaalsContact C-N 3.33Å; A801-Y803 PolarHBondContact O-N 3.33Å; A801-L804 PolarHBondContact O-N 3.41Å; A801-A805 VanDerWaalsContact O-CB 3.27Å; A801-A805 WeakPolarHBondContact O-CB 3.39Å; A801-A805 PolarHBondContact O-N 3.47Å
802	R	74	Confident	73.6	Confident	211 Å²	211	77 Å²	77	80%	0.796	36%	0.36	S	S	*	.	H	α-helix	trans	-61.4	-37.5	178.8	-174.3	178.7	177.2	-174.4	-1	113.2	F800	F800-R802 PolarHBondContact O-N 3.33Å
803	Y	71.8	Confident	73.2	Confident	60 Å²	60	78 Å²	78	24%	0.235	37%	0.365	C	S	.	.	H	α-helix	trans	-83.3	-33	179.8	-60.7	-73.7	0	0	0	111.5	I728 F800 A801 F806	I728-Y803 HydrophobicContact CD1-CD1 4.37Å; I728-Y803 HydrophobicContact CD1-CE1 3.91Å; I728-Y803 HydrophobicContact CG1-CE1 4.35Å; I728-Y803 HydrophobicContact CG1-CE2 4.47Å; F800-Y803 HydrophobicContact CD1-CD2 4.08Å; F800-Y803 HydrophobicContact CD1-CE2 4.38Å; F800-Y803 PolarHBondContact O-N 3.3Å; A801-Y803 VanDerWaalsContact C-N 3.33Å; A801-Y803 PolarHBondContact O-N 3.33Å; Y803-F806 WeakPolarHBondContact O-CB 3.29Å; Y803-F806 PolarHBondContact O-N 3Å
804	L	69.5	Low	73.1	Confident	27 Å²	27	77.5 Å²	77.5	14%	0.141	36%	0.363	C	S	.	.	H	α-helix	trans	-69.9	-31.9	175.4	-69.7	171.7	0	0	0	113.2	L781 E782 I785 R797 F800 A801 F806	L781-L804 HydrophobicContact CD2-CD1 4.05Å; L781-L804 HydrophobicContact CD2-CD2 3.62Å; L781-L804 HydrophobicContact CD2-CG 3.68Å; E782-L804 HydrophobicContact CG-CD2 3.52Å; I785-L804 HydrophobicContact CD1-CD1 3.86Å; R797-L804 HydrophobicContact CG-CD1 4.24Å; F800-L804 PolarHBondContact O-N 3.21Å; A801-L804 PolarHBondContact O-N 3.41Å; L804-F806 PolarHBondContact O-N 3.38Å
805	A	64.8	Low	73	Confident	41 Å²	41	70.6 Å²	70.6	34%	0.339	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-4.5	177.5	0	0	0	0	0	113.5	A801 R807 R808 L813	A801-A805 VanDerWaalsContact O-CB 3.27Å; A801-A805 WeakPolarHBondContact O-CB 3.39Å; A801-A805 PolarHBondContact O-N 3.47Å; A805-R807 PolarHBondContact O-N 3.36Å; A805-R808 PolarHBondContact O-N 3.09Å; A805-L813 HydrophobicContact CB-CD1 4.3Å
806	F	63	Low	72.7	Confident	61 Å²	61	73.4 Å²	73.4	27%	0.268	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	122.2	-179.6	-174.2	-102.3	0	0	0	111.1	N774 R778 Y803 L804 R808	N774-F806 HydrophobicContact CB-CD1 3.67Å; N774-F806 HydrophobicContact CB-CD2 4.34Å; N774-F806 HydrophobicContact CB-CE1 3.39Å; N774-F806 HydrophobicContact CB-CE2 4.12Å; N774-F806 HydrophobicContact CB-CG 4.14Å; N774-F806 HydrophobicContact CB-CZ 3.64Å; R778-F806 PolarHBondContact NH1-O 2.88Å; Y803-F806 WeakPolarHBondContact O-CB 3.29Å; Y803-F806 PolarHBondContact O-N 3Å; L804-F806 PolarHBondContact O-N 3.38Å; F806-R808 PolarHBondContact O-N 3.4Å
807	R	62.9	Low	72.7	Confident	155 Å²	155	74 Å²	74	59%	0.585	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	16.5	-175	-84.1	-155.4	-176.4	-155.4	6.1	115.9	E461 A805	E461-R807 IonicContact OE1-NH1 3.96Å; A805-R807 PolarHBondContact O-N 3.36Å
808	R	65.7	Low	72.8	Confident	66 Å²	66	69 Å²	69	25%	0.249	33%	0.328	C	S	.	.			trans	-81	136.9	164.3	-79.8	-169.7	173.5	-160.3	-3.1	109.1	E782 A805 F806 N810 L813	E782-R808 IonicContact OE1-NH2 3.71Å; A805-R808 PolarHBondContact O-N 3.09Å; F806-R808 PolarHBondContact O-N 3.4Å; R808-N810 PolarHBondContact O-N 3.3Å; R808-L813 HydrophobicContact CB-CD1 4.49Å; R808-L813 HydrophobicContact CB-CD2 4.31Å; R808-L813 HydrophobicContact CB-CG 4.23Å
809	D	66.2	Low	72.9	Confident	103 Å²	103	62.6 Å²	62.6	55%	0.551	30%	0.3	S	S	*	.			trans	-62.8	134.4	175.3	-79.4	-21.4	0	0	0	109.5	N811 E812 L813	D809-N811 PolarHBondContact O-N 3.04Å; D809-N811 VanDerWaalsContact O-N 3.1Å; D809-E812 HydrophobicContact CB-CB 4.16Å; D809-E812 WeakPolarHBondContact O-CB 3.39Å; D809-E812 PolarHBondContact O-N 3.18Å; D809-L813 PolarHBondContact O-N 3.4Å; D809-L813 VanDerWaalsContact O-N 3.1Å
810	N	69.4	Low	72.9	Confident	106 Å²	106	62.2 Å²	62.2	57%	0.567	29%	0.293	S	S	*	.	H	α-helix	trans	-55.1	-31.5	174.9	-71.7	-26.6	0	0	0	111.3	R808 L814 I856	R808-N810 PolarHBondContact O-N 3.3Å; N810-L814 WeakPolarHBondContact O-CG 3.44Å; N810-L814 PolarHBondContact O-N 3.32Å; N810-L814 VanDerWaalsContact O-N 3.1Å; N810-I856 HydrophobicContact CB-CD1 4.43Å
811	N	69.9	Low	73.2	Confident	51 Å²	51	62.6 Å²	62.6	27%	0.273	30%	0.295	S	S	.	.	H	α-helix	trans	-67	-40.8	175.8	-63.9	-16.8	0	0	0	111.6	D809 L814 L815 F862 L867	D809-N811 PolarHBondContact O-N 3.04Å; D809-N811 VanDerWaalsContact O-N 3.1Å; N811-L814 PolarHBondContact O-N 3.17Å; N811-L815 VanDerWaalsContact O-CB 3.32Å; N811-L815 WeakPolarHBondContact O-CB 3.4Å; N811-L815 PolarHBondContact O-N 3.17Å; N811-F862 HydrophobicContact CB-CD2 4.06Å; N811-F862 HydrophobicContact CB-CE2 4.49Å; N811-F862 WeakPolarHBondContact O-CE2 3.37Å; N811-L867 HydrophobicContact CB-CD1 4.05Å
812	E	71.2	Confident	73.7	Confident	88 Å²	88	60.8 Å²	60.8	41%	0.411	28%	0.279	S	S	.	.	H	α-helix	trans	-68.6	-37.7	178.8	-162.6	-175.8	177.7	0	0	111.8	D809 L815 F816	D809-E812 HydrophobicContact CB-CB 4.16Å; D809-E812 WeakPolarHBondContact O-CB 3.39Å; D809-E812 PolarHBondContact O-N 3.18Å; E812-L815 PolarHBondContact O-N 3.26Å; E812-F816 WeakPolarHBondContact O-CB 3.28Å; E812-F816 PolarHBondContact O-N 2.77Å
813	L	73.3	Confident	74	Confident	28 Å²	28	53.6 Å²	53.6	15%	0.147	27%	0.265	C	S	.	.	H	α-helix	trans	-63.3	-44.2	173.4	-67.6	174.5	0	0	0	112	A805 R808 D809 L815 F816 I817	A805-L813 HydrophobicContact CB-CD1 4.3Å; R808-L813 HydrophobicContact CB-CD1 4.49Å; R808-L813 HydrophobicContact CB-CD2 4.31Å; R808-L813 HydrophobicContact CB-CG 4.23Å; D809-L813 PolarHBondContact O-N 3.4Å; D809-L813 VanDerWaalsContact O-N 3.1Å; L813-L815 VanDerWaalsContact C-N 3.32Å; L813-F816 PolarHBondContact O-N 3.28Å; L813-I817 WeakPolarHBondContact O-CG1 3.24Å; L813-I817 PolarHBondContact O-N 3.15Å; L813-I817 VanDerWaalsContact O-N 3.15Å
814	L	77.8	Confident	74.6	Confident	2 Å²	2	55 Å²	55	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-40.1	174.9	-73.9	172.7	0	0	0	111.6	N810 N811 I817 L818 A851 I856 L859 F862	N810-L814 WeakPolarHBondContact O-CG 3.44Å; N810-L814 PolarHBondContact O-N 3.32Å; N810-L814 VanDerWaalsContact O-N 3.1Å; N811-L814 PolarHBondContact O-N 3.17Å; L814-I817 PolarHBondContact O-N 3.12Å; L814-L818 WeakPolarHBondContact O-CB 3.39Å; L814-L818 PolarHBondContact O-N 3.28Å; L814-A851 HydrophobicContact CD2-CB 3.83Å; L814-I856 HydrophobicContact CD1-CG2 4.22Å; L814-I856 HydrophobicContact CD2-CD1 4.24Å; L814-I856 HydrophobicContact CD2-CG2 4.32Å; L814-I856 HydrophobicContact CG-CD1 4.17Å; L814-L859 HydrophobicContact CD1-CD2 4.22Å; L814-L859 HydrophobicContact CD2-CD2 3.87Å; L814-F862 HydrophobicContact CB-CD1 4.27Å; L814-F862 HydrophobicContact CB-CD2 3.84Å; L814-F862 HydrophobicContact CB-CE1 4.24Å; L814-F862 HydrophobicContact CB-CE2 3.83Å; L814-F862 HydrophobicContact CB-CG 4.07Å; L814-F862 HydrophobicContact CB-CZ 4.02Å; L814-F862 HydrophobicContact CD1-CB 3.72Å; L814-F862 HydrophobicContact CD1-CD1 4.37Å; L814-F862 HydrophobicContact CD1-CD2 4.04Å; L814-F862 HydrophobicContact CD1-CG 3.78Å
815	L	78.3	Confident	75.2	Confident	16 Å²	16	56.7 Å²	56.7	8%	0.084	28%	0.281	C	S	.	.	H	α-helix	trans	-64.7	-39.4	176.7	-162.5	132.4	0	0	0	112	N811 E812 L813 L818 K819 F862 L867 N871	N811-L815 VanDerWaalsContact O-CB 3.32Å; N811-L815 WeakPolarHBondContact O-CB 3.4Å; N811-L815 PolarHBondContact O-N 3.17Å; E812-L815 PolarHBondContact O-N 3.26Å; L813-L815 VanDerWaalsContact C-N 3.32Å; L815-L818 PolarHBondContact O-N 3.47Å; L815-K819 HydrophobicContact CD2-CD 3.89Å; L815-K819 HydrophobicContact CD2-CG 4.14Å; L815-K819 WeakPolarHBondContact O-CB 3.25Å; L815-K819 WeakPolarHBondContact O-CG 3.24Å; L815-K819 PolarHBondContact O-N 2.77Å; L815-F862 HydrophobicContact CB-CE2 3.98Å; L815-F862 HydrophobicContact CB-CZ 4Å; L815-F862 HydrophobicContact CD1-CE2 4.35Å; L815-F862 HydrophobicContact CD1-CZ 4.36Å; L815-F862 HydrophobicContact CG-CZ 4.48Å; L815-L867 HydrophobicContact CD1-CB 4.33Å; L815-L867 WeakPolarHBondContact CD1-O 3.47Å; L815-N871 HydrophobicContact CD1-CB 4.35Å; L815-N871 VanDerWaalsContact CD1-ND2 3.27Å; L815-N871 WeakPolarHBondContact CD1-ND2 3.43Å
816	F	76.4	Confident	76	Confident	110 Å²	110	56.7 Å²	56.7	48%	0.482	28%	0.276	S	S	.	.	H	α-helix	trans	-61.4	-46	175.2	180	-95.9	0	0	0	112	E812 L813 L818 K819 Q820	E812-F816 WeakPolarHBondContact O-CB 3.28Å; E812-F816 PolarHBondContact O-N 2.77Å; L813-F816 PolarHBondContact O-N 3.28Å; F816-L818 VanDerWaalsContact C-N 3.26Å; F816-L818 PolarHBondContact O-N 3.47Å; F816-K819 PolarHBondContact O-N 3.08Å; F816-Q820 WeakPolarHBondContact O-CB 3.45Å; F816-Q820 PolarHBondContact O-N 3Å
817	I	80.9	Confident	76.9	Confident	12 Å²	12	56.3 Å²	56.3	6%	0.062	28%	0.284	C	S	.	.	H	α-helix	trans	-59.4	-43.8	175.9	-65.3	166	0	0	0	110.4	L813 L814 Q820 L821 L847 K850 I854	L813-I817 WeakPolarHBondContact O-CG1 3.24Å; L813-I817 PolarHBondContact O-N 3.15Å; L813-I817 VanDerWaalsContact O-N 3.15Å; L814-I817 PolarHBondContact O-N 3.12Å; I817-Q820 WeakPolarHBondContact O-CB 3.46Å; I817-Q820 PolarHBondContact O-N 2.86Å; I817-L821 HydrophobicContact CG2-CD1 4.27Å; I817-L821 WeakPolarHBondContact O-CG 3.47Å; I817-L821 PolarHBondContact O-N 2.82Å; I817-L847 HydrophobicContact CG2-CD1 4.05Å; I817-K850 HydrophobicContact CG2-CB 3.49Å; I817-K850 VanDerWaalsContact CG2-CB 3.49Å; I817-K850 HydrophobicContact CG2-CD 3.74Å; I817-K850 HydrophobicContact CG2-CG 4.23Å; I817-I854 HydrophobicContact CD1-CD1 3.4Å; I817-I854 HydrophobicContact CD1-CG1 4.32Å; I817-I854 HydrophobicContact CG1-CD1 4.14Å
818	L	83.1	Confident	77.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-67.3	-45.7	-177.8	-168.7	139.8	0	0	0	111.3	L814 L815 F816 Q820 L821 V822 L847 F862 F868 F873 I882	L814-L818 WeakPolarHBondContact O-CB 3.39Å; L814-L818 PolarHBondContact O-N 3.28Å; L815-L818 PolarHBondContact O-N 3.47Å; F816-L818 VanDerWaalsContact C-N 3.26Å; F816-L818 PolarHBondContact O-N 3.47Å; L818-Q820 VanDerWaalsContact C-N 3.28Å; L818-Q820 PolarHBondContact O-N 3.38Å; L818-L821 WeakPolarHBondContact O-CB 3.4Å; L818-L821 PolarHBondContact O-N 3.22Å; L818-L821 VanDerWaalsContact O-N 3.11Å; L818-V822 HydrophobicContact CD2-CG2 4.21Å; L818-V822 WeakPolarHBondContact O-CG2 3.26Å; L818-V822 PolarHBondContact O-N 2.76Å; L818-L847 HydrophobicContact CB-CD1 3.82Å; L818-L847 HydrophobicContact CD1-CD1 3.87Å; L818-L847 HydrophobicContact CD1-CD2 3.74Å; L818-L847 HydrophobicContact CD1-CG 4.37Å; L818-L847 HydrophobicContact CG-CD1 4.23Å; L818-F862 HydrophobicContact CD1-CE1 4.14Å; L818-F868 HydrophobicContact CD1-CE2 4.07Å; L818-F873 HydrophobicContact CD2-CD1 3.27Å; L818-F873 HydrophobicContact CD2-CD2 3.81Å; L818-F873 HydrophobicContact CD2-CE1 3.01Å; L818-F873 HydrophobicContact CD2-CE2 3.55Å; L818-F873 HydrophobicContact CD2-CG 3.7Å; L818-F873 HydrophobicContact CD2-CZ 3.17Å; L818-F873 HydrophobicContact CG-CE1 4.42Å; L818-I882 HydrophobicContact CD1-CD1 3.73Å; L818-I882 HydrophobicContact CD1-CG2 4.13Å
819	K	80.6	Confident	78.7	Confident	45 Å²	45	53 Å²	53	20%	0.196	27%	0.274	C	S	.	.	H	α-helix	trans	-57.5	-39.8	171.5	-77.8	-167.5	171.1	-171.6	0	112.4	D654 L815 F816 L821 V822 A823 N871 F873	D654-K819 IonicContact OD2-NZ 3.83Å; L815-K819 HydrophobicContact CD2-CD 3.89Å; L815-K819 HydrophobicContact CD2-CG 4.14Å; L815-K819 WeakPolarHBondContact O-CB 3.25Å; L815-K819 WeakPolarHBondContact O-CG 3.24Å; L815-K819 PolarHBondContact O-N 2.77Å; F816-K819 PolarHBondContact O-N 3.08Å; K819-L821 VanDerWaalsContact C-N 3.35Å; K819-L821 PolarHBondContact O-N 2.83Å; K819-V822 WeakPolarHBondContact O-CB 3.39Å; K819-V822 PolarHBondContact O-N 3.09Å; K819-A823 WeakPolarHBondContact O-CB 3.44Å; K819-A823 PolarHBondContact O-N 3.22Å; K819-N871 WeakPolarHBondContact CE-OD1 3.39Å; K819-N871 PolarHBondContact NZ-OD1 2.96Å; K819-F873 HydrophobicContact CG-CZ 4.3Å
820	Q	82.6	Confident	79.4	Confident	67 Å²	67	54.9 Å²	54.9	31%	0.313	27%	0.274	S	S	.	.	H	α-helix	trans	-63.8	-41	175.9	-172.4	177.1	1.1	0	0	111.9	F816 I817 L818 A823 E824	F816-Q820 WeakPolarHBondContact O-CB 3.45Å; F816-Q820 PolarHBondContact O-N 3Å; I817-Q820 WeakPolarHBondContact O-CB 3.46Å; I817-Q820 PolarHBondContact O-N 2.86Å; L818-Q820 VanDerWaalsContact C-N 3.28Å; L818-Q820 PolarHBondContact O-N 3.38Å; Q820-A823 PolarHBondContact O-N 3.49Å; Q820-E824 PolarHBondContact NE2-OE1 3.25Å; Q820-E824 WeakPolarHBondContact O-CB 3.37Å; Q820-E824 WeakPolarHBondContact O-CG 3.21Å; Q820-E824 PolarHBondContact O-N 3.41Å
821	L	83.8	Confident	80.2	Confident	16 Å²	16	55.2 Å²	55.2	8%	0.084	29%	0.285	C	S	.	.	H	α-helix	trans	-63.4	-41.1	174.1	-73.4	168.5	0	0	0	111.8	I817 L818 K819 E824 Q825 I842 D846 L847 K850	I817-L821 HydrophobicContact CG2-CD1 4.27Å; I817-L821 WeakPolarHBondContact O-CG 3.47Å; I817-L821 PolarHBondContact O-N 2.82Å; L818-L821 WeakPolarHBondContact O-CB 3.4Å; L818-L821 PolarHBondContact O-N 3.22Å; L818-L821 VanDerWaalsContact O-N 3.11Å; K819-L821 VanDerWaalsContact C-N 3.35Å; K819-L821 PolarHBondContact O-N 2.83Å; L821-E824 PolarHBondContact O-N 2.99Å; L821-Q825 WeakPolarHBondContact O-CB 3.43Å; L821-Q825 PolarHBondContact O-N 3.29Å; L821-I842 HydrophobicContact CB-CG2 4.46Å; L821-D846 HydrophobicContact CD1-CB 4.32Å; L821-D846 HydrophobicContact CD2-CB 4.19Å; L821-L847 HydrophobicContact CD1-CB 4.28Å; L821-L847 HydrophobicContact CD1-CD1 4.23Å; L821-K850 HydrophobicContact CD1-CD 4.23Å; L821-K850 HydrophobicContact CD2-CD 3.88Å; L821-K850 HydrophobicContact CG-CD 4.04Å
822	V	83.1	Confident	80.9	Confident	12 Å²	12	60.1 Å²	60.1	7%	0.073	30%	0.299	C	S	.	.	H	α-helix	trans	-59.3	-51.1	174.3	-180	0	0	0	0	110.1	L818 K819 E824 Q825 V826 I840 I842 F873 Q884	L818-V822 HydrophobicContact CD2-CG2 4.21Å; L818-V822 WeakPolarHBondContact O-CG2 3.26Å; L818-V822 PolarHBondContact O-N 2.76Å; K819-V822 WeakPolarHBondContact O-CB 3.39Å; K819-V822 PolarHBondContact O-N 3.09Å; V822-E824 PolarHBondContact O-N 3.09Å; V822-Q825 PolarHBondContact O-N 3.19Å; V822-Q825 VanDerWaalsContact O-N 3.14Å; V822-V826 HydrophobicContact CG1-CG2 4.26Å; V822-V826 VanDerWaalsContact O-CG2 3.29Å; V822-V826 WeakPolarHBondContact O-CG2 3.31Å; V822-V826 PolarHBondContact O-N 3.29Å; V822-I840 HydrophobicContact CG1-CD1 3.59Å; V822-I842 HydrophobicContact CB-CD1 3.94Å; V822-I842 HydrophobicContact CG2-CD1 3.21Å; V822-F873 HydrophobicContact CG2-CE1 3.51Å; V822-F873 HydrophobicContact CG2-CZ 3.92Å; V822-Q884 HydrophobicContact CG1-CB 4.47Å; V822-Q884 HydrophobicContact CG1-CG 4.3Å
823	A	80.2	Confident	81.3	Confident	60 Å²	60	62.6 Å²	62.6	50%	0.496	31%	0.306	S	S	.	.	H	α-helix	trans	-61.9	-42.3	-178.8	0	0	0	0	0	112.4	K819 Q820 Q825 V826 A827	K819-A823 WeakPolarHBondContact O-CB 3.44Å; K819-A823 PolarHBondContact O-N 3.22Å; Q820-A823 PolarHBondContact O-N 3.49Å; A823-Q825 VanDerWaalsContact C-N 3.32Å; A823-Q825 PolarHBondContact O-N 3.19Å; A823-V826 PolarHBondContact O-N 3.2Å; A823-A827 WeakPolarHBondContact O-CB 3.06Å; A823-A827 PolarHBondContact O-N 3.36Å
824	E	83.8	Confident	81.4	Confident	90 Å²	90	64.3 Å²	64.3	42%	0.421	33%	0.33	S	S	.	.	H	α-helix	trans	-59.5	-43.5	174.1	-76.3	171.6	179.3	0	0	110.9	Q820 L821 V822 Y828 K850	Q820-E824 PolarHBondContact NE2-OE1 3.25Å; Q820-E824 WeakPolarHBondContact O-CB 3.37Å; Q820-E824 WeakPolarHBondContact O-CG 3.21Å; Q820-E824 PolarHBondContact O-N 3.41Å; L821-E824 PolarHBondContact O-N 2.99Å; V822-E824 PolarHBondContact O-N 3.09Å; E824-Y828 WeakPolarHBondContact O-CB 3.49Å; E824-Y828 PolarHBondContact O-N 3.46Å; E824-K850 IonicContact OE1-NZ 3.44Å; E824-K850 IonicContact OE2-NZ 3.85Å; E824-K850 PolarHBondContact OE2-NZ 3.17Å
825	Q	82.4	Confident	81.2	Confident	62 Å²	62	68.5 Å²	68.5	29%	0.29	36%	0.355	S	S	.	.	H	α-helix	trans	-70.3	-39	179.4	-168.8	71.6	-26.9	0	0	112.7	L821 V822 A823 Y828 Q829 I840	L821-Q825 WeakPolarHBondContact O-CB 3.43Å; L821-Q825 PolarHBondContact O-N 3.29Å; V822-Q825 PolarHBondContact O-N 3.19Å; V822-Q825 VanDerWaalsContact O-N 3.14Å; A823-Q825 VanDerWaalsContact C-N 3.32Å; A823-Q825 PolarHBondContact O-N 3.19Å; Q825-Y828 WeakPolarHBondContact O-CB 3.46Å; Q825-Y828 PolarHBondContact O-N 3.18Å; Q825-Q829 WeakPolarHBondContact O-CG 3.4Å; Q825-Q829 PolarHBondContact O-N 2.92Å; Q825-I840 HydrophobicContact CB-CG2 4.17Å; Q825-I840 HydrophobicContact CG-CG2 3.79Å
826	V	80.9	Confident	80.6	Confident	40 Å²	40	74.2 Å²	74.2	24%	0.242	38%	0.382	C	S	.	.	H	α-helix	trans	-62.9	-47.2	173.9	171.8	0	0	0	0	110.7	V822 A823 Y828 Q829 R830 I840 F886	V822-V826 HydrophobicContact CG1-CG2 4.26Å; V822-V826 VanDerWaalsContact O-CG2 3.29Å; V822-V826 WeakPolarHBondContact O-CG2 3.31Å; V822-V826 PolarHBondContact O-N 3.29Å; A823-V826 PolarHBondContact O-N 3.2Å; V826-Y828 VanDerWaalsContact C-N 3.28Å; V826-Y828 PolarHBondContact O-N 3.06Å; V826-Q829 PolarHBondContact O-N 2.76Å; V826-R830 WeakPolarHBondContact O-CB 3.23Å; V826-R830 PolarHBondContact O-N 3.07Å; V826-I840 HydrophobicContact CG2-CD1 3.12Å; V826-I840 HydrophobicContact CG2-CG1 3.94Å; V826-F886 HydrophobicContact CG2-CZ 4.38Å
827	A	82.1	Confident	80.3	Confident	53 Å²	53	72.4 Å²	72.4	44%	0.438	38%	0.377	S	S	.	.	H	α-helix	trans	-59.3	-44	177.4	0	0	0	0	0	110.7	A823 R830 S831	A823-A827 WeakPolarHBondContact O-CB 3.06Å; A823-A827 PolarHBondContact O-N 3.36Å; A827-R830 PolarHBondContact O-N 3.12Å; A827-S831 WeakPolarHBondContact O-CB 3.47Å; A827-S831 PolarHBondContact O-N 3.02Å; A827-S831 PolarHBondContact O-OG 2.79Å
828	Y	84.4	Confident	79.8	Confident	119 Å²	119	78.5 Å²	78.5	47%	0.467	41%	0.41	S	S	.	.	H	α-helix	trans	-60	-49.1	175.8	179.7	-99.3	0	0	0	112.7	E824 Q825 V826 S831 R832	E824-Y828 WeakPolarHBondContact O-CB 3.49Å; E824-Y828 PolarHBondContact O-N 3.46Å; Q825-Y828 WeakPolarHBondContact O-CB 3.46Å; Q825-Y828 PolarHBondContact O-N 3.18Å; V826-Y828 VanDerWaalsContact C-N 3.28Å; V826-Y828 PolarHBondContact O-N 3.06Å; Y828-S831 PolarHBondContact O-N 2.9Å; Y828-R832 WeakPolarHBondContact O-CB 3.39Å; Y828-R832 PolarHBondContact O-N 2.91Å; Y828-R832 VanDerWaalsContact O-N 3.07Å; Y828-R832 PolarHBondContact OH-NH1 2.99Å
829	Q	81.8	Confident	79.5	Confident	33 Å²	33	81.8 Å²	81.8	15%	0.154	43%	0.43	C	S	.	.	H	α-helix	trans	-65.1	-40.6	179.2	-72.5	-173.5	6.3	0	0	111.7	Q825 V826 R832 Y833 N837	Q825-Q829 WeakPolarHBondContact O-CG 3.4Å; Q825-Q829 PolarHBondContact O-N 2.92Å; V826-Q829 PolarHBondContact O-N 2.76Å; Q829-R832 PolarHBondContact O-N 3.25Å; Q829-Y833 HydrophobicContact CB-CD2 4.48Å; Q829-Y833 WeakPolarHBondContact O-CB 3.31Å; Q829-Y833 PolarHBondContact O-N 2.9Å; Q829-N837 PolarHBondContact OE1-ND2 3.1Å
830	R	81.6	Confident	79.5	Confident	142 Å²	142	79.7 Å²	79.7	54%	0.536	42%	0.421	S	S	.	.	H	α-helix	trans	-63.7	-45.6	177.7	-168.8	-177.6	-124.7	177.7	0.1	111.6	V826 A827 R832 G834	V826-R830 WeakPolarHBondContact O-CB 3.23Å; V826-R830 PolarHBondContact O-N 3.07Å; A827-R830 PolarHBondContact O-N 3.12Å; R830-R832 VanDerWaalsContact C-N 3.3Å; R830-R832 PolarHBondContact O-N 3.06Å; R830-G834 VanDerWaalsContact O-CA 3.28Å; R830-G834 WeakPolarHBondContact O-CA 3.41Å; R830-G834 PolarHBondContact O-N 2.92Å
831	S	85.4	Confident	79.6	Confident	114 Å²	114	81.5 Å²	81.5	80%	0.797	43%	0.43	S	S	*	.	H	α-helix	trans	-66.7	-30.4	177.9	-66.8	0	0	0	0	113.2	A827 Y828	A827-S831 WeakPolarHBondContact O-CB 3.47Å; A827-S831 PolarHBondContact O-N 3.02Å; A827-S831 PolarHBondContact O-OG 2.79Å; Y828-S831 PolarHBondContact O-N 2.9Å
832	R	85.6	Confident	79.6	Confident	153 Å²	153	80.9 Å²	80.9	58%	0.577	43%	0.426	S	S	*	.	H	α-helix	trans	-89.9	-40.8	-176.5	-174.3	172.4	176.8	147.9	4.6	113.8	Y828 Q829 R830	Y828-R832 WeakPolarHBondContact O-CB 3.39Å; Y828-R832 PolarHBondContact O-N 2.91Å; Y828-R832 VanDerWaalsContact O-N 3.07Å; Y828-R832 PolarHBondContact OH-NH1 2.99Å; Q829-R832 PolarHBondContact O-N 3.25Å; R830-R832 VanDerWaalsContact C-N 3.3Å; R830-R832 PolarHBondContact O-N 3.06Å
833	Y	80.1	Confident	79.8	Confident	140 Å²	140	82.8 Å²	82.8	55%	0.549	44%	0.439	S	S	.	.	H	α-helix	trans	-113.5	-15.1	-170.9	-60.3	-77	0	0	0	113.5	Q829 V835	Q829-Y833 HydrophobicContact CB-CD2 4.48Å; Q829-Y833 WeakPolarHBondContact O-CB 3.31Å; Q829-Y833 PolarHBondContact O-N 2.9Å; Y833-V835 PolarHBondContact O-N 3.43Å
834	G	75.6	Confident	79.9	Confident	64 Å²	64	82.2 Å²	82.2	66%	0.66	43%	0.426	S	S	*	.			trans	68.3	-11.4	179.9	0	0	0	0	0	115.6	R830	R830-G834 VanDerWaalsContact O-CA 3.28Å; R830-G834 WeakPolarHBondContact O-CA 3.41Å; R830-G834 PolarHBondContact O-N 2.92Å
835	V	73.4	Confident	79.9	Confident	90 Å²	90	85.3 Å²	85.3	55%	0.545	44%	0.438	S	S	.	.	S	Bend	trans	-100.7	135.8	-179.5	-176.9	0	0	0	0	109.8	Y833	Y833-V835 PolarHBondContact O-N 3.43Å
836	Q	65.8	Low	80	Confident	137 Å²	137	85.8 Å²	85.8	64%	0.64	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-79.6	116.8	167.4	-73.2	177	-46.8	0	0	108.4
837	N	69	Low	80.1	Confident	72 Å²	72	83.9 Å²	83.9	39%	0.385	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-82.9	139.8	173.5	-65.7	-29.3	0	0	0	109.7	Q829 T839	Q829-N837 PolarHBondContact OE1-ND2 3.1Å; N837-T839 PolarHBondContact O-N 3.39Å
838	D	70.1	Confident	80.1	Confident	139 Å²	139	83.7 Å²	83.7	74%	0.743	42%	0.421	S	S	*	.	S	Bend	trans	-64.6	-26.3	176.8	-102.5	-1.5	0	0	0	113.3
839	T	77.3	Confident	80.1	Confident	69 Å²	69	82 Å²	82	42%	0.423	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	127.8	-178	57	0	0	0	0	110.8	N837 Q884 Q885	N837-T839 PolarHBondContact O-N 3.39Å; T839-Q884 WeakPolarHBondContact CA-O 3.49Å; T839-Q885 HydrophobicContact CG2-CG 4.31Å
840	I	81.1	Confident	79.9	Confident	2 Å²	2	82.8 Å²	82.8	1%	0.01	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	129.5	176.4	-55.1	153.7	0	0	0	109	V822 Q825 V826 I842 L883 Q884 F886	V822-I840 HydrophobicContact CG1-CD1 3.59Å; Q825-I840 HydrophobicContact CB-CG2 4.17Å; Q825-I840 HydrophobicContact CG-CG2 3.79Å; V826-I840 HydrophobicContact CG2-CD1 3.12Å; V826-I840 HydrophobicContact CG2-CG1 3.94Å; I840-I842 HydrophobicContact CG2-CG1 4.19Å; I840-L883 WeakPolarHBondContact O-CA 3.48Å; I840-Q884 HydrophobicContact CB-CB 4.34Å; I840-Q884 HydrophobicContact CD1-CB 4.48Å; I840-Q884 PolarHBondContact N-O 3.26Å; I840-Q884 PolarHBondContact O-N 2.99Å; I840-F886 HydrophobicContact CD1-CD2 4.36Å; I840-F886 HydrophobicContact CD1-CE1 4.41Å; I840-F886 HydrophobicContact CD1-CE2 3.18Å; I840-F886 HydrophobicContact CD1-CZ 3.21Å; I840-F886 HydrophobicContact CG1-CE2 3.88Å; I840-F886 HydrophobicContact CG1-CZ 4.36Å
841	E	84.3	Confident	79.8	Confident	105 Å²	105	76 Å²	76	49%	0.491	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	127.1	177.1	-45.5	-171.6	160.6	0	0	110.1	L883	E841-L883 HydrophobicContact CB-CD2 4.12Å; E841-L883 HydrophobicContact CG-CD2 3.66Å
842	I	84.3	Confident	79.4	Confident	3 Å²	3	77.1 Å²	77.1	2%	0.015	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	127.2	179.3	-60.9	168.5	0	0	0	109.3	L821 V822 I840 E844 L881 I882	L821-I842 HydrophobicContact CB-CG2 4.46Å; V822-I842 HydrophobicContact CB-CD1 3.94Å; V822-I842 HydrophobicContact CG2-CD1 3.21Å; I840-I842 HydrophobicContact CG2-CG1 4.19Å; I842-E844 PolarHBondContact O-N 3.38Å; I842-L881 CarbonylContact O-C 3.52Å; I842-L881 WeakPolarHBondContact O-CA 3.42Å; I842-I882 HydrophobicContact CB-CB 4.3Å; I842-I882 PolarHBondContact N-O 3.16Å; I842-I882 PolarHBondContact O-N 2.88Å
843	P	85.9	Confident	78.9	Confident	52 Å²	52	77.6 Å²	77.6	34%	0.338	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	133.2	172.7	-20.8	33.2	0	0	0	112.4	K845 D846	P843-K845 PolarHBondContact O-N 3.23Å; P843-D846 PolarHBondContact O-N 2.99Å
844	E	82.8	Confident	78.5	Confident	47 Å²	47	74.5 Å²	74.5	22%	0.22	39%	0.385	C	S	.	.	H	α-helix	trans	-59.3	-29.9	177.6	-168.2	-164.2	158.5	0	0	112.7	I842 D846 L847 H848 H875 K880	I842-E844 PolarHBondContact O-N 3.38Å; E844-D846 VanDerWaalsContact C-N 3.29Å; E844-D846 PolarHBondContact O-N 3.47Å; E844-L847 PolarHBondContact O-N 3.04Å; E844-H848 PolarHBondContact O-N 3.01Å; E844-H875 IonicContact OE2-NE2 3.13Å; E844-K880 HydrophobicContact CB-CB 4.26Å; E844-K880 WeakPolarHBondContact CB-O 3.46Å; E844-K880 PolarHBondContact N-O 3.15Å
845	K	84.8	Confident	78.1	Confident	155 Å²	155	76 Å²	76	67%	0.674	39%	0.385	S	S	*	.	H	α-helix	trans	-56.9	-41.3	178.9	-74.8	-174	175.4	-178.9	0	112.6	P843 L847 H848 D849	P843-K845 PolarHBondContact O-N 3.23Å; K845-L847 VanDerWaalsContact C-N 3.33Å; K845-L847 PolarHBondContact O-N 2.95Å; K845-H848 PolarHBondContact O-N 3.12Å; K845-D849 PolarHBondContact O-N 3.34Å
846	D	84.3	Confident	78.2	Confident	73 Å²	73	73 Å²	73	39%	0.39	37%	0.366	S	S	.	.	H	α-helix	trans	-68.5	-36.4	-175.8	-62	-29.5	0	0	0	111.3	L821 P843 E844 K850	L821-D846 HydrophobicContact CD1-CB 4.32Å; L821-D846 HydrophobicContact CD2-CB 4.19Å; P843-D846 PolarHBondContact O-N 2.99Å; E844-D846 VanDerWaalsContact C-N 3.29Å; E844-D846 PolarHBondContact O-N 3.47Å; D846-K850 PolarHBondContact O-N 3.44Å
847	L	82.8	Confident	78.4	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-65.9	-45.7	172.3	-175.5	71.2	0	0	0	110.8	I817 L818 L821 E844 K845 D849 K850 A851 L859 Y863 I882	I817-L847 HydrophobicContact CG2-CD1 4.05Å; L818-L847 HydrophobicContact CB-CD1 3.82Å; L818-L847 HydrophobicContact CD1-CD1 3.87Å; L818-L847 HydrophobicContact CD1-CD2 3.74Å; L818-L847 HydrophobicContact CD1-CG 4.37Å; L818-L847 HydrophobicContact CG-CD1 4.23Å; L821-L847 HydrophobicContact CD1-CB 4.28Å; L821-L847 HydrophobicContact CD1-CD1 4.23Å; E844-L847 PolarHBondContact O-N 3.04Å; K845-L847 VanDerWaalsContact C-N 3.33Å; K845-L847 PolarHBondContact O-N 2.95Å; L847-D849 VanDerWaalsContact C-N 3.32Å; L847-D849 PolarHBondContact O-N 3.15Å; L847-K850 PolarHBondContact O-N 3.06Å; L847-A851 VanDerWaalsContact O-CB 3.26Å; L847-A851 WeakPolarHBondContact O-CB 3.2Å; L847-A851 PolarHBondContact O-N 3.29Å; L847-L859 HydrophobicContact CD2-CD2 3.79Å; L847-L859 HydrophobicContact CG-CD2 4.2Å; L847-Y863 HydrophobicContact CD2-CE1 4.27Å; L847-I882 HydrophobicContact CB-CD1 4.22Å; L847-I882 HydrophobicContact CD2-CD1 3.7Å
848	H	82.8	Confident	78.6	Confident	49 Å²	49	74.4 Å²	74.4	23%	0.227	37%	0.373	C	S	.	.	H	α-helix	trans	-64	-38.4	-177.8	-163.9	-12.1	0	0	0	112	E844 K845 A851 R852 L859	E844-H848 PolarHBondContact O-N 3.01Å; K845-H848 PolarHBondContact O-N 3.12Å; H848-A851 PolarHBondContact O-N 3.06Å; H848-R852 PolarHBondContact CE1-NE 3.38Å; H848-R852 VanDerWaalsContact CE1-NE 3.33Å; H848-R852 PolarHBondContact ND1-NE 3.41Å; H848-R852 WeakPolarHBondContact O-CG 3.32Å; H848-R852 PolarHBondContact O-N 3.42Å; H848-L859 HydrophobicContact CB-CD1 4.1Å
849	D	83.1	Confident	78.8	Confident	83 Å²	83	68.2 Å²	68.2	44%	0.444	34%	0.34	S	S	.	.	H	α-helix	trans	-69.3	-40.3	178.3	-73.7	-24	0	0	0	112.2	K845 L847	K845-D849 PolarHBondContact O-N 3.34Å; L847-D849 VanDerWaalsContact C-N 3.32Å; L847-D849 PolarHBondContact O-N 3.15Å
850	K	77.1	Confident	78.7	Confident	50 Å²	50	68 Å²	68	22%	0.217	34%	0.341	C	S	.	.	H	α-helix	trans	-69.5	-36.5	172.9	-72.8	-170.4	-179.2	176.8	0	112	I817 L821 E824 D846 L847 R852 Q853	I817-K850 HydrophobicContact CG2-CB 3.49Å; I817-K850 VanDerWaalsContact CG2-CB 3.49Å; I817-K850 HydrophobicContact CG2-CD 3.74Å; I817-K850 HydrophobicContact CG2-CG 4.23Å; L821-K850 HydrophobicContact CD1-CD 4.23Å; L821-K850 HydrophobicContact CD2-CD 3.88Å; L821-K850 HydrophobicContact CG-CD 4.04Å; E824-K850 IonicContact OE1-NZ 3.44Å; E824-K850 IonicContact OE2-NZ 3.85Å; E824-K850 PolarHBondContact OE2-NZ 3.17Å; D846-K850 PolarHBondContact O-N 3.44Å; L847-K850 PolarHBondContact O-N 3.06Å; K850-R852 PolarHBondContact O-N 3.16Å; K850-Q853 WeakPolarHBondContact O-CB 3.4Å; K850-Q853 PolarHBondContact O-N 2.98Å
851	A	79.3	Confident	78.4	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-65.1	-36.4	176.3	0	0	0	0	0	112.7	L814 L847 H848 Q853 I854 S855 I856 L859	L814-A851 HydrophobicContact CD2-CB 3.83Å; L847-A851 VanDerWaalsContact O-CB 3.26Å; L847-A851 WeakPolarHBondContact O-CB 3.2Å; L847-A851 PolarHBondContact O-N 3.29Å; H848-A851 PolarHBondContact O-N 3.06Å; A851-Q853 VanDerWaalsContact C-N 3.25Å; A851-Q853 PolarHBondContact O-N 3.29Å; A851-I854 CarbonylContact O-C 3.6Å; A851-I854 PolarHBondContact O-N 2.84Å; A851-S855 PolarHBondContact O-N 3.05Å; A851-I856 CarbonylContact C-O 3.58Å; A851-I856 PolarHBondContact O-N 3.08Å; A851-L859 HydrophobicContact CB-CD2 4.36Å
852	R	78.8	Confident	78.2	Confident	136 Å²	136	65.8 Å²	65.8	51%	0.513	34%	0.341	S	S	.	.	H	α-helix	trans	-61.3	-32.3	174.4	-78.6	174.1	-171.8	-177.3	2.5	113	H848 K850 I854 S855	H848-R852 PolarHBondContact CE1-NE 3.38Å; H848-R852 VanDerWaalsContact CE1-NE 3.33Å; H848-R852 PolarHBondContact ND1-NE 3.41Å; H848-R852 WeakPolarHBondContact O-CG 3.32Å; H848-R852 PolarHBondContact O-N 3.42Å; K850-R852 PolarHBondContact O-N 3.16Å; R852-I854 PolarHBondContact O-N 3.23Å; R852-S855 PolarHBondContact O-N 3.2Å; R852-S855 VanDerWaalsContact O-N 3.09Å
853	Q	75.2	Confident	77.9	Confident	163 Å²	163	66.8 Å²	66.8	76%	0.762	35%	0.345	S	S	*	.	H	α-helix	trans	-65.6	-22.9	176.7	-64.1	175	12	0	0	112.5	K850 A851	K850-Q853 WeakPolarHBondContact O-CB 3.4Å; K850-Q853 PolarHBondContact O-N 2.98Å; A851-Q853 VanDerWaalsContact C-N 3.25Å; A851-Q853 PolarHBondContact O-N 3.29Å
854	I	69.8	Low	77.5	Confident	75 Å²	75	70.2 Å²	70.2	39%	0.385	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	13.5	178	-45.7	-172.6	0	0	0	110.6	I817 A851 R852 I856	I817-I854 HydrophobicContact CD1-CD1 3.4Å; I817-I854 HydrophobicContact CD1-CG1 4.32Å; I817-I854 HydrophobicContact CG1-CD1 4.14Å; A851-I854 CarbonylContact O-C 3.6Å; A851-I854 PolarHBondContact O-N 2.84Å; R852-I854 PolarHBondContact O-N 3.23Å; I854-I856 HydrophobicContact CG2-CD1 4.44Å; I854-I856 PolarHBondContact O-N 3.23Å
855	S	68.9	Low	77.4	Confident	96 Å²	96	68.7 Å²	68.7	67%	0.671	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	24.2	179.9	59.4	0	0	0	0	115.3	A851 R852	A851-S855 PolarHBondContact O-N 3.05Å; R852-S855 PolarHBondContact O-N 3.2Å; R852-S855 VanDerWaalsContact O-N 3.09Å
856	I	74.5	Confident	76.7	Confident	26 Å²	26	68.8 Å²	68.8	13%	0.133	36%	0.358	C	S	.	.			trans	-97.3	118.4	173.5	-57.4	175	0	0	0	108.6	N810 L814 A851 I854	N810-I856 HydrophobicContact CB-CD1 4.43Å; L814-I856 HydrophobicContact CD1-CG2 4.22Å; L814-I856 HydrophobicContact CD2-CD1 4.24Å; L814-I856 HydrophobicContact CD2-CG2 4.32Å; L814-I856 HydrophobicContact CG-CD1 4.17Å; A851-I856 CarbonylContact C-O 3.58Å; A851-I856 PolarHBondContact O-N 3.08Å; I854-I856 HydrophobicContact CG2-CD1 4.44Å; I854-I856 PolarHBondContact O-N 3.23Å
857	H	70	Confident	76.1	Confident	136 Å²	136	68.1 Å²	68.1	63%	0.63	35%	0.354	S	S	*	.			trans	-105.8	-16.9	-176.1	-63.9	-69	0	0	0	114.1
858	N	72.8	Confident	75.9	Confident	103 Å²	103	68.3 Å²	68.3	55%	0.551	36%	0.355	S	S	*	.			trans	-112.3	111.3	-176.9	-167.2	0.7	0	0	0	111.5	S860	N858-S860 PolarHBondContact OD1-N 3.21Å; N858-S860 PolarHBondContact OD1-OG 3.01Å
859	L	74.3	Confident	75.7	Confident	10 Å²	10	74 Å²	74	5%	0.052	38%	0.375	C	S	.	.			trans	-100.3	-10.7	-179.9	-70.4	152.1	0	0	0	112.9	L814 L847 H848 A851 A861 F862 Y863	L814-L859 HydrophobicContact CD1-CD2 4.22Å; L814-L859 HydrophobicContact CD2-CD2 3.87Å; L847-L859 HydrophobicContact CD2-CD2 3.79Å; L847-L859 HydrophobicContact CG-CD2 4.2Å; H848-L859 HydrophobicContact CB-CD1 4.1Å; A851-L859 HydrophobicContact CB-CD2 4.36Å; L859-A861 PolarHBondContact O-N 3.39Å; L859-F862 WeakPolarHBondContact O-CB 3.21Å; L859-F862 PolarHBondContact O-N 3.43Å; L859-F862 VanDerWaalsContact O-N 3.09Å; L859-Y863 HydrophobicContact CB-CE2 3.91Å; L859-Y863 WeakPolarHBondContact O-CD2 3.32Å; L859-Y863 PolarHBondContact O-N 3.38Å; L859-Y863 VanDerWaalsContact O-N 3.13Å
860	S	74.9	Confident	75.2	Confident	63 Å²	63	71.1 Å²	71.1	44%	0.441	36%	0.36	S	S	.	.	H	α-helix	trans	-62.8	-46.3	-176.9	58	0	0	0	0	112.3	N858 F862 Y863 D864	N858-S860 PolarHBondContact OD1-N 3.21Å; N858-S860 PolarHBondContact OD1-OG 3.01Å; S860-F862 PolarHBondContact O-N 3.49Å; S860-F862 VanDerWaalsContact O-N 3.15Å; S860-Y863 PolarHBondContact O-N 2.88Å; S860-Y863 VanDerWaalsContact O-N 3.16Å; S860-D864 PolarHBondContact O-N 3.4Å
861	A	76.3	Confident	75.1	Confident	60 Å²	60	69.2 Å²	69.2	50%	0.496	35%	0.353	S	S	.	.	H	α-helix	trans	-60.2	-25	174.9	0	0	0	0	0	113.3	L859 S865	L859-A861 PolarHBondContact O-N 3.39Å; A861-S865 PolarHBondContact O-N 3.44Å
862	F	78.7	Confident	75.1	Confident	1 Å²	1	74.9 Å²	74.9	0%	0.004	37%	0.374	C	S	.	.	H	α-helix	trans	-79.5	-40.5	177.2	175.4	-108.5	0	0	0	111.8	N811 L814 L815 L818 L859 S860 D864 S865 F868	N811-F862 HydrophobicContact CB-CD2 4.06Å; N811-F862 HydrophobicContact CB-CE2 4.49Å; N811-F862 WeakPolarHBondContact O-CE2 3.37Å; L814-F862 HydrophobicContact CB-CD1 4.27Å; L814-F862 HydrophobicContact CB-CD2 3.84Å; L814-F862 HydrophobicContact CB-CE1 4.24Å; L814-F862 HydrophobicContact CB-CE2 3.83Å; L814-F862 HydrophobicContact CB-CG 4.07Å; L814-F862 HydrophobicContact CB-CZ 4.02Å; L814-F862 HydrophobicContact CD1-CB 3.72Å; L814-F862 HydrophobicContact CD1-CD1 4.37Å; L814-F862 HydrophobicContact CD1-CD2 4.04Å; L814-F862 HydrophobicContact CD1-CG 3.78Å; L815-F862 HydrophobicContact CB-CE2 3.98Å; L815-F862 HydrophobicContact CB-CZ 4Å; L815-F862 HydrophobicContact CD1-CE2 4.35Å; L815-F862 HydrophobicContact CD1-CZ 4.36Å; L815-F862 HydrophobicContact CG-CZ 4.48Å; L818-F862 HydrophobicContact CD1-CE1 4.14Å; L859-F862 WeakPolarHBondContact O-CB 3.21Å; L859-F862 PolarHBondContact O-N 3.43Å; L859-F862 VanDerWaalsContact O-N 3.09Å; S860-F862 PolarHBondContact O-N 3.49Å; S860-F862 VanDerWaalsContact O-N 3.15Å; F862-D864 VanDerWaalsContact C-N 3.28Å; F862-D864 PolarHBondContact O-N 3.42Å; F862-S865 WeakPolarHBondContact O-CB 3.22Å; F862-S865 PolarHBondContact O-N 3.15Å; F862-S865 PolarHBondContact O-OG 3.31Å; F862-F868 HydrophobicContact CD1-CD2 4.12Å; F862-F868 AromaticContact CE1-CD2 3.47Å; F862-F868 HydrophobicContact CE1-CD2 3.47Å; F862-F868 VanDerWaalsContact CE1-CD2 3.47Å; F862-F868 AromaticContact CE1-CE2 3.91Å; F862-F868 HydrophobicContact CE1-CE2 3.91Å; F862-F868 HydrophobicContact CE1-CG 4.48Å; F862-F868 AromaticContact CZ-CD2 3.76Å; F862-F868 HydrophobicContact CZ-CD2 3.76Å; F862-F868 WeakPolarHBondContact O-CB 3.17Å
863	Y	79.1	Confident	75.3	Confident	25 Å²	25	69 Å²	69	10%	0.098	35%	0.352	C	S	.	.	H	α-helix	trans	-66.7	-30.3	176.4	-61.3	-42.5	0	0	0	113.4	L847 L859 S860 S865 F868 H875 I882	L847-Y863 HydrophobicContact CD2-CE1 4.27Å; L859-Y863 HydrophobicContact CB-CE2 3.91Å; L859-Y863 WeakPolarHBondContact O-CD2 3.32Å; L859-Y863 PolarHBondContact O-N 3.38Å; L859-Y863 VanDerWaalsContact O-N 3.13Å; S860-Y863 PolarHBondContact O-N 2.88Å; S860-Y863 VanDerWaalsContact O-N 3.16Å; Y863-S865 VanDerWaalsContact C-N 3.31Å; Y863-F868 HydrophobicContact CD1-CD2 4.36Å; Y863-F868 HydrophobicContact CD1-CE1 4.17Å; Y863-F868 AromaticContact CD1-CE2 3.89Å; Y863-F868 HydrophobicContact CD1-CE2 3.89Å; Y863-F868 AromaticContact CD1-CZ 3.78Å; Y863-F868 HydrophobicContact CD1-CZ 3.78Å; Y863-F868 HydrophobicContact CE1-CE2 4.16Å; Y863-F868 HydrophobicContact CE1-CZ 4.2Å; Y863-H875 HydrophobicContact CD1-CB 4.05Å; Y863-H875 HydrophobicContact CE1-CB 4.42Å; Y863-H875 AromaticContact CE2-CD2 3.97Å; Y863-H875 AromaticContact CE2-NE2 3.91Å; Y863-H875 HydrophobicContact CG-CB 4.27Å; Y863-H875 AromaticContact CZ-CD2 3.83Å; Y863-I882 HydrophobicContact CE1-CD1 4.38Å
864	D	78.3	Confident	75.5	Confident	123 Å²	123	64 Å²	64	66%	0.658	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-13.1	176.2	-66.6	-28.8	0	0	0	112.8	S860 F862	S860-D864 PolarHBondContact O-N 3.4Å; F862-D864 VanDerWaalsContact C-N 3.28Å; F862-D864 PolarHBondContact O-N 3.42Å
865	S	79.1	Confident	76.1	Confident	16 Å²	16	63.2 Å²	63.2	11%	0.112	33%	0.33	C	S	.	.	S	Bend	trans	-69.8	143.1	-178	75.5	0	0	0	0	112.5	A861 F862 Y863 L867 F868	A861-S865 PolarHBondContact O-N 3.44Å; F862-S865 WeakPolarHBondContact O-CB 3.22Å; F862-S865 PolarHBondContact O-N 3.15Å; F862-S865 PolarHBondContact O-OG 3.31Å; Y863-S865 VanDerWaalsContact C-N 3.31Å; S865-L867 PolarHBondContact O-N 3.11Å; S865-F868 WeakPolarHBondContact O-CB 3.34Å; S865-F868 PolarHBondContact O-N 3.14Å
866	E	71.6	Confident	76.7	Confident	157 Å²	157	60.9 Å²	60.9	73%	0.734	31%	0.31	S	S	*	.	H	α-helix	trans	-64.1	-29.4	176.5	-66.9	-168.4	166.4	0	0	112.4	F868 R869 S870	E866-F868 VanDerWaalsContact C-N 3.26Å; E866-F868 PolarHBondContact O-N 2.88Å; E866-R869 PolarHBondContact O-N 3.48Å; E866-R869 VanDerWaalsContact O-N 3.13Å; E866-S870 WeakPolarHBondContact O-CB 3.25Å; E866-S870 PolarHBondContact O-N 3.05Å; E866-S870 PolarHBondContact O-OG 3.49Å
867	L	71.2	Confident	76.7	Confident	59 Å²	59	62 Å²	62	31%	0.309	33%	0.328	S	S	.	.	H	α-helix	trans	-59.2	-34.5	175	-65.9	173.9	0	0	0	113	N811 L815 S865 S870 N871	N811-L867 HydrophobicContact CB-CD1 4.05Å; L815-L867 HydrophobicContact CD1-CB 4.33Å; L815-L867 WeakPolarHBondContact CD1-O 3.47Å; S865-L867 PolarHBondContact O-N 3.11Å; L867-S870 WeakPolarHBondContact CA-OG 3.41Å; L867-S870 PolarHBondContact O-OG 3Å; L867-S870 VanDerWaalsContact O-OG 3.12Å; L867-N871 PolarHBondContact O-N 3.41Å; L867-N871 PolarHBondContact O-ND2 3.03Å
868	F	78.8	Confident	77	Confident	4 Å²	4	65.1 Å²	65.1	2%	0.018	34%	0.34	C	S	.	.	H	α-helix	trans	-69.6	-41.9	176.9	-177.2	-101.1	0	0	0	111	L818 F862 Y863 S865 E866 F873 H875 I882	L818-F868 HydrophobicContact CD1-CE2 4.07Å; F862-F868 HydrophobicContact CD1-CD2 4.12Å; F862-F868 AromaticContact CE1-CD2 3.47Å; F862-F868 HydrophobicContact CE1-CD2 3.47Å; F862-F868 VanDerWaalsContact CE1-CD2 3.47Å; F862-F868 AromaticContact CE1-CE2 3.91Å; F862-F868 HydrophobicContact CE1-CE2 3.91Å; F862-F868 HydrophobicContact CE1-CG 4.48Å; F862-F868 AromaticContact CZ-CD2 3.76Å; F862-F868 HydrophobicContact CZ-CD2 3.76Å; F862-F868 WeakPolarHBondContact O-CB 3.17Å; Y863-F868 HydrophobicContact CD1-CD2 4.36Å; Y863-F868 HydrophobicContact CD1-CE1 4.17Å; Y863-F868 AromaticContact CD1-CE2 3.89Å; Y863-F868 HydrophobicContact CD1-CE2 3.89Å; Y863-F868 AromaticContact CD1-CZ 3.78Å; Y863-F868 HydrophobicContact CD1-CZ 3.78Å; Y863-F868 HydrophobicContact CE1-CE2 4.16Å; Y863-F868 HydrophobicContact CE1-CZ 4.2Å; S865-F868 WeakPolarHBondContact O-CB 3.34Å; S865-F868 PolarHBondContact O-N 3.14Å; E866-F868 VanDerWaalsContact C-N 3.26Å; E866-F868 PolarHBondContact O-N 2.88Å; F868-F873 HydrophobicContact CD1-CB 4.02Å; F868-F873 HydrophobicContact CD2-CB 3.72Å; F868-F873 HydrophobicContact CD2-CD2 4.43Å; F868-F873 HydrophobicContact CD2-CG 4.29Å; F868-F873 HydrophobicContact CE1-CB 3.7Å; F868-F873 WeakPolarHBondContact CE1-O 3.43Å; F868-F873 HydrophobicContact CE2-CB 3.38Å; F868-F873 HydrophobicContact CE2-CG 4.03Å; F868-F873 HydrophobicContact CG-CB 4.04Å; F868-F873 HydrophobicContact CZ-CB 3.37Å; F868-F873 HydrophobicContact CZ-CG 4.42Å; F868-F873 WeakPolarHBondContact O-CB 3.43Å; F868-F873 PolarHBondContact O-N 3.36Å; F868-H875 HydrophobicContact CE1-CB 3.98Å; F868-H875 HydrophobicContact CZ-CB 4.01Å; F868-I882 HydrophobicContact CE2-CG2 4.38Å; F868-I882 HydrophobicContact CZ-CG2 4.17Å
869	R	77.6	Confident	77.2	Confident	169 Å²	169	67.2 Å²	67.2	64%	0.638	34%	0.344	S	S	*	.	H	α-helix	trans	-73.7	-37.5	178.2	-65.8	-175.2	-178.3	172	3.2	112.8	E866 N871 R872	E866-R869 PolarHBondContact O-N 3.48Å; E866-R869 VanDerWaalsContact O-N 3.13Å; R869-N871 PolarHBondContact O-N 3.5Å; R869-R872 PolarHBondContact O-N 3.03Å
870	S	72.9	Confident	77.5	Confident	21 Å²	21	72.9 Å²	72.9	15%	0.147	37%	0.368	C	S	.	.	H	α-helix	trans	-63.5	-32.6	-179.4	72	0	0	0	0	112	N690 E866 L867 R872	N690-S870 PolarHBondContact OD1-OG 3.16Å; E866-S870 WeakPolarHBondContact O-CB 3.25Å; E866-S870 PolarHBondContact O-N 3.05Å; E866-S870 PolarHBondContact O-OG 3.49Å; L867-S870 WeakPolarHBondContact CA-OG 3.41Å; L867-S870 PolarHBondContact O-OG 3Å; L867-S870 VanDerWaalsContact O-OG 3.12Å; S870-R872 PolarHBondContact O-N 3.33Å
871	N	75	Confident	78	Confident	11 Å²	11	71.7 Å²	71.7	6%	0.059	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	13.2	173.4	-71.3	-80.4	0	0	0	113.7	L815 K819 L867 R869 F873 Q884	L815-N871 HydrophobicContact CD1-CB 4.35Å; L815-N871 VanDerWaalsContact CD1-ND2 3.27Å; L815-N871 WeakPolarHBondContact CD1-ND2 3.43Å; K819-N871 WeakPolarHBondContact CE-OD1 3.39Å; K819-N871 PolarHBondContact NZ-OD1 2.96Å; L867-N871 PolarHBondContact O-N 3.41Å; L867-N871 PolarHBondContact O-ND2 3.03Å; R869-N871 PolarHBondContact O-N 3.5Å; N871-F873 VanDerWaalsContact C-N 3.31Å; N871-F873 HydrophobicContact CB-CD2 3.67Å; N871-F873 HydrophobicContact CB-CE2 3.56Å; N871-F873 PolarHBondContact O-N 2.6Å; N871-Q884 PolarHBondContact O-NE2 3.03Å; N871-Q884 PolarHBondContact O-OE1 3.34Å
872	R	79	Confident	78.4	Confident	119 Å²	119	68.8 Å²	68.8	45%	0.449	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	25.5	176.6	-57	-69.1	-172.6	175.3	-1.4	115.7	R869 S870 Q884 Q885	R869-R872 PolarHBondContact O-N 3.03Å; S870-R872 PolarHBondContact O-N 3.33Å; R872-Q884 PolarHBondContact O-OE1 3.47Å; R872-Q884 VanDerWaalsContact O-OE1 3.11Å; R872-Q885 WeakPolarHBondContact CB-O 3.16Å; R872-Q885 PolarHBondContact O-N 2.97Å
873	F	82.8	Confident	78.6	Confident	12 Å²	12	70.9 Å²	70.9	5%	0.053	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	137.3	171	-63.3	-74.6	0	0	0	111.3	L818 K819 V822 F868 N871 I882 L883 Q884	L818-F873 HydrophobicContact CD2-CD1 3.27Å; L818-F873 HydrophobicContact CD2-CD2 3.81Å; L818-F873 HydrophobicContact CD2-CE1 3.01Å; L818-F873 HydrophobicContact CD2-CE2 3.55Å; L818-F873 HydrophobicContact CD2-CG 3.7Å; L818-F873 HydrophobicContact CD2-CZ 3.17Å; L818-F873 HydrophobicContact CG-CE1 4.42Å; K819-F873 HydrophobicContact CG-CZ 4.3Å; V822-F873 HydrophobicContact CG2-CE1 3.51Å; V822-F873 HydrophobicContact CG2-CZ 3.92Å; F868-F873 HydrophobicContact CD1-CB 4.02Å; F868-F873 HydrophobicContact CD2-CB 3.72Å; F868-F873 HydrophobicContact CD2-CD2 4.43Å; F868-F873 HydrophobicContact CD2-CG 4.29Å; F868-F873 HydrophobicContact CE1-CB 3.7Å; F868-F873 WeakPolarHBondContact CE1-O 3.43Å; F868-F873 HydrophobicContact CE2-CB 3.38Å; F868-F873 HydrophobicContact CE2-CG 4.03Å; F868-F873 HydrophobicContact CG-CB 4.04Å; F868-F873 HydrophobicContact CZ-CB 3.37Å; F868-F873 HydrophobicContact CZ-CG 4.42Å; F868-F873 WeakPolarHBondContact O-CB 3.43Å; F868-F873 PolarHBondContact O-N 3.36Å; N871-F873 VanDerWaalsContact C-N 3.31Å; N871-F873 HydrophobicContact CB-CD2 3.67Å; N871-F873 HydrophobicContact CB-CE2 3.56Å; N871-F873 PolarHBondContact O-N 2.6Å; F873-I882 HydrophobicContact CD1-CG2 4.11Å; F873-L883 WeakPolarHBondContact CA-O 3.44Å; F873-Q884 HydrophobicContact CD1-CB 3.96Å; F873-Q884 HydrophobicContact CD1-CG 4.31Å; F873-Q884 HydrophobicContact CE1-CB 3.73Å; F873-Q884 HydrophobicContact CE1-CG 3.81Å; F873-Q884 HydrophobicContact CZ-CG 4.39Å; F873-Q884 VanDerWaalsContact CZ-OE1 3.29Å
874	S	80.6	Confident	78.7	Confident	58 Å²	58	69.7 Å²	69.7	41%	0.406	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	130.7	171.5	178.3	0	0	0	0	109.8	L883	S874-L883 PolarHBondContact N-O 3.05Å; S874-L883 PolarHBondContact O-N 3.12Å
875	H	82.1	Confident	78.6	Confident	58 Å²	58	68.9 Å²	68.9	27%	0.269	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	121.7	177.5	171.7	-103.1	0	0	0	110.4	E844 Y863 F868 G877	E844-H875 IonicContact OE2-NE2 3.13Å; Y863-H875 HydrophobicContact CD1-CB 4.05Å; Y863-H875 HydrophobicContact CE1-CB 4.42Å; Y863-H875 AromaticContact CE2-CD2 3.97Å; Y863-H875 AromaticContact CE2-NE2 3.91Å; Y863-H875 HydrophobicContact CG-CB 4.27Å; Y863-H875 AromaticContact CZ-CD2 3.83Å; F868-H875 HydrophobicContact CE1-CB 3.98Å; F868-H875 HydrophobicContact CZ-CB 4.01Å; H875-G877 VanDerWaalsContact CE1-CA 3.45Å; H875-G877 WeakPolarHBondContact CE1-CA 3.31Å
876	D	81.4	Confident	78	Confident	48 Å²	48	72.3 Å²	72.3	26%	0.257	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	97.3	171.3	-173.5	-7.5	0	0	0	110.4	K878 K879 K880 L881	D876-K878 PolarHBondContact O-N 3.06Å; D876-K878 PolarHBondContact OD1-N 2.83Å; D876-K879 HydrophobicContact CB-CB 4.43Å; D876-K879 PolarHBondContact O-N 3.35Å; D876-K879 WeakPolarHBondContact OD2-CD 3.28Å; D876-K879 WeakPolarHBondContact OD2-CG 3.41Å; D876-K880 PolarHBondContact O-N 3.34Å; D876-L881 PolarHBondContact N-O 3.21Å; D876-L881 PolarHBondContact O-N 3.21Å
877	G	74.1	Confident	78.4	Confident	50 Å²	50	68.1 Å²	68.1	52%	0.515	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-15.3	-179.2	0	0	0	0	0	114.9	H875	H875-G877 VanDerWaalsContact CE1-CA 3.45Å; H875-G877 WeakPolarHBondContact CE1-CA 3.31Å
878	K	77.1	Confident	78.7	Confident	200 Å²	200	68.5 Å²	68.5	87%	0.87	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-36.5	175.7	-68.7	-179.6	-178.2	174.4	0	111.8	D876	D876-K878 PolarHBondContact O-N 3.06Å; D876-K878 PolarHBondContact OD1-N 2.83Å
879	K	75.6	Confident	78.7	Confident	148 Å²	148	72.1 Å²	72.1	64%	0.643	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-11.9	179.8	-67.3	-175.4	-177.6	175.5	0	113.6	D876 L881	D876-K879 HydrophobicContact CB-CB 4.43Å; D876-K879 PolarHBondContact O-N 3.35Å; D876-K879 WeakPolarHBondContact OD2-CD 3.28Å; D876-K879 WeakPolarHBondContact OD2-CG 3.41Å; K879-L881 HydrophobicContact CB-CB 4.37Å; K879-L881 HydrophobicContact CB-CD1 4.06Å; K879-L881 HydrophobicContact CB-CG 4.2Å; K879-L881 PolarHBondContact O-N 3.46Å
880	K	82.4	Confident	78.8	Confident	128 Å²	128	66.4 Å²	66.4	56%	0.557	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	39.4	-174.4	-55.3	-177.3	-179.5	-178	0	111.7	E844 D876	E844-K880 HydrophobicContact CB-CB 4.26Å; E844-K880 WeakPolarHBondContact CB-O 3.46Å; E844-K880 PolarHBondContact N-O 3.15Å; D876-K880 PolarHBondContact O-N 3.34Å
881	L	83.9	Confident	79.2	Confident	38 Å²	38	69.3 Å²	69.3	20%	0.199	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	139.2	180	-68.7	172.3	0	0	0	109.3	I842 D876 K879	I842-L881 CarbonylContact O-C 3.52Å; I842-L881 WeakPolarHBondContact O-CA 3.42Å; D876-L881 PolarHBondContact N-O 3.21Å; D876-L881 PolarHBondContact O-N 3.21Å; K879-L881 HydrophobicContact CB-CB 4.37Å; K879-L881 HydrophobicContact CB-CD1 4.06Å; K879-L881 HydrophobicContact CB-CG 4.2Å; K879-L881 PolarHBondContact O-N 3.46Å
882	I	84.4	Confident	79.4	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	119.7	168.3	-57.2	173.7	0	0	0	105.6	L818 I842 L847 Y863 F868 F873	L818-I882 HydrophobicContact CD1-CD1 3.73Å; L818-I882 HydrophobicContact CD1-CG2 4.13Å; I842-I882 HydrophobicContact CB-CB 4.3Å; I842-I882 PolarHBondContact N-O 3.16Å; I842-I882 PolarHBondContact O-N 2.88Å; L847-I882 HydrophobicContact CB-CD1 4.22Å; L847-I882 HydrophobicContact CD2-CD1 3.7Å; Y863-I882 HydrophobicContact CE1-CD1 4.38Å; F868-I882 HydrophobicContact CE2-CG2 4.38Å; F868-I882 HydrophobicContact CZ-CG2 4.17Å; F873-I882 HydrophobicContact CD1-CG2 4.11Å
883	L	82.9	Confident	79.5	Confident	44 Å²	44	69.9 Å²	69.9	23%	0.23	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	125.4	177.9	-60.5	175.7	0	0	0	108.1	I840 E841 F873 S874	I840-L883 WeakPolarHBondContact O-CA 3.48Å; E841-L883 HydrophobicContact CB-CD2 4.12Å; E841-L883 HydrophobicContact CG-CD2 3.66Å; F873-L883 WeakPolarHBondContact CA-O 3.44Å; S874-L883 PolarHBondContact N-O 3.05Å; S874-L883 PolarHBondContact O-N 3.12Å
884	Q	81.8	Confident	79.2	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.3	165	179.7	59.6	5.4	0	0	109	V822 T839 I840 N871 R872 F873 F886	V822-Q884 HydrophobicContact CG1-CB 4.47Å; V822-Q884 HydrophobicContact CG1-CG 4.3Å; T839-Q884 WeakPolarHBondContact CA-O 3.49Å; I840-Q884 HydrophobicContact CB-CB 4.34Å; I840-Q884 HydrophobicContact CD1-CB 4.48Å; I840-Q884 PolarHBondContact N-O 3.26Å; I840-Q884 PolarHBondContact O-N 2.99Å; N871-Q884 PolarHBondContact O-NE2 3.03Å; N871-Q884 PolarHBondContact O-OE1 3.34Å; R872-Q884 PolarHBondContact O-OE1 3.47Å; R872-Q884 VanDerWaalsContact O-OE1 3.11Å; F873-Q884 HydrophobicContact CD1-CB 3.96Å; F873-Q884 HydrophobicContact CD1-CG 4.31Å; F873-Q884 HydrophobicContact CE1-CB 3.73Å; F873-Q884 HydrophobicContact CE1-CG 3.81Å; F873-Q884 HydrophobicContact CZ-CG 4.39Å; F873-Q884 VanDerWaalsContact CZ-OE1 3.29Å; Q884-F886 HydrophobicContact CG-CE1 4.27Å; Q884-F886 HydrophobicContact CG-CZ 4.44Å
885	Q	76.4	Confident	79.1	Confident	105 Å²	105	75.7 Å²	75.7	49%	0.491	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	140.2	169.1	-63.2	-177.9	-16.5	0	0	108.3	T839 R872	T839-Q885 HydrophobicContact CG2-CG 4.31Å; R872-Q885 WeakPolarHBondContact CB-O 3.16Å; R872-Q885 PolarHBondContact O-N 2.97Å
886	F	67.1	Low	78.8	Confident	88 Å²	88	77.3 Å²	77.3	39%	0.386	38%	0.377	S	S	.	.			trans	-96.3	0	175.2	-69.3	-64.7	0	0	0	112.4	P655 V656 V826 I840 Q884	P655-F886 HydrophobicContact CB-CD1 3.73Å; P655-F886 HydrophobicContact CB-CE1 3.88Å; P655-F886 HydrophobicContact CB-CG 4.5Å; P655-F886 HydrophobicContact CG-CD1 4.3Å; P655-F886 HydrophobicContact CG-CE1 3.98Å; P655-F886 HydrophobicContact CG-CZ 4.45Å; V656-F886 HydrophobicContact CG2-CD1 3.99Å; V656-F886 HydrophobicContact CG2-CE1 4.09Å; V826-F886 HydrophobicContact CG2-CZ 4.38Å; I840-F886 HydrophobicContact CD1-CD2 4.36Å; I840-F886 HydrophobicContact CD1-CE1 4.41Å; I840-F886 HydrophobicContact CD1-CE2 3.18Å; I840-F886 HydrophobicContact CD1-CZ 3.21Å; I840-F886 HydrophobicContact CG1-CE2 3.88Å; I840-F886 HydrophobicContact CG1-CZ 4.36Å; Q884-F886 HydrophobicContact CG-CE1 4.27Å; Q884-F886 HydrophobicContact CG-CZ 4.44Å

Retrieved 886 of 886 residues in 270 ms (Link to these results)

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