A0A087XXE2_POEFO Loading...

Inactive rhomboid protein

Regulates ADAM17 protease, a sheddase of the epidermal growth factor (EGF) receptor ligands and TNF, thereby plays a role in sleep, cell survival, proliferation, migration and inflammation. Does not exhibit any protease activity on its own.

AlphaFold DB , UniProt , Accession A0A087XXE2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 898 aa.

						>A0A087XXE2_POEFO|A0A087XXE2
MAEPRRESTSSLQRKKPPWLRLDIPTAQMSLDEPPTFVQPVRRQGFLRSISMPVETSHLQSPPRDIFDTRRPVLQRQSSITQTIKSSRRVHFERINTVPVKGQRAARRSVRKHHSLSRTLLRGTADWFGVSKDGDATQKWQRKSLRHCSLRYGKLKPQVIREMDLPSQDNISLTSTETPPPLYVPSSQHGMQKIVDPLARGRAFRMVEEVDGYSVPPTPITPGAASLCSFTSSRSGLNRLPRRRKRESVAKMSFRAAAALVKGRSLRDSTLKRAQRRSFTPASFMEEDVVDFPDELDTSFFARDILMHEELSTYADEVFESPSEMAIKEAEPGTKKDEMELTGSALDKTELERSHLMLPLERGWRKAKEGTPGPPKVPLRQEVVSVHGQRRGQRIVVPVKKLFAREKRPYGLGMVGKLTNRTYRKRIDSYVKRQIEDMDDHRPFFTYWITFVHLLITILAVCIYGIAPVGFSQHETVDSVLRNKGVYENVKFVQQENFWIGPGSESLIHLGAKYSPCMRQDEQVHNLIREKKAVERNSACCVRNDRSGCVQTSEEECSSTLAVWVKWPNDPAILNSTPQFKGKDRQHGSVCHQDPRICLEPASVSPHEWPDDITKWPICTRYNTGNHTNLPHIDCTITGRPCCIGTKGRCEITSREYCDFMKGYFHEEATLCSQVHCMDDVCGLLPFLNPEIPDQFYRLWLSLFLHAGILHCMVSVAFQMTILRDLEKLAGWLRISIIYILSGITGNLASAIFLPYRAEVGPAGSQFGILACLFVELFQCWQILAQPWRAFIKLLCVVLFLFAFGLLPWIDNFAHICGFISGFFLSFAFLPYVSFGRMDLYRKRCQIIVFLLVFVGLFSGLVVLFYVYPIKCDWCELITCIPFTDKFCEKYDLNAHLH
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	31.6	Very low	245 Å²	245	147.8 Å²	147.8	100%	1.207	81%	0.808	S	S	*	*				0	172.3	0	-72.6	-175.5	169.9	0	0	108.6
2	A	35.3	Very low	31.4	Very low	102 Å²	102	149.8 Å²	149.8	84%	0.843	82%	0.816	S	S	*	*			trans	71.7	94	-177.2	0	0	0	0	0	116
3	E	31.9	Very low	31.3	Very low	138 Å²	138	151.4 Å²	151.4	65%	0.645	81%	0.814	S	S	*	*			trans	-55	143.4	168.1	171.9	-169.4	172.4	0	0	115	R5	E3-R5 HydrophobicContact CG-CG 4.37Å; E3-R5 VanDerWaalsContact OE1-CG 3.31Å; E3-R5 WeakPolarHBondContact OE1-CG 3.3Å; E3-R5 IonicContact OE1-CZ 3.44Å; E3-R5 IonicContact OE1-NE 2.72Å; E3-R5 PolarHBondContact OE1-NE 3.41Å; E3-R5 IonicContact OE1-NH2 2.7Å; E3-R5 PolarHBondContact OE1-NH2 3.26Å; E3-R5 IonicContact OE2-NH2 3.27Å
4	P	40.5	Very low	31	Very low	125 Å²	125	156.6 Å²	156.6	81%	0.812	82%	0.817	S	S	*	*			trans	-98.5	133.8	155.4	34.5	-28.7	0	0	0	112.4
5	R	32.1	Very low	30.9	Very low	183 Å²	183	159 Å²	159	69%	0.691	82%	0.818	S	S	*	*			trans	-104.5	154.3	164.3	-74.7	-179.7	-177	177.2	3.3	107.8	E3	E3-R5 HydrophobicContact CG-CG 4.37Å; E3-R5 VanDerWaalsContact OE1-CG 3.31Å; E3-R5 WeakPolarHBondContact OE1-CG 3.3Å; E3-R5 IonicContact OE1-CZ 3.44Å; E3-R5 IonicContact OE1-NE 2.72Å; E3-R5 PolarHBondContact OE1-NE 3.41Å; E3-R5 IonicContact OE1-NH2 2.7Å; E3-R5 PolarHBondContact OE1-NH2 3.26Å; E3-R5 IonicContact OE2-NH2 3.27Å
6	R	30.7	Very low	31.4	Very low	202 Å²	202	161.9 Å²	161.9	76%	0.762	82%	0.823	S	S	*	*			cis	-160	170.3	9.5	-116.5	164.4	175.9	-179	-1.5	105
7	E	28.5	Very low	31.7	Very low	156 Å²	156	159.5 Å²	159.5	73%	0.729	82%	0.821	S	S	*	*			cis	-151.1	177.3	6.2	-148.3	143.5	-119.5	0	0	109.4
8	S	29.4	Very low	32.6	Very low	102 Å²	102	157.6 Å²	157.6	71%	0.713	82%	0.82	S	S	*	*			trans	-127.8	140.1	-154.2	-48.1	0	0	0	0	116.5
9	T	29	Very low	32.7	Very low	136 Å²	136	162.6 Å²	162.6	83%	0.834	83%	0.827	S	S	*	*			trans	39.5	133.2	137.2	61.3	0	0	0	0	121.6
10	S	27.8	Very low	32.4	Very low	127 Å²	127	162.3 Å²	162.3	89%	0.888	83%	0.827	S	S	*	*				-148.3	159.9	125.1	64.6	0	0	0	0	111.1
11	S	28.2	Very low	32.3	Very low	110 Å²	110	165.1 Å²	165.1	77%	0.769	83%	0.827	S	S	*	*			trans	-149	157	-173.8	66.8	0	0	0	0	111.1
12	L	28.9	Very low	32.1	Very low	171 Å²	171	160.2 Å²	160.2	90%	0.895	81%	0.805	S	S	*	*			trans	-172	163.3	142.7	-105.1	162	0	0	0	112.5
13	Q	29.8	Very low	31.8	Very low	171 Å²	171	161.8 Å²	161.8	80%	0.799	80%	0.799	S	S	*	*			trans	-102.1	160.5	-164.6	-53.5	164.5	-18	0	0	113.3
14	R	27.5	Very low	31.7	Very low	225 Å²	225	162.5 Å²	162.5	85%	0.849	81%	0.806	S	S	*	*				-169.5	114.2	128.2	-104.7	157.7	-167.9	-146.8	3.7	116.7
15	K	29.3	Very low	31.4	Very low	192 Å²	192	162.2 Å²	162.2	84%	0.835	80%	0.804	S	S	*	*				55.2	116.9	129.4	-59.9	-175.4	179.4	-169.8	0	121.6
16	K	38.1	Very low	31.1	Very low	206 Å²	206	160.1 Å²	160.1	90%	0.896	81%	0.812	S	S	*	*			trans	-88.7	150.1	148.9	-65	179.6	177	-179.7	0	110.8
17	P	37	Very low	31	Very low	121 Å²	121	155.4 Å²	155.4	79%	0.786	82%	0.816	S	S	*	*			trans	-96.7	166.4	161.1	36.3	-30.3	0	0	0	112.5
18	P	49	Very low	31	Very low	125 Å²	125	156.9 Å²	156.9	81%	0.812	82%	0.823	S	S	*	*			trans	-114.1	166.8	-158.4	41.5	-33.7	0	0	0	116.5
19	W	34.3	Very low	30.8	Very low	252 Å²	252	160.7 Å²	160.7	96%	0.955	83%	0.832	S	S	*	*			trans	-83.5	154	160	-66.3	85.7	0	0	0	110.9
20	L	26.4	Very low	30.8	Very low	156 Å²	156	158.7 Å²	158.7	82%	0.817	82%	0.824	S	S	*	*			trans	-90	117.3	179.5	-157.1	86.3	0	0	0	111	L22	L20-L22 HydrophobicContact CD2-CD1 4.12Å
21	R	30	Very low	31	Very low	222 Å²	222	159.8 Å²	159.8	84%	0.838	82%	0.819	S	S	*	*			trans	-106	151.6	157.8	-78.3	-168.1	-179.9	-177.7	0.5	109.7
22	L	29.6	Very low	31.1	Very low	142 Å²	142	161.1 Å²	161.1	74%	0.743	82%	0.817	S	S	*	*			trans	-133.9	95	-179.4	-101.1	161.6	0	0	0	108	L20	L20-L22 HydrophobicContact CD2-CD1 4.12Å
23	D	29.4	Very low	31.2	Very low	135 Å²	135	161.5 Å²	161.5	72%	0.722	81%	0.814	S	S	*	*			trans	-120	122.5	179.6	-63.6	-62.8	0	0	0	109.3
24	I	30.1	Very low	31.8	Very low	153 Å²	153	158.3 Å²	158.3	79%	0.785	81%	0.808	S	S	*	*			trans	-151.8	148.3	172.3	-0.9	176.1	0	0	0	107.8
25	P	33.7	Very low	32.8	Very low	119 Å²	119	152.7 Å²	152.7	77%	0.773	80%	0.801	S	S	*	*				-116.1	167.6	-85.8	36.5	-26.9	0	0	0	112.9
26	T	27.3	Very low	32.7	Very low	140 Å²	140	149.8 Å²	149.8	86%	0.859	80%	0.799	S	S	*	*			trans	-67.8	145.9	174.1	31.6	0	0	0	0	113
27	A	27.8	Very low	32.2	Very low	102 Å²	102	149.4 Å²	149.4	84%	0.843	80%	0.798	S	S	*	*			trans	-105.7	148.1	158.3	0	0	0	0	0	109.1
28	Q	28.9	Very low	31.9	Very low	188 Å²	188	150.2 Å²	150.2	88%	0.879	80%	0.801	S	S	*	*			trans	-110.2	141.8	-177.7	-62.3	175.7	-77	0	0	111.5
29	M	25.5	Very low	31	Very low	181 Å²	181	152.4 Å²	152.4	89%	0.892	80%	0.8	S	S	*	*			trans	156	148.7	154.9	-92.6	178.7	80.1	0	0	107.7
30	S	27.4	Very low	31.5	Very low	95 Å²	95	145 Å²	145	66%	0.664	79%	0.785	S	S	*	*			cis	-170.7	163.7	-27.4	42.1	0	0	0	0	106.5
31	L	32.3	Very low	31.7	Very low	150 Å²	150	143.9 Å²	143.9	79%	0.785	78%	0.784	S	S	*	*			trans	-74.8	168.9	-158.7	-62.9	75.5	0	0	0	117.7
32	D	30.2	Very low	31.6	Very low	137 Å²	137	144 Å²	144	73%	0.733	78%	0.784	S	S	*	*			trans	90.7	107.4	143.3	-58.2	-32.8	0	0	0	124.3
33	E	31.3	Very low	31.6	Very low	180 Å²	180	149.2 Å²	149.2	84%	0.841	79%	0.794	S	S	*	*			trans	66.2	158.7	130.4	-69.6	-119.9	89.4	0	0	124.6
34	P	42.6	Very low	31.6	Very low	103 Å²	103	150.5 Å²	150.5	67%	0.669	80%	0.796	S	S	*	*			trans	-114.6	-159.5	-162.8	47.4	-35.7	0	0	0	112.5
35	P	49.5	Very low	31.5	Very low	108 Å²	108	146.9 Å²	146.9	70%	0.701	80%	0.797	S	S	*	*			cis	-139.8	-162.2	0.7	37.7	-13.8	0	0	0	116.9
36	T	26.5	Very low	31.3	Very low	130 Å²	130	150.2 Å²	150.2	80%	0.798	80%	0.799	S	S	*	*			trans	93.7	100.6	160.2	56.2	0	0	0	0	122.8
37	F	28	Very low	31.5	Very low	198 Å²	198	151.6 Å²	151.6	87%	0.868	80%	0.8	S	S	*	*				55.1	119.1	126	-115.2	-95.7	0	0	0	123
38	V	29.2	Very low	31.7	Very low	139 Å²	139	158.7 Å²	158.7	84%	0.842	81%	0.806	S	S	*	*				-174.5	157.1	123	143.6	0	0	0	0	110.2
39	Q	30.3	Very low	31.6	Very low	170 Å²	170	154.7 Å²	154.7	79%	0.794	80%	0.798	S	S	*	*			trans	-132.9	174.1	-178.1	-100.8	-166.3	25.1	0	0	110.3
40	P	45.9	Very low	31.7	Very low	98 Å²	98	154.5 Å²	154.5	64%	0.636	80%	0.799	S	S	*	*			cis	-133.8	-174	-18.7	32.4	-11.8	0	0	0	113.2
41	V	29.3	Very low	31.8	Very low	132 Å²	132	154.7 Å²	154.7	80%	0.8	80%	0.8	S	S	*	*				166.6	130.4	125.1	157.2	0	0	0	0	114.3
42	R	28.3	Very low	31.6	Very low	224 Å²	224	155.9 Å²	155.9	85%	0.845	80%	0.804	S	S	*	*			trans	-3.2	133.4	162.7	-66.6	171.7	162.6	164.6	-6	121
43	R	29.8	Very low	31.9	Very low	251 Å²	251	154.8 Å²	154.8	95%	0.947	80%	0.804	S	S	*	*				-159.1	158.8	92.2	-111	-179.9	177.2	176.8	0.6	112.7
44	Q	29.1	Very low	31.7	Very low	162 Å²	162	152.2 Å²	152.2	76%	0.757	80%	0.801	S	S	*	*			trans	-115.5	152.7	-173.5	-65.5	163.7	-69.8	0	0	111.6
45	G	28.9	Very low	30.9	Very low	78 Å²	78	156.6 Å²	156.6	80%	0.804	81%	0.812	S	S	*	*			trans	-115.6	133.2	159.6	0	0	0	0	0	109.8
46	F	29.9	Very low	29.9	Very low	189 Å²	189	157.2 Å²	157.2	83%	0.829	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-92.1	135.8	-176.7	-100.4	-100.8	0	0	0	112.4
47	L	31.3	Very low	29.9	Very low	168 Å²	168	156.7 Å²	156.7	88%	0.88	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-93.3	155.7	159.1	-78.6	168.7	0	0	0	110.2
48	R	30.7	Very low	30	Very low	252 Å²	252	156 Å²	156	95%	0.951	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-87.9	138.2	178.9	-84	-178.1	168.7	169	-4	112
49	S	27.6	Very low	29.9	Very low	104 Å²	104	157.5 Å²	157.5	73%	0.727	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-81.6	147.1	170.9	52.3	0	0	0	0	112.8
50	I	28.6	Very low	29.7	Very low	176 Å²	176	157.8 Å²	157.8	90%	0.903	82%	0.819	S	S	*	*			trans	-126.8	135.2	147.6	-65.2	-179.2	0	0	0	106.5
51	S	28.3	Very low	28.9	Very low	99 Å²	99	157.7 Å²	157.7	69%	0.692	82%	0.82	S	S	*	*			trans	-130.8	140.7	-172	53.7	0	0	0	0	111
52	M	28.4	Very low	29.4	Very low	176 Å²	176	157 Å²	157	87%	0.867	82%	0.819	S	S	*	*			trans	-128.8	154.7	163.1	-78.4	-63.1	-74.8	0	0	109.1
53	P	35.5	Very low	30.3	Very low	113 Å²	113	152 Å²	152	73%	0.734	82%	0.815	S	S	*	*			trans	-86.9	166.4	-151.7	33.6	-36.9	0	0	0	115.2
54	V	27.1	Very low	30.2	Very low	127 Å²	127	151.4 Å²	151.4	77%	0.77	81%	0.813	S	S	*	*			trans	-105.8	138.8	171.8	172	0	0	0	0	108.8
55	E	26.3	Very low	30.2	Very low	194 Å²	194	150.3 Å²	150.3	91%	0.907	81%	0.812	S	S	*	*			trans	-113.7	149.6	158.3	-78.2	-169.4	142.8	0	0	110.2
56	T	28.4	Very low	30.3	Very low	121 Å²	121	154 Å²	154	74%	0.742	81%	0.811	S	S	*	*			trans	-105.7	129.8	-165.9	47.8	0	0	0	0	112.6
57	S	27.3	Very low	30.3	Very low	120 Å²	120	153.7 Å²	153.7	84%	0.839	81%	0.81	S	S	*	*			trans	-98.5	107.3	173.2	44.3	0	0	0	0	112.2
58	H	29.1	Very low	30.2	Very low	184 Å²	184	151.9 Å²	151.9	85%	0.852	80%	0.801	S	S	*	*			trans	-91.7	138.8	157.7	-79.4	-92.7	0	0	0	109.2
59	L	26.9	Very low	30.1	Very low	170 Å²	170	144.6 Å²	144.6	89%	0.89	79%	0.785	S	S	*	*			trans	-151	130.1	178.1	-149.1	158.3	0	0	0	109.7
60	Q	27.6	Very low	30.2	Very low	176 Å²	176	150.8 Å²	150.8	82%	0.822	79%	0.793	S	S	*	*			trans	-142.6	125.9	-176	-159.7	172.9	5.8	0	0	110.7
61	S	28	Very low	30.2	Very low	95 Å²	95	153.5 Å²	153.5	66%	0.664	79%	0.791	S	S	*	*			trans	30.8	123.3	160.4	58.9	0	0	0	0	122.1
62	P	39.8	Very low	30.9	Very low	119 Å²	119	154.1 Å²	154.1	77%	0.773	79%	0.793	S	S	*	*			trans	-84.1	-169.7	149.4	41.6	-36.4	0	0	0	110
63	P	47.1	Very low	30.9	Very low	117 Å²	117	151.6 Å²	151.6	76%	0.76	79%	0.787	S	S	*	*			cis	-131.6	174.4	-4.8	42.3	-27.7	0	0	0	115.2
64	R	28.8	Very low	30.6	Very low	240 Å²	240	152.3 Å²	152.3	91%	0.906	79%	0.785	S	S	*	*			trans	-170.1	167.3	132.6	-114.2	178.9	175.1	174.4	0.4	114.5
65	D	28.1	Very low	30.5	Very low	138 Å²	138	153.9 Å²	153.9	74%	0.738	78%	0.783	S	S	*	*			trans	-85.7	164.3	-167.5	-40.4	-96.6	0	0	0	114.9
66	I	31.4	Very low	30.6	Very low	155 Å²	155	153.5 Å²	153.5	80%	0.795	77%	0.774	S	S	*	*				162.8	125.5	125.8	-84.2	163.8	0	0	0	112.8
67	F	30.9	Very low	30.6	Very low	183 Å²	183	154.3 Å²	154.3	80%	0.803	77%	0.769	S	S	*	*			trans	30.6	121.8	150	-79.1	-89.9	0	0	0	124.7
68	D	28.3	Very low	30.6	Very low	130 Å²	130	153.3 Å²	153.3	70%	0.695	76%	0.762	S	S	*	*				85.5	130	122.5	-108.7	-11.4	0	0	0	126.5
69	T	29.3	Very low	30.5	Very low	100 Å²	100	148.8 Å²	148.8	61%	0.613	75%	0.751	S	S	*	*			trans	70	137.6	144.6	51.1	0	0	0	0	125.1
70	R	29.6	Very low	30.7	Very low	233 Å²	233	147.8 Å²	147.8	88%	0.879	75%	0.745	S	S	*	*			trans	71.9	104.9	138.3	-72.5	168.8	-169.3	-161.5	3.9	120.6
71	R	27.8	Very low	30.8	Very low	233 Å²	233	144.2 Å²	144.2	88%	0.879	74%	0.735	S	S	*	*			trans	-54.2	169.3	134	-51.3	179.7	176	177.9	-1.8	109.9
72	P	42.5	Very low	30.8	Very low	113 Å²	113	147.9 Å²	147.9	73%	0.734	74%	0.742	S	S	*	*			cis	-157	-172.8	27.4	38.1	-11.7	0	0	0	120
73	V	28.3	Very low	30.2	Very low	122 Å²	122	147.6 Å²	147.6	74%	0.739	74%	0.739	S	S	*	*			trans	71.7	154.5	153.3	-118.2	0	0	0	0	123.9
74	L	29.2	Very low	29.3	Very low	129 Å²	129	150 Å²	150	68%	0.675	74%	0.743	S	S	*	*			trans	81	121.4	157.2	-65.1	156.1	0	0	0	116.6
75	Q	26.9	Very low	29.2	Very low	159 Å²	159	147.8 Å²	147.8	74%	0.743	74%	0.74	S	S	*	*				85.6	128.5	53.8	-174.8	-175.7	96.4	0	0	110.3
76	R	28	Very low	29.1	Very low	186 Å²	186	145.8 Å²	145.8	70%	0.702	74%	0.737	S	S	*	*			cis	-179.8	154.5	-0.5	155.3	-170.5	-177	-140.2	4.3	110.7
77	Q	28.3	Very low	28.9	Very low	138 Å²	138	143.3 Å²	143.3	65%	0.645	73%	0.734	S	S	*	*			trans	67.4	129.7	163.1	-81.9	167.7	-36.1	0	0	117
78	S	26.8	Very low	28.7	Very low	100 Å²	100	145.7 Å²	145.7	70%	0.699	74%	0.737	S	S	*	*				79.9	145	85.5	99.7	0	0	0	0	113.2
79	S	26.6	Very low	28.7	Very low	89 Å²	89	150.9 Å²	150.9	62%	0.622	75%	0.747	S	S	*	*			cis	-175.4	-170	-6.5	47.7	0	0	0	0	108.7
80	I	32.2	Very low	28.5	Very low	148 Å²	148	151.8 Å²	151.8	76%	0.759	75%	0.752	S	S	*	*			trans	72.6	144.3	157.7	-66.9	165.4	0	0	0	115.8
81	T	28.3	Very low	28.2	Very low	101 Å²	101	149.2 Å²	149.2	62%	0.62	75%	0.75	S	S	*	*			cis	-161.5	-179.1	-32	45.6	0	0	0	0	108.5
82	Q	28.4	Very low	28.4	Very low	172 Å²	172	147.5 Å²	147.5	80%	0.804	75%	0.749	S	S	*	*			trans	74.3	151.1	153.1	-75.2	176.3	22.6	0	0	118.2
83	T	27.1	Very low	27.6	Very low	114 Å²	114	149.5 Å²	149.5	70%	0.699	75%	0.748	S	S	*	*			cis	-166.9	160.7	-30.3	17.4	0	0	0	0	108.3
84	I	29.3	Very low	27.5	Very low	166 Å²	166	153.5 Å²	153.5	85%	0.851	75%	0.75	S	S	*	*				169.6	165.7	128.9	-87.2	160.1	0	0	0	111.9
85	K	25.4	Very low	27.4	Very low	194 Å²	194	153.9 Å²	153.9	84%	0.843	75%	0.751	S	S	*	*			trans	-81.5	179	-170.8	-52.8	165.9	-176.7	169.5	0	111.3
86	S	26.1	Very low	27.6	Very low	97 Å²	97	153.1 Å²	153.1	68%	0.678	75%	0.753	S	S	*	*			cis	-170	148.5	24.1	-172.2	0	0	0	0	114.6
87	S	27.9	Very low	27.6	Very low	103 Å²	103	151.3 Å²	151.3	72%	0.72	76%	0.762	S	S	*	*			trans	57.3	150	145.9	62	0	0	0	0	121
88	R	27.4	Very low	27.6	Very low	233 Å²	233	151 Å²	151	88%	0.879	77%	0.77	S	S	*	*			cis	-132.8	155.6	3.3	-55.5	171	162.8	155.3	-7.4	107.4
89	R	26.5	Very low	29.1	Very low	239 Å²	239	151.7 Å²	151.7	90%	0.902	77%	0.772	S	S	*	*				51.3	140.7	56.7	-71.3	-160.3	-174.1	-170.8	4.1	115.4
90	V	25.7	Very low	29.1	Very low	119 Å²	119	153.8 Å²	153.8	72%	0.721	78%	0.78	S	S	*	*			cis	-168.4	140.9	-20.1	127.6	0	0	0	0	106.5
91	H	22.9	Very low	28.8	Very low	178 Å²	178	156.4 Å²	156.4	82%	0.824	79%	0.786	S	S	*	*			trans	-160.7	155.5	142.6	-122.8	67.2	0	0	0	113.8
92	F	32.5	Very low	28.6	Very low	198 Å²	198	155.1 Å²	155.1	87%	0.868	79%	0.793	S	S	*	*			trans	-165.5	107.7	-169.9	-154.5	-60.9	0	0	0	109.6
93	E	25.1	Very low	28.5	Very low	154 Å²	154	155.7 Å²	155.7	72%	0.72	80%	0.795	S	S	*	*			trans	-158.5	170.6	161.3	-87.5	-150.3	123.2	0	0	112.5
94	R	27.3	Very low	28.5	Very low	207 Å²	207	161.9 Å²	161.9	78%	0.781	81%	0.806	S	S	*	*				175.9	168.4	-50.2	-161.5	-177	-172.6	-171.1	4.2	108.9
95	I	27.5	Very low	28.3	Very low	136 Å²	136	159.1 Å²	159.1	70%	0.697	81%	0.808	S	S	*	*			trans	88.5	140.2	157.8	-55	-176.5	0	0	0	117.5
96	N	30.6	Very low	28.3	Very low	144 Å²	144	154.4 Å²	154.4	77%	0.77	81%	0.805	S	S	*	*			trans	-99.5	169.1	179.8	-39.6	-68.8	0	0	0	111.6
97	T	27.9	Very low	28.3	Very low	147 Å²	147	161.9 Å²	161.9	90%	0.902	82%	0.818	S	S	*	*			trans	-156.9	168.9	146.8	0.1	0	0	0	0	111.7
98	V	28.6	Very low	28.3	Very low	133 Å²	133	168.8 Å²	168.8	81%	0.806	83%	0.829	S	S	*	*			trans	-135.3	-158.6	-159.1	-138.2	0	0	0	0	112.2
99	P	56.9	Low	28.2	Very low	113 Å²	113	163.4 Å²	163.4	73%	0.734	83%	0.827	S	S	*	*			trans	-125.7	172.5	-134.9	43.8	-25.5	0	0	0	118.2
100	V	26.7	Very low	28.3	Very low	133 Å²	133	158.2 Å²	158.2	81%	0.806	82%	0.821	S	S	*	*			trans	-145.1	117	171.7	-175.8	0	0	0	0	108.1
101	K	26	Very low	28.4	Very low	204 Å²	204	163.3 Å²	163.3	89%	0.887	83%	0.828	S	S	*	*				59.2	136.7	82.7	-82.7	174.7	175.3	172.3	0	115.4
102	G	24.8	Very low	28.6	Very low	73 Å²	73	162.2 Å²	162.2	75%	0.753	82%	0.821	S	S	*	*			cis	136.6	122.1	-17	0	0	0	0	0	116.6
103	Q	26	Very low	28.5	Very low	184 Å²	184	161.7 Å²	161.7	86%	0.86	82%	0.82	S	S	*	*			trans	-149.2	132.3	163.7	-77.6	-176.6	0.4	0	0	108.2
104	R	27.1	Very low	28.7	Very low	245 Å²	245	161.3 Å²	161.3	93%	0.925	82%	0.818	S	S	*	*				66.1	134.1	68.9	-66.1	-177.1	176.5	-175.6	-0.8	112.6
105	A	24.3	Very low	28.8	Very low	108 Å²	108	156 Å²	156	89%	0.893	81%	0.813	S	S	*	*			cis	-127.6	-158	21	0	0	0	0	0	114.8
106	A	26.4	Very low	28.9	Very low	95 Å²	95	158.1 Å²	158.1	79%	0.785	83%	0.825	S	S	*	*			trans	-152.5	159.5	-161.2	0	0	0	0	0	116.3
107	R	26	Very low	29	Very low	253 Å²	253	156.2 Å²	156.2	96%	0.955	82%	0.823	S	S	*	*			trans	-165.7	141.3	140.7	-108	165.7	-169.6	-170.1	3.6	115.2
108	R	27.6	Very low	29.4	Very low	248 Å²	248	161.3 Å²	161.3	94%	0.936	83%	0.826	S	S	*	*			trans	-24.6	141	174.9	-64.1	169.1	168.1	169.9	-5.2	120.7
109	S	24.8	Very low	29.8	Very low	120 Å²	120	161.1 Å²	161.1	84%	0.839	83%	0.825	S	S	*	*				-160.2	168.8	120.3	-162.5	0	0	0	0	111.5
110	V	29.9	Very low	28.8	Very low	130 Å²	130	164.3 Å²	164.3	79%	0.788	84%	0.835	S	S	*	*			trans	-144.2	136.4	-174.4	175.1	0	0	0	0	112
111	R	27.3	Very low	29.5	Very low	227 Å²	227	165.2 Å²	165.2	86%	0.857	83%	0.834	S	S	*	*			trans	140.1	150.6	167	-83.7	162.1	179.9	-166.3	2.4	108.5
112	K	27.2	Very low	30.2	Very low	155 Å²	155	167.3 Å²	167.3	67%	0.674	84%	0.836	S	S	*	*			cis	-161.3	154.5	-6.1	-129.6	176	176.8	-168.6	0	108.6
113	H	29.9	Very low	30.8	Very low	186 Å²	186	166.2 Å²	166.2	86%	0.861	83%	0.826	S	S	*	*			trans	-94.6	149.7	160.2	-81.1	-90.3	0	0	0	111.2
114	H	28.8	Very low	31.7	Very low	146 Å²	146	161.2 Å²	161.2	68%	0.676	81%	0.808	S	S	*	*			trans	-133.8	137.1	161.6	-76.7	-100.5	0	0	0	106.9
115	S	30.6	Very low	32.3	Very low	96 Å²	96	152.4 Å²	152.4	67%	0.671	79%	0.787	S	S	*	*			cis	100.5	86.7	15.2	87.2	0	0	0	0	116.2
116	L	28.7	Very low	33.1	Very low	180 Å²	180	153.9 Å²	153.9	94%	0.942	78%	0.78	S	S	*	*			trans	-122.2	151.9	150.1	-71	169.6	0	0	0	106.8
117	S	32.3	Very low	33.8	Very low	105 Å²	105	160.1 Å²	160.1	73%	0.734	78%	0.784	S	S	*	*			cis	-134.6	160.4	4.1	56.3	0	0	0	0	111.6
118	R	38.1	Very low	34.3	Very low	254 Å²	254	156 Å²	156	96%	0.958	77%	0.773	S	S	*	*			trans	-117.2	96.7	-179.1	-90.2	178.1	153.3	-173.6	-5.5	111.1
119	T	36.1	Very low	35.1	Very low	128 Å²	128	146.9 Å²	146.9	79%	0.785	76%	0.756	S	S	*	*	S	Bend	trans	-149.1	-13.6	169.8	-4	0	0	0	0	117.3
120	L	36.1	Very low	35.8	Very low	181 Å²	181	147 Å²	147	95%	0.948	75%	0.751	S	S	*	*	S	Bend	trans	-120	45.5	-178	-72.1	173.9	0	0	0	113.7
121	L	41.2	Very low	36.4	Very low	151 Å²	151	143.1 Å²	143.1	79%	0.791	73%	0.73	S	S	*	*			trans	-144.7	55.1	178.3	-141.5	155	0	0	0	111.9
122	R	40.3	Very low	37.3	Very low	248 Å²	248	141.2 Å²	141.2	94%	0.936	73%	0.728	S	S	*	*	S	Bend	trans	-141.5	33.9	-178.2	-148.8	178.3	-171.5	175.9	2.2	114.4
123	G	39	Very low	38.4	Very low	51 Å²	51	140.1 Å²	140.1	53%	0.526	73%	0.73	S	S	.	*	S	Bend	trans	-140.1	0.2	175.5	0	0	0	0	0	115.3
124	T	43.2	Very low	39.5	Very low	78 Å²	78	133.6 Å²	133.6	48%	0.479	71%	0.712	S	S	.	*	S	Bend	trans	-94.5	-25.3	-175	43.1	0	0	0	0	114.1	W127 F128	T124-W127 PolarHBondContact O-N 3.09Å; T124-F128 WeakPolarHBondContact O-CD2 3.4Å; T124-F128 PolarHBondContact O-N 3.32Å
125	A	41.4	Very low	40.5	Very low	60 Å²	60	130.9 Å²	130.9	50%	0.496	70%	0.703	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.2	-41.9	-178.1	0	0	0	0	0	112.7	F128 G129	A125-F128 PolarHBondContact O-N 3.31Å; A125-G129 PolarHBondContact O-N 3.45Å
126	D	40.5	Very low	41.6	Very low	140 Å²	140	128.7 Å²	128.7	75%	0.749	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-32.4	179.4	-58.1	-55.7	0	0	0	112.1	G129	D126-G129 PolarHBondContact O-N 3.49Å
127	W	40.3	Very low	42.8	Very low	226 Å²	226	123.9 Å²	123.9	86%	0.856	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-40.9	174.1	-164.6	-57.1	0	0	0	111.7	T124 G129	T124-W127 PolarHBondContact O-N 3.09Å; W127-G129 VanDerWaalsContact C-N 3.29Å; W127-G129 PolarHBondContact O-N 2.93Å
128	F	37.5	Very low	43.9	Very low	167 Å²	167	123.4 Å²	123.4	73%	0.732	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	2.6	177.7	-73.6	-69.1	0	0	0	114.3	T124 A125	T124-F128 WeakPolarHBondContact O-CD2 3.4Å; T124-F128 PolarHBondContact O-N 3.32Å; A125-F128 PolarHBondContact O-N 3.31Å
129	G	43.5	Very low	44.8	Very low	56 Å²	56	117.5 Å²	117.5	58%	0.577	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	72.2	30.2	165.5	0	0	0	0	0	115.5	A125 D126 W127 S131	A125-G129 PolarHBondContact O-N 3.45Å; D126-G129 PolarHBondContact O-N 3.49Å; W127-G129 VanDerWaalsContact C-N 3.29Å; W127-G129 PolarHBondContact O-N 2.93Å; G129-S131 PolarHBondContact O-N 3.35Å
130	V	40.6	Very low	45.8	Very low	121 Å²	121	120.5 Å²	120.5	73%	0.733	63%	0.633	S	S	*	*			trans	-75.3	70.4	174.1	-170.3	0	0	0	0	110.2
131	S	41.2	Very low	46.7	Very low	50 Å²	50	117.1 Å²	117.1	35%	0.35	61%	0.613	S	S	.	*			trans	-68	139	171.9	-179.1	0	0	0	0	110.2	G129 D135	G129-S131 PolarHBondContact O-N 3.35Å; S131-D135 WeakPolarHBondContact OG-CB 3.5Å
132	K	47.2	Very low	47.7	Very low	186 Å²	186	116.2 Å²	116.2	81%	0.809	60%	0.599	S	S	*	*			trans	-51.1	140.6	176.2	-71.2	-177	176.7	-179.3	0	110.9	G134 D135	K132-G134 PolarHBondContact O-N 2.94Å; K132-D135 PolarHBondContact O-N 2.93Å
133	D	50.8	Low	48.8	Very low	133 Å²	133	111.9 Å²	111.9	71%	0.711	59%	0.586	S	S	*	*	H	α-helix	trans	-62.9	-19.1	-153.2	-53.9	-91.6	0	0	0	116.1	T137	D133-T137 VanDerWaalsContact O-CG2 3.32Å; D133-T137 WeakPolarHBondContact O-CG2 3.35Å; D133-T137 PolarHBondContact O-N 3.42Å; D133-T137 PolarHBondContact O-OG1 3.11Å
134	G	52.2	Low	50.2	Low	48 Å²	48	111.6 Å²	111.6	50%	0.495	58%	0.576	S	S	.	*	H	α-helix	trans	-67.6	-36.7	173.9	0	0	0	0	0	114.6	K132 T137 Q138	K132-G134 PolarHBondContact O-N 2.94Å; G134-T137 PolarHBondContact O-OG1 3.5Å; G134-Q138 PolarHBondContact O-N 3.17Å
135	D	49.3	Very low	50.9	Low	89 Å²	89	111.2 Å²	111.2	48%	0.476	57%	0.571	S	S	.	*	H	α-helix	trans	-78	-36.4	-176.8	-104.6	12.7	0	0	0	112.2	S131 K132 K139	S131-D135 WeakPolarHBondContact OG-CB 3.5Å; K132-D135 PolarHBondContact O-N 2.93Å; D135-K139 WeakPolarHBondContact O-CB 3.46Å; D135-K139 WeakPolarHBondContact O-CG 3.5Å; D135-K139 PolarHBondContact O-N 2.67Å; D135-K139 VanDerWaalsContact O-N 3.14Å
136	A	55.2	Low	51.8	Low	51 Å²	51	117.4 Å²	117.4	42%	0.421	58%	0.582	S	S	.	*	H	α-helix	trans	-67.1	-43.7	178.8	0	0	0	0	0	111.3	K139 W140	A136-K139 PolarHBondContact O-N 3.43Å; A136-W140 WeakPolarHBondContact O-CB 3.36Å; A136-W140 PolarHBondContact O-N 2.96Å
137	T	54	Low	53	Low	78 Å²	78	115.7 Å²	115.7	48%	0.479	57%	0.569	S	S	.	*	H	α-helix	trans	-65.1	-47.3	179.7	46.5	0	0	0	0	112	D133 G134 K139 W140 Q141	D133-T137 VanDerWaalsContact O-CG2 3.32Å; D133-T137 WeakPolarHBondContact O-CG2 3.35Å; D133-T137 PolarHBondContact O-N 3.42Å; D133-T137 PolarHBondContact O-OG1 3.11Å; G134-T137 PolarHBondContact O-OG1 3.5Å; T137-K139 PolarHBondContact O-N 3.05Å; T137-W140 PolarHBondContact O-N 3.33Å; T137-W140 VanDerWaalsContact O-N 3.12Å; T137-Q141 PolarHBondContact O-N 2.94Å
138	Q	54.1	Low	53.9	Low	96 Å²	96	107.3 Å²	107.3	45%	0.449	55%	0.545	S	S	.	.	H	α-helix	trans	-60.5	-42.8	174.1	-72.9	-164.5	11.6	0	0	112.8	G134 W140 Q141 R142	G134-Q138 PolarHBondContact O-N 3.17Å; Q138-W140 VanDerWaalsContact C-N 3.26Å; Q138-W140 PolarHBondContact O-N 3.06Å; Q138-Q141 PolarHBondContact O-N 3.32Å; Q138-R142 WeakPolarHBondContact O-CB 3.33Å; Q138-R142 WeakPolarHBondContact O-CG 3.24Å; Q138-R142 PolarHBondContact O-N 3.45Å
139	K	58.1	Low	55	Low	129 Å²	129	101.2 Å²	101.2	56%	0.561	52%	0.522	S	S	*	.	H	α-helix	trans	-62.3	-33.9	175.3	-82.5	168.7	-178.9	151.9	0	112.1	D135 A136 T137 K143	D135-K139 WeakPolarHBondContact O-CB 3.46Å; D135-K139 WeakPolarHBondContact O-CG 3.5Å; D135-K139 PolarHBondContact O-N 2.67Å; D135-K139 VanDerWaalsContact O-N 3.14Å; A136-K139 PolarHBondContact O-N 3.43Å; T137-K139 PolarHBondContact O-N 3.05Å; K139-K143 WeakPolarHBondContact O-CB 3.35Å; K139-K143 WeakPolarHBondContact O-CG 3.35Å; K139-K143 PolarHBondContact O-N 2.8Å; K139-K143 VanDerWaalsContact O-N 3.16Å
140	W	56.3	Low	55.9	Low	192 Å²	192	105.6 Å²	105.6	73%	0.727	53%	0.532	S	S	*	.	H	α-helix	trans	-74.3	-45.2	177.6	-156	94.4	0	0	0	112	A136 T137 Q138 R142 K143 S144	A136-W140 WeakPolarHBondContact O-CB 3.36Å; A136-W140 PolarHBondContact O-N 2.96Å; T137-W140 PolarHBondContact O-N 3.33Å; T137-W140 VanDerWaalsContact O-N 3.12Å; Q138-W140 VanDerWaalsContact C-N 3.26Å; Q138-W140 PolarHBondContact O-N 3.06Å; W140-R142 PolarHBondContact O-N 3.41Å; W140-K143 PolarHBondContact O-N 2.89Å; W140-S144 WeakPolarHBondContact O-CB 3.3Å; W140-S144 PolarHBondContact O-N 2.9Å
141	Q	55.8	Low	56.6	Low	110 Å²	110	108.1 Å²	108.1	51%	0.514	53%	0.528	S	S	.	.	H	α-helix	trans	-57.5	-47.7	173.1	-74.7	175.6	-36.7	0	0	111.8	T137 Q138 K143 S144 L145	T137-Q141 PolarHBondContact O-N 2.94Å; Q138-Q141 PolarHBondContact O-N 3.32Å; Q141-K143 VanDerWaalsContact C-N 3.31Å; Q141-K143 PolarHBondContact O-N 3.44Å; Q141-S144 WeakPolarHBondContact O-CB 3.24Å; Q141-S144 PolarHBondContact O-N 3.42Å; Q141-S144 VanDerWaalsContact O-N 3.15Å; Q141-L145 WeakPolarHBondContact O-CG 3.49Å; Q141-L145 PolarHBondContact O-N 2.91Å
142	R	62	Low	57.5	Low	131 Å²	131	115 Å²	115	49%	0.494	55%	0.548	S	S	.	.	H	α-helix	trans	-64	-31.4	177.4	-74.1	176.5	172.6	158.1	-2.3	113	Q138 W140 R146 D164	Q138-R142 WeakPolarHBondContact O-CB 3.33Å; Q138-R142 WeakPolarHBondContact O-CG 3.24Å; Q138-R142 PolarHBondContact O-N 3.45Å; W140-R142 PolarHBondContact O-N 3.41Å; R142-R146 WeakPolarHBondContact O-CG 3.27Å; R142-R146 PolarHBondContact O-N 2.9Å; R142-D164 IonicContact CZ-OD1 3.52Å; R142-D164 IonicContact NE-OD1 3.29Å; R142-D164 IonicContact NH2-OD1 3.75Å; R142-D164 PolarHBondContact NH2-OD1 3.47Å
143	K	63.7	Low	58.1	Low	157 Å²	157	108.1 Å²	108.1	68%	0.683	53%	0.53	S	S	*	.	H	α-helix	trans	-71.8	-42.3	170.5	-79.1	177.8	178	178.2	0	112.2	K139 W140 Q141 R146 H147	K139-K143 WeakPolarHBondContact O-CB 3.35Å; K139-K143 WeakPolarHBondContact O-CG 3.35Å; K139-K143 PolarHBondContact O-N 2.8Å; K139-K143 VanDerWaalsContact O-N 3.16Å; W140-K143 PolarHBondContact O-N 2.89Å; Q141-K143 VanDerWaalsContact C-N 3.31Å; Q141-K143 PolarHBondContact O-N 3.44Å; K143-R146 PolarHBondContact O-N 3.03Å; K143-H147 PolarHBondContact O-N 3.27Å
144	S	66.9	Low	58.6	Low	45 Å²	45	111.5 Å²	111.5	32%	0.315	54%	0.538	S	S	.	.	H	α-helix	trans	-59.7	-51.4	177	-178.6	0	0	0	0	111.6	W140 Q141 R146 H147 C148	W140-S144 WeakPolarHBondContact O-CB 3.3Å; W140-S144 PolarHBondContact O-N 2.9Å; Q141-S144 WeakPolarHBondContact O-CB 3.24Å; Q141-S144 PolarHBondContact O-N 3.42Å; Q141-S144 VanDerWaalsContact O-N 3.15Å; S144-R146 VanDerWaalsContact C-N 3.34Å; S144-R146 PolarHBondContact O-N 3.5Å; S144-H147 CarbonylContact O-C 3.52Å; S144-H147 WeakPolarHBondContact O-CA 3.34Å; S144-H147 WeakPolarHBondContact O-CB 3.3Å; S144-H147 PolarHBondContact O-N 2.93Å; S144-C148 PolarHBondContact O-N 3.34Å
145	L	59.1	Low	58.8	Low	70 Å²	70	113.1 Å²	113.1	37%	0.366	54%	0.535	S	S	.	.	H	α-helix	trans	-62.2	-37.5	178.7	-70.3	168.5	0	0	0	112.7	Q141 S149 L155 M163	Q141-L145 WeakPolarHBondContact O-CG 3.49Å; Q141-L145 PolarHBondContact O-N 2.91Å; L145-S149 WeakPolarHBondContact O-CB 3.48Å; L145-S149 PolarHBondContact O-N 3.3Å; L145-S149 PolarHBondContact O-OG 2.94Å; L145-L155 HydrophobicContact CD2-CD1 4.4Å; L145-M163 HydrophobicContact CD1-CE 4.41Å; L145-M163 HydrophobicContact CD1-SD 4.44Å
146	R	60.1	Low	59.7	Low	190 Å²	190	116.1 Å²	116.1	72%	0.717	54%	0.544	S	S	*	.	H	α-helix	trans	-62.8	-40.5	169.9	-77.6	-179.3	177.4	-165.2	0.7	112.4	R142 K143 S144 S149 L150	R142-R146 WeakPolarHBondContact O-CG 3.27Å; R142-R146 PolarHBondContact O-N 2.9Å; K143-R146 PolarHBondContact O-N 3.03Å; S144-R146 VanDerWaalsContact C-N 3.34Å; S144-R146 PolarHBondContact O-N 3.5Å; R146-S149 WeakPolarHBondContact CA-OG 3.5Å; R146-S149 PolarHBondContact O-OG 2.92Å; R146-S149 VanDerWaalsContact O-OG 3.13Å; R146-L150 WeakPolarHBondContact O-CB 3.35Å; R146-L150 WeakPolarHBondContact O-CD1 3.47Å; R146-L150 VanDerWaalsContact O-CG 3.24Å; R146-L150 WeakPolarHBondContact O-CG 3.24Å; R146-L150 PolarHBondContact O-N 3.35Å; R146-L150 VanDerWaalsContact O-N 3.16Å
147	H	64.9	Low	59.7	Low	104 Å²	104	118.4 Å²	118.4	48%	0.481	55%	0.554	S	S	.	*	H	α-helix	trans	-70.6	-38.9	178	-171.7	-110.8	0	0	0	112.7	K143 S144 L150 R151	K143-H147 PolarHBondContact O-N 3.27Å; S144-H147 CarbonylContact O-C 3.52Å; S144-H147 WeakPolarHBondContact O-CA 3.34Å; S144-H147 WeakPolarHBondContact O-CB 3.3Å; S144-H147 PolarHBondContact O-N 2.93Å; H147-L150 PolarHBondContact O-N 3.45Å; H147-R151 PolarHBondContact CE1-NE 3.05Å; H147-R151 PolarHBondContact O-N 3.33Å
148	C	58.4	Low	59.7	Low	51 Å²	51	121.2 Å²	121.2	35%	0.345	56%	0.562	S	S	.	*	H	α-helix	trans	-65.5	-46.5	174.3	-74.6	0	0	0	0	112	S144 L150 R151 Y152	S144-C148 PolarHBondContact O-N 3.34Å; C148-L150 PolarHBondContact O-N 2.97Å; C148-R151 PolarHBondContact O-N 3.47Å; C148-Y152 HydrophobicContact CB-CD2 4.45Å; C148-Y152 PolarHBondContact O-N 2.63Å
149	S	62.5	Low	59.7	Low	38 Å²	38	119.9 Å²	119.9	27%	0.266	56%	0.561	S	S	.	*	H	α-helix	trans	-64.6	-24.1	177	52.3	0	0	0	0	114.1	L145 R146 G153	L145-S149 WeakPolarHBondContact O-CB 3.48Å; L145-S149 PolarHBondContact O-N 3.3Å; L145-S149 PolarHBondContact O-OG 2.94Å; R146-S149 WeakPolarHBondContact CA-OG 3.5Å; R146-S149 PolarHBondContact O-OG 2.92Å; R146-S149 VanDerWaalsContact O-OG 3.13Å; S149-G153 VanDerWaalsContact CA-O 3.32Å; S149-G153 WeakPolarHBondContact CA-O 3.44Å; S149-G153 CarbonylContact O-C 3.57Å; S149-G153 VanDerWaalsContact O-C 3.29Å; S149-G153 PolarHBondContact O-N 2.94Å
150	L	60.6	Low	59.9	Low	149 Å²	149	117.9 Å²	117.9	78%	0.78	56%	0.555	S	S	*	*	H	α-helix	trans	-79.6	-22.9	171.9	-76.1	168.6	0	0	0	114	R146 H147 C148	R146-L150 WeakPolarHBondContact O-CB 3.35Å; R146-L150 WeakPolarHBondContact O-CD1 3.47Å; R146-L150 VanDerWaalsContact O-CG 3.24Å; R146-L150 WeakPolarHBondContact O-CG 3.24Å; R146-L150 PolarHBondContact O-N 3.35Å; R146-L150 VanDerWaalsContact O-N 3.16Å; H147-L150 PolarHBondContact O-N 3.45Å; C148-L150 PolarHBondContact O-N 2.97Å
151	R	55.6	Low	59.5	Low	174 Å²	174	118 Å²	118	66%	0.657	56%	0.556	S	S	*	*	H	α-helix	trans	-97.3	-37	178.7	-80.7	-169.4	174.1	-155.1	-1.3	114.4	H147 C148	H147-R151 PolarHBondContact CE1-NE 3.05Å; H147-R151 PolarHBondContact O-N 3.33Å; C148-R151 PolarHBondContact O-N 3.47Å
152	Y	59.9	Low	59.3	Low	193 Å²	193	119.3 Å²	119.3	76%	0.757	56%	0.562	S	S	*	*	H	α-helix	trans	-113.7	1.4	-170.4	-59.2	-72.3	0	0	0	113.9	C148	C148-Y152 HydrophobicContact CB-CD2 4.45Å; C148-Y152 PolarHBondContact O-N 2.63Å
153	G	61.6	Low	58.9	Low	42 Å²	42	118.7 Å²	118.7	43%	0.433	57%	0.566	S	S	.	*			trans	99.9	166.1	-179.4	0	0	0	0	0	113.4	S149 L155	S149-G153 VanDerWaalsContact CA-O 3.32Å; S149-G153 WeakPolarHBondContact CA-O 3.44Å; S149-G153 CarbonylContact O-C 3.57Å; S149-G153 VanDerWaalsContact O-C 3.29Å; S149-G153 PolarHBondContact O-N 2.94Å; G153-L155 PolarHBondContact O-N 3.3Å
154	K	59.5	Low	58.1	Low	204 Å²	204	115.4 Å²	115.4	89%	0.887	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-69.4	118.6	-176.5	-69.7	-174.1	176.8	-175.8	0	111
155	L	57.6	Low	56.8	Low	83 Å²	83	119.9 Å²	119.9	44%	0.435	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-58.4	147.6	166.5	-74.5	159	0	0	0	110.7	L145 G153 I160	L145-L155 HydrophobicContact CD2-CD1 4.4Å; G153-L155 PolarHBondContact O-N 3.3Å; L155-I160 HydrophobicContact CB-CD1 4.38Å; L155-I160 HydrophobicContact CB-CG1 4.45Å
156	K	67.6	Low	55.8	Low	151 Å²	151	122 Å²	122	66%	0.657	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-64	142.3	177.7	-73.3	-174.7	177.8	179.7	0	110.3	Q158 V159	K156-Q158 PolarHBondContact O-N 2.94Å; K156-Q158 VanDerWaalsContact O-N 3.12Å; K156-V159 PolarHBondContact O-N 3.43Å
157	P	56.1	Low	54.7	Low	99 Å²	99	118.5 Å²	118.5	64%	0.643	60%	0.598	S	S	*	*	H	α-helix	trans	-60.2	-24.2	-177.3	-26.2	35.3	0	0	0	115.6	R161	P157-R161 PolarHBondContact O-N 3.17Å
158	Q	52.8	Low	53.3	Low	137 Å²	137	122.3 Å²	122.3	64%	0.64	62%	0.616	S	S	*	*	H	α-helix	trans	-65.4	-51.4	179.6	-71.3	155.3	-53.2	0	0	111.6	K156 I160 R161 E162	K156-Q158 PolarHBondContact O-N 2.94Å; K156-Q158 VanDerWaalsContact O-N 3.12Å; Q158-I160 PolarHBondContact O-N 3.09Å; Q158-R161 WeakPolarHBondContact O-CA 3.42Å; Q158-R161 WeakPolarHBondContact O-CB 3.32Å; Q158-R161 PolarHBondContact O-N 3.44Å; Q158-E162 PolarHBondContact O-N 3.37Å
159	V	55.2	Low	52	Low	69 Å²	69	127 Å²	127	42%	0.418	64%	0.638	S	S	.	*	H	α-helix	trans	-59.4	-32.9	178.8	-175.9	0	0	0	0	112.2	K156 M163	K156-V159 PolarHBondContact O-N 3.43Å; V159-M163 WeakPolarHBondContact O-CG 3.4Å; V159-M163 PolarHBondContact O-N 3.05Å
160	I	61.3	Low	50.4	Low	87 Å²	87	133 Å²	133	45%	0.446	67%	0.666	S	S	.	*	H	α-helix	trans	-69.2	-38.5	175.4	-60.1	173.2	0	0	0	110.6	L155 Q158 M163 D164	L155-I160 HydrophobicContact CB-CD1 4.38Å; L155-I160 HydrophobicContact CB-CG1 4.45Å; Q158-I160 PolarHBondContact O-N 3.09Å; I160-M163 PolarHBondContact O-N 3.2Å; I160-D164 PolarHBondContact O-N 2.97Å
161	R	48.8	Very low	48.9	Very low	195 Å²	195	133.4 Å²	133.4	74%	0.736	67%	0.668	S	S	*	*	H	α-helix	trans	-74.2	-30.6	-178.5	-166.7	-180	-67.9	-177.2	-3.7	112.8	P157 Q158 M163	P157-R161 PolarHBondContact O-N 3.17Å; Q158-R161 WeakPolarHBondContact O-CA 3.42Å; Q158-R161 WeakPolarHBondContact O-CB 3.32Å; Q158-R161 PolarHBondContact O-N 3.44Å; R161-M163 VanDerWaalsContact C-N 3.31Å
162	E	49.9	Very low	47.8	Very low	137 Å²	137	130.2 Å²	130.2	64%	0.64	67%	0.672	S	S	*	*	H	α-helix	trans	-69.6	-27.4	173.6	-70.3	163.3	162.3	0	0	112.5	Q158	Q158-E162 PolarHBondContact O-N 3.37Å
163	M	53.9	Low	46.5	Very low	117 Å²	117	128 Å²	128	58%	0.576	67%	0.673	S	S	*	*	H	α-helix	trans	-88.4	-14.4	179.4	-70	-169.4	75	0	0	115.5	L145 V159 I160 R161	L145-M163 HydrophobicContact CD1-CE 4.41Å; L145-M163 HydrophobicContact CD1-SD 4.44Å; V159-M163 WeakPolarHBondContact O-CG 3.4Å; V159-M163 PolarHBondContact O-N 3.05Å; I160-M163 PolarHBondContact O-N 3.2Å; R161-M163 VanDerWaalsContact C-N 3.31Å
164	D	48.1	Very low	45	Very low	89 Å²	89	132 Å²	132	48%	0.476	69%	0.689	S	S	.	*	S	Bend	trans	-95.4	7	179.7	-90.6	-44.2	0	0	0	112.9	R142 I160	R142-D164 IonicContact CZ-OD1 3.52Å; R142-D164 IonicContact NE-OD1 3.29Å; R142-D164 IonicContact NH2-OD1 3.75Å; R142-D164 PolarHBondContact NH2-OD1 3.47Å; I160-D164 PolarHBondContact O-N 2.97Å
165	L	38.8	Very low	43.7	Very low	139 Å²	139	127 Å²	127	73%	0.728	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-91.2	117.6	172.3	-77.2	170.9	0	0	0	111.1
166	P	39.2	Very low	42.6	Very low	114 Å²	114	128.3 Å²	128.3	74%	0.74	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-75.2	137.6	170.3	31	-32.5	0	0	0	110.6	Q168	P166-Q168 PolarHBondContact O-N 2.97Å
167	S	36.9	Very low	40.8	Very low	116 Å²	116	128.1 Å²	128.1	81%	0.811	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-63.5	122.2	170.7	50.8	0	0	0	0	110.5
168	Q	35.3	Very low	39.7	Very low	184 Å²	184	129 Å²	129	86%	0.86	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-66.4	129.2	160.2	-68.6	177.4	-36.9	0	0	108.3	P166	P166-Q168 PolarHBondContact O-N 2.97Å
169	D	31.6	Very low	40.2	Very low	151 Å²	151	128 Å²	128	81%	0.807	70%	0.702	S	S	*	*			trans	-165.8	100.7	150.9	-101	-30.6	0	0	0	110
170	N	28.3	Very low	40.2	Very low	162 Å²	162	130.1 Å²	130.1	87%	0.866	72%	0.717	S	S	*	*			trans	154.2	135.4	137.4	-83.2	-69.4	0	0	0	111.1
171	I	29.5	Very low	40.3	Very low	158 Å²	158	131.1 Å²	131.1	81%	0.81	73%	0.729	S	S	*	*			trans	-129.9	146.5	-170	-67.5	168.9	0	0	0	108.7
172	S	31.5	Very low	39.5	Very low	108 Å²	108	129.1 Å²	129.1	76%	0.755	73%	0.732	S	S	*	*			trans	138.9	147.3	152.9	60.5	0	0	0	0	113.1
173	L	33.1	Very low	38.5	Very low	145 Å²	145	131.7 Å²	131.7	76%	0.759	74%	0.738	S	S	*	*			cis	-162.3	179.7	-27.3	-119	168.9	0	0	0	109.1
174	T	28.7	Very low	37.4	Very low	127 Å²	127	131.6 Å²	131.6	78%	0.779	74%	0.743	S	S	*	*			trans	71.8	125.1	177.3	67.8	0	0	0	0	115.6
175	S	33.1	Very low	37.1	Very low	99 Å²	99	132.7 Å²	132.7	69%	0.692	76%	0.755	S	S	*	*			cis	89	123.4	21.1	-52.6	0	0	0	0	114.1
176	T	35.2	Very low	36.7	Very low	111 Å²	111	130.4 Å²	130.4	68%	0.681	75%	0.751	S	S	*	*			cis	-143.9	-130.1	-7.9	-17.9	0	0	0	0	111.2
177	E	29	Very low	36.3	Very low	147 Å²	147	129.4 Å²	129.4	69%	0.687	75%	0.746	S	S	*	*			cis	-154	150.1	1.8	-159.4	50.3	-85.1	0	0	113.9
178	T	34.3	Very low	36.2	Very low	116 Å²	116	131.4 Å²	131.4	71%	0.712	74%	0.743	S	S	*	*			trans	-161	168.1	-177.5	55.4	0	0	0	0	111.8
179	P	62.3	Low	36.1	Very low	118 Å²	118	131.4 Å²	131.4	77%	0.766	74%	0.743	S	S	*	*			cis	-109.4	-121.5	-6.3	44.6	-30.8	0	0	0	107.7
180	P	55.8	Low	36	Very low	113 Å²	113	128 Å²	128	73%	0.734	74%	0.743	S	S	*	*			cis	-90.1	-157	-20.6	42.4	-35.2	0	0	0	110
181	P	62.6	Low	36.1	Very low	107 Å²	107	129.4 Å²	129.4	70%	0.695	75%	0.747	S	S	*	*			cis	-111.1	-172.8	-27.8	18.2	5.8	0	0	0	110.1
182	L	33.1	Very low	36.8	Very low	154 Å²	154	131.1 Å²	131.1	81%	0.806	75%	0.752	S	S	*	*			cis	-155.6	-166.8	-25.4	-103.7	165.3	0	0	0	104.4
183	Y	29	Very low	36.7	Very low	191 Å²	191	136 Å²	136	75%	0.749	76%	0.759	S	S	*	*			cis	-149.3	161.5	8.5	-163.1	-88.6	0	0	0	108.8
184	V	30.9	Very low	37	Very low	115 Å²	115	136.8 Å²	136.8	70%	0.697	76%	0.762	S	S	*	*			trans	-150.5	156.6	-179.4	-139.2	0	0	0	0	111
185	P	40.8	Very low	37.2	Very low	111 Å²	111	137 Å²	137	72%	0.721	76%	0.763	S	S	*	*				-150	173.4	95.1	35.5	-16.4	0	0	0	114.6
186	S	30.6	Very low	37.1	Very low	92 Å²	92	139.4 Å²	139.4	64%	0.643	77%	0.769	S	S	*	*			cis	-173.8	139.2	-27.9	55.6	0	0	0	0	113
187	S	31.3	Very low	37.9	Very low	92 Å²	92	139 Å²	139	64%	0.643	77%	0.768	S	S	*	*			trans	66.2	167.3	139.4	78.4	0	0	0	0	120.3
188	Q	33.8	Very low	38.5	Very low	159 Å²	159	140.5 Å²	140.5	74%	0.743	78%	0.779	S	S	*	*			cis	-152	123.2	1.3	-137.1	154.3	30	0	0	109.7
189	H	33.8	Very low	38.4	Very low	183 Å²	183	139.6 Å²	139.6	85%	0.847	78%	0.784	S	S	*	*				75	140.1	109.1	-66.7	24.8	0	0	0	119.2
190	G	29.6	Very low	37.1	Very low	80 Å²	80	146 Å²	146	83%	0.825	79%	0.793	S	S	*	*			trans	174.9	114.5	171.1	0	0	0	0	0	113.3
191	M	30.9	Very low	36	Very low	192 Å²	192	144.4 Å²	144.4	95%	0.946	80%	0.797	S	S	*	*			trans	-75.6	162.7	-165.7	-74.5	170	-100.5	0	0	116.7
192	Q	42.8	Very low	34.5	Very low	194 Å²	194	151.1 Å²	151.1	91%	0.907	81%	0.808	S	S	*	*			trans	-69.1	151.6	166.2	-66.2	179	-15.7	0	0	112.3
193	K	31.2	Very low	34.5	Very low	211 Å²	211	147.1 Å²	147.1	92%	0.917	80%	0.798	S	S	*	*			trans	-149.2	143.6	162.3	-148.8	168.9	-172.9	177.4	0	111.5
194	I	38.3	Very low	34.5	Very low	160 Å²	160	146.6 Å²	146.6	82%	0.821	80%	0.799	S	S	*	*			trans	-98.1	141.4	174.8	-63.3	166.4	0	0	0	108.3
195	V	32.2	Very low	34.5	Very low	131 Å²	131	150.2 Å²	150.2	79%	0.794	80%	0.8	S	S	*	*			trans	172.4	139.7	141.7	147.3	0	0	0	0	111.5
196	D	32.4	Very low	34	Very low	151 Å²	151	151.8 Å²	151.8	81%	0.807	80%	0.8	S	S	*	*			trans	31.6	150.8	165.1	-89.5	-9.5	0	0	0	126.2
197	P	50.5	Low	34	Very low	103 Å²	103	151.8 Å²	151.8	67%	0.669	80%	0.796	S	S	*	*			trans	-91.7	168.5	165.7	38.8	-33.6	0	0	0	113.5
198	L	41.6	Very low	34.1	Very low	177 Å²	177	154.9 Å²	154.9	93%	0.927	80%	0.8	S	S	*	*			trans	91.1	60.4	170.5	-54.4	172.4	0	0	0	119.2
199	A	33.4	Very low	34.1	Very low	98 Å²	98	155.6 Å²	155.6	81%	0.81	80%	0.804	S	S	*	*			trans	-138.7	131.6	144.3	0	0	0	0	0	109
200	R	34.7	Very low	34.3	Very low	252 Å²	252	152.2 Å²	152.2	95%	0.951	80%	0.796	S	S	*	*			cis	88.5	92.6	30.2	-166.9	-173.3	-166.7	170	4.4	113.1
201	G	31.9	Very low	34.4	Very low	79 Å²	79	156.1 Å²	156.1	81%	0.814	80%	0.798	S	S	*	*			trans	176.5	112.8	170.9	0	0	0	0	0	116.5
202	R	32.6	Very low	34.5	Very low	249 Å²	249	150.4 Å²	150.4	94%	0.94	79%	0.788	S	S	*	*			trans	-83.8	166.2	153.1	-79.3	178	-179.9	-179	-0.7	108
203	A	31.9	Very low	34.1	Very low	70 Å²	70	152.4 Å²	152.4	58%	0.579	79%	0.789	S	S	*	*			cis	-175	-161.2	-14.8	0	0	0	0	0	107.2
204	F	29.2	Very low	34.1	Very low	179 Å²	179	147.7 Å²	147.7	79%	0.785	78%	0.782	S	S	*	*			trans	73.9	149.2	162.9	-64.6	-58.7	0	0	0	116.9
205	R	31.8	Very low	34.1	Very low	191 Å²	191	146.4 Å²	146.4	72%	0.721	78%	0.782	S	S	*	*			cis	-170.6	175	-21.2	-142.2	-179.9	-175.4	161.1	-2.7	109.2
206	M	28.9	Very low	35.2	Very low	145 Å²	145	145.5 Å²	145.5	71%	0.714	78%	0.779	S	S	*	*			trans	70.6	152.6	152.3	-88.5	22.2	-161.4	0	0	118.2
207	V	32	Very low	36	Very low	91 Å²	91	143.9 Å²	143.9	55%	0.552	78%	0.776	S	S	*	*			cis	-167.7	166	-18	73.5	0	0	0	0	112.1
208	E	33.3	Very low	35.2	Very low	158 Å²	158	145.1 Å²	145.1	74%	0.738	78%	0.782	S	S	*	*			trans	58.6	161.9	159.9	-79	137.2	-161.8	0	0	119.2
209	E	32.2	Very low	35.6	Very low	174 Å²	174	142 Å²	142	81%	0.813	77%	0.772	S	S	*	*			cis	-152.1	174.4	0.5	-119.1	165.3	163.6	0	0	105.8
210	V	38.7	Very low	35.6	Very low	112 Å²	112	144.9 Å²	144.9	68%	0.679	77%	0.773	S	S	*	*			cis	178.7	179.3	-26.9	139.9	0	0	0	0	106.5
211	D	33	Very low	35.4	Very low	162 Å²	162	139 Å²	139	87%	0.866	77%	0.765	S	S	*	*			trans	69.7	149.3	175.3	-68.2	-28	0	0	0	119.2
212	G	32.1	Very low	36.1	Very low	72 Å²	72	141.4 Å²	141.4	74%	0.742	77%	0.766	S	S	*	*			cis	-162.6	165.7	-1.3	0	0	0	0	0	112.3
213	Y	33.8	Very low	35.8	Very low	235 Å²	235	133.4 Å²	133.4	92%	0.922	76%	0.761	S	S	*	*			trans	-101.6	156.4	-156.2	-122	-92	0	0	0	118.3
214	S	31.3	Very low	35.8	Very low	112 Å²	112	135.2 Å²	135.2	78%	0.783	78%	0.776	S	S	*	*			trans	-156.2	160	167.4	58	0	0	0	0	113.9
215	V	39.2	Very low	35.8	Very low	133 Å²	133	131.7 Å²	131.7	81%	0.806	78%	0.78	S	S	*	*			trans	-171.7	167.6	-177.7	76.5	0	0	0	0	107.1
216	P	54.5	Low	35.6	Very low	113 Å²	113	127.7 Å²	127.7	73%	0.734	78%	0.781	S	S	*	*			cis	-111.6	-142.7	-2.9	39.9	-19.9	0	0	0	110.4
217	P	49.7	Very low	35.6	Very low	117 Å²	117	127.7 Å²	127.7	76%	0.76	78%	0.783	S	S	*	*			cis	-132	-145.4	-6.7	43.7	-22.7	0	0	0	115.1
218	T	33.2	Very low	35.5	Very low	129 Å²	129	128.5 Å²	128.5	79%	0.791	79%	0.792	S	S	*	*			trans	-150.1	-176.9	-175.2	69.7	0	0	0	0	109.8
219	P	51.3	Low	35.3	Very low	110 Å²	110	125.9 Å²	125.9	71%	0.714	79%	0.791	S	S	*	*			cis	-137.1	-163.2	-2.3	33.1	-8.9	0	0	0	115.1
220	I	33.4	Very low	35.3	Very low	160 Å²	160	127.9 Å²	127.9	82%	0.821	80%	0.797	S	S	*	*			trans	115.8	133.3	157	-59.8	168.3	0	0	0	116.7
221	T	29.8	Very low	34.8	Very low	128 Å²	128	128.5 Å²	128.5	79%	0.785	80%	0.802	S	S	*	*			trans	-110	179.2	-177.8	32.7	0	0	0	0	111.7
222	P	46.4	Very low	34.8	Very low	130 Å²	130	126.1 Å²	126.1	84%	0.844	80%	0.797	S	S	*	*			cis	-124.4	174	-16.3	34	-16.6	0	0	0	113.7
223	G	27.4	Very low	34.8	Very low	80 Å²	80	127.2 Å²	127.2	83%	0.825	79%	0.794	S	S	*	*			trans	-155.8	148	175.6	0	0	0	0	0	115
224	A	30	Very low	34.8	Very low	108 Å²	108	127.5 Å²	127.5	89%	0.893	79%	0.793	S	S	*	*			trans	-64.3	159.3	-168.4	0	0	0	0	0	116.8
225	A	30.8	Very low	34.7	Very low	106 Å²	106	128.4 Å²	128.4	88%	0.876	80%	0.799	S	S	*	*			trans	-68.8	152	-177.5	0	0	0	0	0	115
226	S	27.1	Very low	34.3	Very low	106 Å²	106	125.3 Å²	125.3	74%	0.741	79%	0.794	S	S	*	*			trans	-152.8	138	162.1	-160.3	0	0	0	0	114.1
227	L	29.4	Very low	33.4	Very low	145 Å²	145	128.4 Å²	128.4	76%	0.759	80%	0.804	S	S	*	*			trans	38.9	113	151	-61.4	171.4	0	0	0	122.5
228	C	28.9	Very low	32.6	Very low	108 Å²	108	130.7 Å²	130.7	73%	0.73	81%	0.809	S	S	*	*				76.9	155.1	121.6	-66.8	0	0	0	0	123.3
229	S	29.9	Very low	32.6	Very low	103 Å²	103	135.9 Å²	135.9	72%	0.72	82%	0.815	S	S	*	*			trans	67.4	97.6	150.6	-62.4	0	0	0	0	120.2
230	F	30.7	Very low	31.8	Very low	216 Å²	216	139.2 Å²	139.2	95%	0.947	83%	0.825	S	S	*	*			trans	-133.8	136.8	137.7	-89.8	-73.8	0	0	0	111.7
231	T	29.4	Very low	31.9	Very low	126 Å²	126	137 Å²	137	77%	0.773	82%	0.821	S	S	*	*			trans	-118.9	142	177.1	55	0	0	0	0	110.6
232	S	33.1	Very low	32	Very low	111 Å²	111	142.8 Å²	142.8	78%	0.776	83%	0.829	S	S	*	*			trans	69.9	163.4	176.2	97.5	0	0	0	0	114.6
233	S	32.4	Very low	31.4	Very low	95 Å²	95	148.6 Å²	148.6	66%	0.664	83%	0.834	S	S	*	*			cis	-144	152.9	13.2	-106.8	0	0	0	0	114.5
234	R	32.3	Very low	31.9	Very low	242 Å²	242	156.2 Å²	156.2	91%	0.913	84%	0.838	S	S	*	*			trans	40.5	121.2	149.8	-65.2	178.9	168.4	-170.2	-2.4	120.6
235	S	29.9	Very low	32.5	Very low	130 Å²	130	160.7 Å²	160.7	91%	0.909	84%	0.837	S	S	*	*				-154	162.7	104.9	-166.9	0	0	0	0	110
236	G	30.5	Very low	33.3	Very low	68 Å²	68	167.1 Å²	167.1	70%	0.701	84%	0.839	S	S	*	*			trans	-142.4	138.7	-174.4	0	0	0	0	0	113.6
237	L	35	Very low	34.7	Very low	178 Å²	178	166.8 Å²	166.8	93%	0.932	83%	0.825	S	S	*	*			trans	-137.6	127.8	166.8	-145.2	79	0	0	0	109.9	R239	L237-R239 PolarHBondContact O-N 3.35Å
238	N	33.4	Very low	36.7	Very low	165 Å²	165	163.3 Å²	163.3	88%	0.882	81%	0.814	S	S	*	*			trans	-87.4	106.5	-170.8	-77.4	-43.7	0	0	0	112.6
239	R	33.8	Very low	38.3	Very low	239 Å²	239	163.9 Å²	163.9	90%	0.902	81%	0.813	S	S	*	*			trans	-155.3	112.6	155.6	-105.8	170.3	-169.1	-167.7	2.8	110.4	L237 P241	L237-R239 PolarHBondContact O-N 3.35Å; R239-P241 WeakPolarHBondContact O-CD 3.33Å
240	L	33.7	Very low	39.8	Very low	179 Å²	179	161.9 Å²	161.9	94%	0.937	80%	0.803	S	S	*	*			trans	-105.6	107	-178.5	-78.7	173.1	0	0	0	112.7
241	P	35.9	Very low	41.4	Very low	114 Å²	114	156.2 Å²	156.2	74%	0.74	78%	0.778	S	S	*	*			trans	-83.2	161.4	157.2	32.9	-31.8	0	0	0	111.8	R239	R239-P241 WeakPolarHBondContact O-CD 3.33Å
242	R	33	Very low	43.4	Very low	250 Å²	250	155.9 Å²	155.9	94%	0.943	77%	0.769	S	S	*	*			trans	-56.6	133.3	-167.7	-71.4	171.4	167.5	152.5	-5.2	114.6	R244	R242-R244 PolarHBondContact O-N 3.1Å
243	R	32.6	Very low	44.8	Very low	251 Å²	251	153.7 Å²	153.7	95%	0.947	75%	0.754	S	S	*	*			trans	-67.1	92.6	-176.8	-166.3	-175.8	-163.7	-162	6.9	113.2
244	R	38.7	Very low	46.6	Very low	240 Å²	240	156.9 Å²	156.9	91%	0.906	76%	0.756	S	S	*	*			trans	-68.1	132.8	166.7	-143.7	176.9	-168.2	-177.7	3.6	109.3	R242 R246	R242-R244 PolarHBondContact O-N 3.1Å; R244-R246 PolarHBondContact O-N 3.48Å
245	K	42.8	Very low	48.4	Very low	202 Å²	202	152.4 Å²	152.4	88%	0.878	74%	0.739	S	S	*	*			trans	-71.7	111.9	-175.6	-166.5	176.2	-175.9	179.2	0	110
246	R	46.8	Very low	50.3	Low	242 Å²	242	148.7 Å²	148.7	91%	0.913	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-67.8	137.9	173	-72.1	-171.8	175.3	-166.1	-1.5	109.9	R244	R244-R246 PolarHBondContact O-N 3.48Å
247	E	56.8	Low	51.9	Low	98 Å²	98	147.8 Å²	147.8	46%	0.458	70%	0.702	S	S	.	*	P	Polyproline II helix	trans	-77.4	158.2	164.3	-56.2	-148.6	99.5	0	0	109.6	K251 R255	E247-K251 WeakPolarHBondContact OE1-CD 3.46Å; E247-K251 WeakPolarHBondContact OE1-CE 3.47Å; E247-K251 IonicContact OE1-NZ 3.47Å; E247-K251 PolarHBondContact OE1-NZ 2.91Å; E247-R255 IonicContact OE2-CZ 3.68Å; E247-R255 IonicContact OE2-NH1 2.74Å; E247-R255 PolarHBondContact OE2-NH1 2.87Å
248	S	70.6	Confident	53.2	Low	73 Å²	73	142.3 Å²	142.3	51%	0.51	68%	0.683	S	S	.	*	P	Polyproline II helix	trans	-73.7	147.9	178.4	56.4	0	0	0	0	111.7	A250 K251 M252	S248-A250 VanDerWaalsContact C-N 3.26Å; S248-A250 PolarHBondContact O-N 3.14Å; S248-K251 WeakPolarHBondContact O-CB 3.38Å; S248-K251 PolarHBondContact O-N 3.18Å; S248-M252 PolarHBondContact O-N 3.13Å
249	V	64	Low	54.5	Low	120 Å²	120	137.5 Å²	137.5	73%	0.727	67%	0.665	S	S	*	*	H	α-helix	trans	-57.1	-41.5	178.8	-178.7	0	0	0	0	110.9	K251 M252 S253	V249-K251 PolarHBondContact O-N 2.94Å; V249-M252 CarbonylContact O-C 3.43Å; V249-M252 WeakPolarHBondContact O-CA 3.33Å; V249-M252 PolarHBondContact O-N 3.31Å; V249-S253 PolarHBondContact O-N 3.42Å; V249-S253 PolarHBondContact O-OG 3.41Å
250	A	59.9	Low	55.6	Low	60 Å²	60	133 Å²	133	50%	0.496	66%	0.659	S	S	.	*	H	α-helix	trans	-56	-34.2	174.1	0	0	0	0	0	113.8	S248 S253 F254	S248-A250 VanDerWaalsContact C-N 3.26Å; S248-A250 PolarHBondContact O-N 3.14Å; A250-S253 WeakPolarHBondContact CA-OG 3.46Å; A250-S253 PolarHBondContact O-OG 2.88Å; A250-S253 VanDerWaalsContact O-OG 3.1Å; A250-F254 WeakPolarHBondContact O-CB 3.5Å; A250-F254 WeakPolarHBondContact O-CD2 3.45Å; A250-F254 PolarHBondContact O-N 2.9Å
251	K	64.9	Low	56.7	Low	97 Å²	97	130.9 Å²	130.9	42%	0.422	65%	0.653	S	S	.	*	H	α-helix	trans	-75.9	-26.2	176.6	-166.1	-179.4	179.7	-171.6	0	112.3	E247 S248 V249 R255	E247-K251 WeakPolarHBondContact OE1-CD 3.46Å; E247-K251 WeakPolarHBondContact OE1-CE 3.47Å; E247-K251 IonicContact OE1-NZ 3.47Å; E247-K251 PolarHBondContact OE1-NZ 2.91Å; S248-K251 WeakPolarHBondContact O-CB 3.38Å; S248-K251 PolarHBondContact O-N 3.18Å; V249-K251 PolarHBondContact O-N 2.94Å; K251-R255 WeakPolarHBondContact O-CG 3.13Å; K251-R255 PolarHBondContact O-N 3.01Å
252	M	71.8	Confident	57.1	Low	119 Å²	119	134 Å²	134	59%	0.586	66%	0.655	S	S	*	*	H	α-helix	trans	-78.9	-40.8	171.3	-60.2	-145.4	-53.4	0	0	111.8	S248 V249 R255 A256	S248-M252 PolarHBondContact O-N 3.13Å; V249-M252 CarbonylContact O-C 3.43Å; V249-M252 WeakPolarHBondContact O-CA 3.33Å; V249-M252 PolarHBondContact O-N 3.31Å; M252-R255 CarbonylContact O-C 3.59Å; M252-R255 PolarHBondContact O-N 3.14Å; M252-R255 VanDerWaalsContact O-N 3.16Å; M252-A256 WeakPolarHBondContact O-CB 3.44Å; M252-A256 PolarHBondContact O-N 3.39Å
253	S	62.4	Low	57.2	Low	66 Å²	66	125.2 Å²	125.2	46%	0.462	64%	0.642	S	S	.	*	H	α-helix	trans	-65.5	-41.8	177	61.8	0	0	0	0	112.1	V249 A250 R255 A256 A257	V249-S253 PolarHBondContact O-N 3.42Å; V249-S253 PolarHBondContact O-OG 3.41Å; A250-S253 WeakPolarHBondContact CA-OG 3.46Å; A250-S253 PolarHBondContact O-OG 2.88Å; A250-S253 VanDerWaalsContact O-OG 3.1Å; S253-R255 VanDerWaalsContact C-N 3.27Å; S253-R255 PolarHBondContact O-N 2.85Å; S253-A256 PolarHBondContact O-N 2.85Å; S253-A257 WeakPolarHBondContact O-CB 3.35Å; S253-A257 PolarHBondContact O-N 3.24Å
254	F	69.4	Low	57.3	Low	161 Å²	161	124.6 Å²	124.6	71%	0.706	64%	0.639	S	S	*	*	H	α-helix	trans	-60.7	-34.5	171.5	-98.4	-80.2	0	0	0	113	A250 A258	A250-F254 WeakPolarHBondContact O-CB 3.5Å; A250-F254 WeakPolarHBondContact O-CD2 3.45Å; A250-F254 PolarHBondContact O-N 2.9Å; F254-A258 WeakPolarHBondContact O-CB 3.41Å; F254-A258 PolarHBondContact O-N 2.88Å
255	R	70.9	Confident	56.9	Low	149 Å²	149	118.7 Å²	118.7	56%	0.562	64%	0.635	S	S	*	*	H	α-helix	trans	-73.1	-36.5	173.8	-84.6	177.5	165.3	161.8	-5.1	112.9	E247 K251 M252 S253 A259	E247-R255 IonicContact OE2-CZ 3.68Å; E247-R255 IonicContact OE2-NH1 2.74Å; E247-R255 PolarHBondContact OE2-NH1 2.87Å; K251-R255 WeakPolarHBondContact O-CG 3.13Å; K251-R255 PolarHBondContact O-N 3.01Å; M252-R255 CarbonylContact O-C 3.59Å; M252-R255 PolarHBondContact O-N 3.14Å; M252-R255 VanDerWaalsContact O-N 3.16Å; S253-R255 VanDerWaalsContact C-N 3.27Å; S253-R255 PolarHBondContact O-N 2.85Å; R255-A259 WeakPolarHBondContact O-CB 3.34Å; R255-A259 PolarHBondContact O-N 3.07Å
256	A	69.4	Low	56.3	Low	52 Å²	52	117.3 Å²	117.3	43%	0.43	64%	0.636	S	S	.	*	H	α-helix	trans	-67.3	-47.1	175.6	0	0	0	0	0	111	M252 S253 A258 A259 L260	M252-A256 WeakPolarHBondContact O-CB 3.44Å; M252-A256 PolarHBondContact O-N 3.39Å; S253-A256 PolarHBondContact O-N 2.85Å; A256-A258 PolarHBondContact O-N 3.08Å; A256-A259 WeakPolarHBondContact O-CB 3.37Å; A256-A259 PolarHBondContact O-N 3.45Å; A256-A259 VanDerWaalsContact O-N 3.09Å; A256-L260 WeakPolarHBondContact O-CG 3.42Å; A256-L260 PolarHBondContact O-N 3.13Å
257	A	64.1	Low	55.5	Low	49 Å²	49	115.9 Å²	115.9	41%	0.405	63%	0.631	S	S	.	*	H	α-helix	trans	-59.6	-45.5	173.7	0	0	0	0	0	111.8	S253 A259 L260 V261	S253-A257 WeakPolarHBondContact O-CB 3.35Å; S253-A257 PolarHBondContact O-N 3.24Å; A257-A259 PolarHBondContact O-N 3.5Å; A257-L260 PolarHBondContact O-N 3.43Å; A257-V261 WeakPolarHBondContact O-CG2 3.39Å; A257-V261 PolarHBondContact O-N 2.95Å
258	A	63	Low	54.2	Low	63 Å²	63	117.5 Å²	117.5	52%	0.521	64%	0.643	S	S	.	*	H	α-helix	trans	-66.7	-20.1	175.6	0	0	0	0	0	114.2	F254 A256 K262	F254-A258 WeakPolarHBondContact O-CB 3.41Å; F254-A258 PolarHBondContact O-N 2.88Å; A256-A258 PolarHBondContact O-N 3.08Å; A258-K262 WeakPolarHBondContact O-CB 3.37Å
259	A	58.9	Low	52.1	Low	63 Å²	63	119.7 Å²	119.7	52%	0.521	66%	0.658	S	S	.	*	H	α-helix	trans	-81.7	-40.5	170.9	0	0	0	0	0	111.8	R255 A256 A257 K262	R255-A259 WeakPolarHBondContact O-CB 3.34Å; R255-A259 PolarHBondContact O-N 3.07Å; A256-A259 WeakPolarHBondContact O-CB 3.37Å; A256-A259 PolarHBondContact O-N 3.45Å; A256-A259 VanDerWaalsContact O-N 3.09Å; A257-A259 PolarHBondContact O-N 3.5Å; A259-K262 CarbonylContact O-C 3.29Å; A259-K262 PolarHBondContact O-N 3Å; A259-K262 VanDerWaalsContact O-N 3.14Å
260	L	56.9	Low	50.5	Low	146 Å²	146	120.2 Å²	120.2	76%	0.764	66%	0.662	S	S	*	*	H	α-helix	trans	-64.5	-43.5	176.2	-70.4	167.8	0	0	0	112.1	A256 A257 K262 G263	A256-L260 WeakPolarHBondContact O-CG 3.42Å; A256-L260 PolarHBondContact O-N 3.13Å; A257-L260 PolarHBondContact O-N 3.43Å; L260-K262 PolarHBondContact O-N 3.4Å; L260-G263 PolarHBondContact O-N 3.3Å
261	V	57.6	Low	49.1	Very low	134 Å²	134	124.4 Å²	124.4	81%	0.812	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-19.3	174.2	173.8	0	0	0	0	112	A257 G263	A257-V261 WeakPolarHBondContact O-CG2 3.39Å; A257-V261 PolarHBondContact O-N 2.95Å; V261-G263 PolarHBondContact O-N 3.19Å
262	K	44.5	Very low	47.4	Very low	179 Å²	179	128.5 Å²	128.5	78%	0.778	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	47.4	177.9	-158	167	-171.8	170.4	0	111.9	A258 A259 L260	A258-K262 WeakPolarHBondContact O-CB 3.37Å; A259-K262 CarbonylContact O-C 3.29Å; A259-K262 PolarHBondContact O-N 3Å; A259-K262 VanDerWaalsContact O-N 3.14Å; L260-K262 PolarHBondContact O-N 3.4Å
263	G	34.9	Very low	45.3	Very low	65 Å²	65	134.4 Å²	134.4	67%	0.67	71%	0.708	S	S	*	*			trans	-53.1	137.9	-178.3	0	0	0	0	0	113.4	L260 V261	L260-G263 PolarHBondContact O-N 3.3Å; V261-G263 PolarHBondContact O-N 3.19Å
264	R	35.1	Very low	43.8	Very low	239 Å²	239	135.4 Å²	135.4	90%	0.902	72%	0.72	S	S	*	*			trans	-105.5	134.9	160.1	-82.7	-178.2	164.1	177	-7.3	107.8	L266	R264-L266 PolarHBondContact O-N 2.93Å
265	S	30	Very low	41.8	Very low	116 Å²	116	137.2 Å²	137.2	81%	0.811	73%	0.731	S	S	*	*			trans	-59.3	133.8	168.5	-176.5	0	0	0	0	109.8
266	L	30.8	Very low	40	Very low	172 Å²	172	141.4 Å²	141.4	90%	0.901	75%	0.747	S	S	*	*			trans	-104.7	117.9	163.1	-82.3	166.1	0	0	0	106.9	R264	R264-L266 PolarHBondContact O-N 2.93Å
267	R	28.8	Very low	38.1	Very low	213 Å²	213	150.9 Å²	150.9	80%	0.804	77%	0.772	S	S	*	*			trans	-133.3	132.9	159.4	-140.2	179.4	79.2	-172.8	-0.5	108.6
268	D	29.9	Very low	36.7	Very low	132 Å²	132	152.8 Å²	152.8	71%	0.706	78%	0.782	S	S	*	*			trans	51.9	106.8	167.3	-48.8	-40.8	0	0	0	118.3
269	S	26.1	Very low	35.2	Very low	118 Å²	118	158.9 Å²	158.9	83%	0.825	80%	0.797	S	S	*	*			trans	-147.1	96.5	154.5	68.8	0	0	0	0	110.5
270	T	30.6	Very low	34	Very low	132 Å²	132	161.8 Å²	161.8	81%	0.81	81%	0.809	S	S	*	*			trans	-98.2	141.3	171.1	38.6	0	0	0	0	111.1
271	L	30.8	Very low	33.9	Very low	147 Å²	147	161 Å²	161	77%	0.77	81%	0.812	S	S	*	*			trans	73.8	126.9	161.8	-63.3	168.7	0	0	0	121.2
272	K	30.1	Very low	32.5	Very low	183 Å²	183	159 Å²	159	80%	0.796	81%	0.81	S	S	*	*			trans	74.6	83.3	139.9	-66.7	172.2	178.6	175.9	0	121.3
273	R	27.5	Very low	31.7	Very low	243 Å²	243	155.3 Å²	155.3	92%	0.917	81%	0.806	S	S	*	*				46.2	111.2	103.7	-165.7	-168.9	-158.5	173	6.3	118.8
274	A	29.6	Very low	31.3	Very low	87 Å²	87	161.5 Å²	161.5	72%	0.719	82%	0.815	S	S	*	*				148.5	147	120.1	0	0	0	0	0	117.6
275	Q	29.3	Very low	31.1	Very low	200 Å²	200	156.4 Å²	156.4	94%	0.935	80%	0.803	S	S	*	*			trans	71.9	162	146	-82.1	-178	-14.7	0	0	123.5
276	R	31.9	Very low	31.3	Very low	236 Å²	236	158.3 Å²	158.3	89%	0.891	80%	0.799	S	S	*	*			trans	-99.3	146.8	-168.8	-48.2	158.8	169.3	171.3	-6.7	110.5
277	R	30.8	Very low	31.4	Very low	251 Å²	251	157.4 Å²	157.4	95%	0.947	79%	0.791	S	S	*	*				-177.9	-168.6	111.5	-105.2	176.7	171.1	165.7	-2.7	112.1
278	S	34.6	Very low	31.5	Very low	90 Å²	90	154.3 Å²	154.3	63%	0.629	79%	0.79	S	S	*	*			trans	-123.1	172.5	-165.3	53	0	0	0	0	112.6
279	F	31.2	Very low	31.6	Very low	190 Å²	190	153.1 Å²	153.1	83%	0.833	79%	0.788	S	S	*	*			trans	109.8	177.4	169.4	-71.2	-75.6	0	0	0	117.1
280	T	32.3	Very low	31.8	Very low	125 Å²	125	153.3 Å²	153.3	77%	0.767	78%	0.783	S	S	*	*			trans	-106.1	171.4	-143.3	32.3	0	0	0	0	113.7
281	P	54.9	Low	31.8	Very low	129 Å²	129	153.5 Å²	153.5	84%	0.838	78%	0.779	S	S	*	*			trans	-95.4	164.4	-157.1	37.9	-37.5	0	0	0	116.2
282	A	28	Very low	31.5	Very low	92 Å²	92	155.3 Å²	155.3	76%	0.76	78%	0.781	S	S	*	*			trans	-158.7	159.6	169.3	0	0	0	0	0	105.5
283	S	28.3	Very low	32.3	Very low	101 Å²	101	151.6 Å²	151.6	71%	0.706	78%	0.776	S	S	*	*			cis	159.2	132.2	-28.9	52.5	0	0	0	0	105.4
284	F	26.5	Very low	32.6	Very low	195 Å²	195	146.7 Å²	146.7	86%	0.855	77%	0.768	S	S	*	*			trans	67.7	154.9	-174.3	-65.5	176.5	0	0	0	114.7
285	M	31.4	Very low	32.7	Very low	132 Å²	132	150.3 Å²	150.3	65%	0.65	77%	0.77	S	S	*	*			cis	-129	-105.9	-22.9	-162.8	158.3	89.1	0	0	113.7	E287	M285-E287 HydrophobicContact CE-CG 4.44Å
286	E	33.5	Very low	32.8	Very low	156 Å²	156	148 Å²	148	73%	0.729	76%	0.763	S	S	*	*			cis	-149.8	175.8	6.1	-101.4	78.7	-138.5	0	0	110.5
287	E	32.7	Very low	32.6	Very low	153 Å²	153	143.3 Å²	143.3	72%	0.715	76%	0.756	S	S	*	*			trans	-94.1	171.6	177.1	-71.6	166.4	136	0	0	111.7	M285	M285-E287 HydrophobicContact CE-CG 4.44Å
288	D	31.4	Very low	32.5	Very low	148 Å²	148	137.3 Å²	137.3	79%	0.791	75%	0.747	S	S	*	*			cis	-123.7	140.1	35.3	-79.1	-50.1	0	0	0	113
289	V	31.6	Very low	32.3	Very low	108 Å²	108	137.8 Å²	137.8	66%	0.655	75%	0.751	S	S	*	*				76.4	131.4	69.9	170.6	0	0	0	0	112.5
290	V	31.8	Very low	32.2	Very low	122 Å²	122	136.6 Å²	136.6	74%	0.739	75%	0.745	S	S	*	*			cis	-99.9	-137.7	16.2	-144.1	0	0	0	0	113.5
291	D	29	Very low	32.2	Very low	135 Å²	135	139.7 Å²	139.7	72%	0.722	75%	0.748	S	S	*	*			cis	-158.5	156.3	14.5	-147.1	-9.6	0	0	0	113.1
292	F	25.7	Very low	31	Very low	185 Å²	185	138 Å²	138	81%	0.811	75%	0.746	S	S	*	*			trans	-157.8	177.9	-166.6	-82.4	-79.7	0	0	0	112.6
293	P	46.8	Very low	30.9	Very low	105 Å²	105	143.8 Å²	143.8	68%	0.682	75%	0.748	S	S	*	*			cis	-116.1	-166.1	-0.8	29.8	-5.7	0	0	0	111.8
294	D	32.7	Very low	31	Very low	140 Å²	140	144.1 Å²	144.1	75%	0.749	74%	0.742	S	S	*	*			cis	-127.8	147.2	21.8	-64.1	-40.4	0	0	0	110.6
295	E	32.2	Very low	31	Very low	164 Å²	164	142 Å²	142	77%	0.766	74%	0.738	S	S	*	*				62.3	133.4	68.3	-71.7	-141.7	137.9	0	0	115.6
296	L	31.5	Very low	31	Very low	152 Å²	152	142.5 Å²	142.5	80%	0.796	74%	0.742	S	S	*	*			cis	-152	171.6	-11.9	-160.2	61.8	0	0	0	112.1
297	D	28.4	Very low	30.7	Very low	137 Å²	137	140.8 Å²	140.8	73%	0.733	74%	0.736	S	S	*	*			trans	-77	-179.1	-168.8	-169.9	19.7	0	0	0	117.4
298	T	28.5	Very low	30.3	Very low	125 Å²	125	141 Å²	141	77%	0.767	74%	0.736	S	S	*	*			trans	91.8	-171.2	160.8	78.8	0	0	0	0	119.8
299	S	30.3	Very low	30.1	Very low	100 Å²	100	140.4 Å²	140.4	70%	0.699	73%	0.729	S	S	*	*			trans	-155.9	176.3	-137	67.2	0	0	0	0	116.5
300	F	29.1	Very low	30	Very low	165 Å²	165	143.4 Å²	143.4	72%	0.724	74%	0.736	S	S	*	*			trans	90.3	136.7	163.3	-97.5	-81.5	0	0	0	121.1
301	F	32.8	Very low	29.8	Very low	189 Å²	189	144.2 Å²	144.2	83%	0.829	74%	0.735	S	S	*	*			trans	63.5	150.6	171.8	-57.9	-67.5	0	0	0	116.8
302	A	28.4	Very low	29.7	Very low	95 Å²	95	142.4 Å²	142.4	79%	0.785	73%	0.733	S	S	*	*			cis	-148.7	171.2	24.7	0	0	0	0	0	115.7
303	R	26.6	Very low	29.8	Very low	213 Å²	213	139.1 Å²	139.1	80%	0.804	73%	0.728	S	S	*	*			trans	-88.8	173.1	158.3	-88.4	175.2	68	173.8	-5.4	108.6
304	D	29.6	Very low	29	Very low	108 Å²	108	144.8 Å²	144.8	58%	0.578	74%	0.738	S	S	*	*			cis	-161.8	-160.5	12.5	-125.5	2.9	0	0	0	108.9
305	I	27.2	Very low	28.9	Very low	151 Å²	151	141.4 Å²	141.4	77%	0.774	73%	0.729	S	S	*	*			trans	80.4	120.6	161.9	-52.9	-173.5	0	0	0	115
306	L	30.6	Very low	28.8	Very low	141 Å²	141	141 Å²	141	74%	0.738	73%	0.732	S	S	*	*			cis	-159.2	170	-11.1	-135.2	60.1	0	0	0	105.7
307	M	27	Very low	28.9	Very low	120 Å²	120	142 Å²	142	59%	0.591	73%	0.733	S	S	*	*			cis	-133.5	-156.7	3.3	-129.3	-37	-168.8	0	0	106.2	E309	M307-E309 VanDerWaalsContact CE-OE1 3.3Å; M307-E309 WeakPolarHBondContact CE-OE1 3.24Å
308	H	25.7	Very low	29	Very low	158 Å²	158	141.5 Å²	141.5	73%	0.731	74%	0.735	S	S	*	*			cis	-148.1	152.8	2.8	-91.8	-64.4	0	0	0	105
309	E	27.3	Very low	29.1	Very low	135 Å²	135	144.8 Å²	144.8	63%	0.631	74%	0.739	S	S	*	*			cis	-155.2	-97.8	-11.4	-170.4	130.7	-80.6	0	0	108.8	M307	M307-E309 VanDerWaalsContact CE-OE1 3.3Å; M307-E309 WeakPolarHBondContact CE-OE1 3.24Å
310	E	28.4	Very low	28.9	Very low	171 Å²	171	148.9 Å²	148.9	80%	0.799	75%	0.747	S	S	*	*			trans	-132	163.9	-179.1	-54.3	-173.4	161.3	0	0	109.8
311	L	28.5	Very low	29.5	Very low	140 Å²	140	146.1 Å²	146.1	73%	0.733	75%	0.748	S	S	*	*			cis	-154.4	128.2	14.5	-165.5	67	0	0	0	107.2
312	S	27.1	Very low	29.9	Very low	96 Å²	96	142.4 Å²	142.4	67%	0.671	74%	0.743	S	S	*	*				54.8	137.7	94.6	138.5	0	0	0	0	116.4
313	T	27.7	Very low	30	Very low	117 Å²	117	142.6 Å²	142.6	72%	0.718	74%	0.738	S	S	*	*			cis	-164.1	157.1	-12.9	-34.7	0	0	0	0	111.8
314	Y	29.9	Very low	30.3	Very low	223 Å²	223	140.4 Å²	140.4	88%	0.875	74%	0.737	S	S	*	*			trans	87.6	148.8	139.2	-137	-119.8	0	0	0	124.8
315	A	29.7	Very low	30.6	Very low	69 Å²	69	142.6 Å²	142.6	57%	0.57	75%	0.746	S	S	*	*			trans	54.1	108.3	157.1	0	0	0	0	0	124.6
316	D	30.3	Very low	30.7	Very low	156 Å²	156	140.2 Å²	140.2	83%	0.834	75%	0.749	S	S	*	*				41.9	137.2	105.8	-70.5	-9.9	0	0	0	125
317	E	33.6	Very low	30.9	Very low	172 Å²	172	141.2 Å²	141.2	80%	0.804	75%	0.753	S	S	*	*			trans	84.1	158	137.4	-81	-73.4	-171	0	0	123.3
318	V	30	Very low	31	Very low	128 Å²	128	143.2 Å²	143.2	78%	0.776	76%	0.758	S	S	*	*			trans	78.8	122.3	167.9	-166.1	0	0	0	0	119.1
319	F	31.1	Very low	31.2	Very low	194 Å²	194	142.9 Å²	142.9	85%	0.851	76%	0.757	S	S	*	*			trans	-67.8	144.3	163.3	-99.4	-117.5	0	0	0	112
320	E	26.5	Very low	31.3	Very low	186 Å²	186	141.1 Å²	141.1	87%	0.869	77%	0.766	S	S	*	*				-159	155.1	126.7	-126.2	174.1	-165.2	0	0	114.4
321	S	41.2	Very low	31.4	Very low	106 Å²	106	141 Å²	141	74%	0.741	77%	0.765	S	S	*	*			trans	-160.9	119.2	170.4	63.5	0	0	0	0	111.1
322	P	40.4	Very low	32.2	Very low	111 Å²	111	140.1 Å²	140.1	72%	0.721	77%	0.768	S	S	*	*			trans	-129.1	162.9	159.4	26.3	-7.2	0	0	0	115
323	S	30.5	Very low	32.2	Very low	100 Å²	100	138.1 Å²	138.1	70%	0.699	76%	0.763	S	S	*	*			trans	-27.6	167.9	163.2	52.8	0	0	0	0	119.2
324	E	33.8	Very low	32.3	Very low	167 Å²	167	138.3 Å²	138.3	78%	0.78	76%	0.763	S	S	*	*			cis	-158.2	-148.4	26.6	-148.7	157.4	-157.8	0	0	115.8
325	M	34.8	Very low	32.2	Very low	153 Å²	153	136.6 Å²	136.6	75%	0.754	76%	0.761	S	S	*	*			trans	-98.8	167.3	-160.2	-60.4	170.8	-77.1	0	0	116.3
326	A	30.6	Very low	32.1	Very low	101 Å²	101	140.9 Å²	140.9	84%	0.835	77%	0.766	S	S	*	*			trans	-151.6	164.2	154.4	0	0	0	0	0	112.1
327	I	34.7	Very low	32	Very low	162 Å²	162	139.1 Å²	139.1	83%	0.831	76%	0.757	S	S	*	*			trans	-134.5	148.7	-159.2	-65.8	165.5	0	0	0	113.2
328	K	29.3	Very low	31.9	Very low	162 Å²	162	139.4 Å²	139.4	70%	0.704	76%	0.758	S	S	*	*			trans	-177.6	157	150	-97.1	-159.5	-175.6	-72.7	0	109.6
329	E	30.3	Very low	31.8	Very low	152 Å²	152	141 Å²	141	71%	0.71	76%	0.759	S	S	*	*			cis	-170.7	176.1	-19.6	-163.3	145.3	-94.6	0	0	111.2
330	A	28.6	Very low	31.6	Very low	97 Å²	97	138.7 Å²	138.7	80%	0.802	75%	0.751	S	S	*	*			trans	85.6	126	156.6	0	0	0	0	0	122.4
331	E	30.8	Very low	32	Very low	168 Å²	168	136.2 Å²	136.2	79%	0.785	74%	0.743	S	S	*	*			trans	-104.2	-177.4	169.9	-103.1	-87.8	123.2	0	0	109	G333	E331-G333 PolarHBondContact OE2-N 3.03Å
332	P	45.7	Very low	31.4	Very low	123 Å²	123	137.6 Å²	137.6	80%	0.799	75%	0.747	S	S	*	*			cis	-138.1	166.1	20.2	41.5	-22.4	0	0	0	119.6
333	G	27.6	Very low	30.9	Very low	54 Å²	54	135.9 Å²	135.9	56%	0.557	75%	0.749	S	S	*	*			trans	-149.6	-7.7	-173.7	0	0	0	0	0	123.7	E331	E331-G333 PolarHBondContact OE2-N 3.03Å
334	T	28.6	Very low	30.7	Very low	120 Å²	120	137 Å²	137	74%	0.736	76%	0.757	S	S	*	*			trans	62.9	123.1	173.4	52.2	0	0	0	0	122.8
335	K	29.2	Very low	30.5	Very low	188 Å²	188	132.9 Å²	132.9	82%	0.817	75%	0.752	S	S	*	*			trans	69.3	143.7	139.7	-64.5	174.1	-176.5	173.9	0	118.7
336	K	26.6	Very low	30.4	Very low	158 Å²	158	133.2 Å²	133.2	69%	0.687	76%	0.756	S	S	*	*			cis	-157.6	155.4	4	-123.1	-177.6	167.2	-80	0	110.8
337	D	28.3	Very low	30.2	Very low	119 Å²	119	135.1 Å²	135.1	64%	0.636	75%	0.752	S	S	*	*			trans	1.4	166.2	153.5	-21.4	-32.2	0	0	0	121.2
338	E	30.4	Very low	30.1	Very low	179 Å²	179	136 Å²	136	84%	0.836	75%	0.75	S	S	*	*			cis	178.4	-179.7	-36.2	-153.7	177.7	177.5	0	0	106.7
339	M	28.6	Very low	30.3	Very low	160 Å²	160	134.1 Å²	134.1	79%	0.788	75%	0.752	S	S	*	*			trans	65	160.3	168.3	-74.1	179.3	67.1	0	0	118.8
340	E	27.8	Very low	30.3	Very low	146 Å²	146	135.1 Å²	135.1	68%	0.682	76%	0.757	S	S	*	*			cis	-172.5	165.2	-42.2	-131.2	-166.2	157.6	0	0	111
341	L	34.4	Very low	30.3	Very low	134 Å²	134	137 Å²	137	70%	0.702	75%	0.753	S	S	*	*			trans	67.8	148.4	147.3	-123.5	68.7	0	0	0	125.2
342	T	28.4	Very low	30.1	Very low	136 Å²	136	135 Å²	135	83%	0.834	74%	0.743	S	S	*	*			trans	70.5	141.1	164.8	69.6	0	0	0	0	119.1
343	G	29.1	Very low	29.3	Very low	74 Å²	74	138.8 Å²	138.8	76%	0.763	74%	0.742	S	S	*	*			cis	-177.1	151.7	-5.5	0	0	0	0	0	114.5
344	S	27.1	Very low	29.3	Very low	124 Å²	124	139.9 Å²	139.9	87%	0.867	74%	0.741	S	S	*	*			trans	-43.7	166.8	175.5	58.8	0	0	0	0	117.6
345	A	30.8	Very low	29.4	Very low	80 Å²	80	141.5 Å²	141.5	66%	0.661	74%	0.74	S	S	*	*			cis	-168.2	-179.9	30.7	0	0	0	0	0	114.7
346	L	31.1	Very low	29.5	Very low	160 Å²	160	139.7 Å²	139.7	84%	0.838	74%	0.738	S	S	*	*			trans	71.2	143.5	157.2	-63.2	170.6	0	0	0	119
347	D	27	Very low	29.6	Very low	141 Å²	141	140.6 Å²	140.6	75%	0.754	75%	0.747	S	S	*	*			cis	-155.4	-170.2	-20.4	-157.8	0.6	0	0	0	111.4
348	K	32.7	Very low	29.7	Very low	181 Å²	181	141.3 Å²	141.3	79%	0.787	75%	0.75	S	S	*	*			trans	-95.5	152.2	-157.5	-72.8	172.2	178.3	170.4	0	119.2
349	T	34.3	Very low	30.2	Very low	123 Å²	123	138.2 Å²	138.2	76%	0.755	75%	0.746	S	S	*	*			trans	9.2	137.6	146.3	62.6	0	0	0	0	122.1
350	E	29.2	Very low	30.4	Very low	173 Å²	173	136.6 Å²	136.6	81%	0.808	74%	0.739	S	S	*	*				-165.3	179	113.5	-112.8	-162.9	153.3	0	0	116.1
351	L	28	Very low	30.7	Very low	137 Å²	137	136.9 Å²	136.9	72%	0.717	74%	0.741	S	S	*	*			trans	-31.5	168.7	170.9	-92.5	69.1	0	0	0	119.8
352	E	27.9	Very low	30.4	Very low	124 Å²	124	141.3 Å²	141.3	58%	0.579	75%	0.748	S	S	*	*			cis	-166.7	155.4	-19.1	-149.9	-151.5	153.3	0	0	109.7
353	R	27.8	Very low	30.4	Very low	203 Å²	203	138.1 Å²	138.1	77%	0.766	74%	0.742	S	S	*	*			trans	58.3	166.9	159.3	-84.3	172.2	162.4	122.3	-8.1	117.8
354	S	28.3	Very low	30.1	Very low	77 Å²	77	146.8 Å²	146.8	54%	0.538	75%	0.752	S	S	.	*			cis	-157.9	151.8	-29.4	39	0	0	0	0	107.6
355	H	31.4	Very low	30.3	Very low	155 Å²	155	152.8 Å²	152.8	72%	0.718	76%	0.755	S	S	*	*				169.2	147.4	85.1	-94.3	-71.5	0	0	0	112.8
356	L	29.8	Very low	30.2	Very low	149 Å²	149	159 Å²	159	78%	0.78	77%	0.768	S	S	*	*			trans	63.1	150.7	142.6	-63.8	169.2	0	0	0	119.6
357	M	29.8	Very low	30.2	Very low	177 Å²	177	156.3 Å²	156.3	87%	0.872	77%	0.768	S	S	*	*			cis	-127.2	161.8	12.3	-76.5	-168.5	-177.6	0	0	115.1
358	L	29.8	Very low	30.3	Very low	135 Å²	135	158 Å²	158	71%	0.707	77%	0.769	S	S	*	*			trans	-103.3	-173	166.5	-94.3	169.6	0	0	0	109.1	L360	L358-L360 HydrophobicContact CD1-CD1 4.13Å; L358-L360 HydrophobicContact CD2-CB 4.44Å; L358-L360 HydrophobicContact CD2-CD1 3.89Å; L358-L360 HydrophobicContact CD2-CG 3.99Å
359	P	40.2	Very low	30.2	Very low	114 Å²	114	157.6 Å²	157.6	74%	0.74	77%	0.77	S	S	*	*			cis	-129.5	171.5	16	44	-25.9	0	0	0	114.9
360	L	33.3	Very low	29.9	Very low	126 Å²	126	155.1 Å²	155.1	66%	0.66	77%	0.769	S	S	*	*			cis	63.7	147.7	43.7	-80.5	176.8	0	0	0	113.6	L358	L358-L360 HydrophobicContact CD1-CD1 4.13Å; L358-L360 HydrophobicContact CD2-CB 4.44Å; L358-L360 HydrophobicContact CD2-CD1 3.89Å; L358-L360 HydrophobicContact CD2-CG 3.99Å
361	E	33.8	Very low	29.9	Very low	151 Å²	151	153.5 Å²	153.5	71%	0.706	77%	0.77	S	S	*	*			cis	-136.4	154.9	13.4	-72.6	-164.3	122.6	0	0	113.9
362	R	28.4	Very low	30.6	Very low	228 Å²	228	153 Å²	153	86%	0.86	78%	0.776	S	S	*	*				179.8	108.2	101.4	-96.4	174.7	-175.9	155.3	5.4	112.3
363	G	27.9	Very low	30.6	Very low	68 Å²	68	150.4 Å²	150.4	70%	0.701	78%	0.782	S	S	*	*			trans	-96.2	170.1	-179.8	0	0	0	0	0	114.6
364	W	24.7	Very low	31.1	Very low	257 Å²	257	147 Å²	147	97%	0.973	79%	0.786	S	S	*	*			trans	-136.4	128.8	160	-97.9	72	0	0	0	107.5
365	R	29.8	Very low	32	Very low	249 Å²	249	149 Å²	149	94%	0.94	80%	0.798	S	S	*	*			trans	-81.8	142.2	-179.3	-69.4	-170.9	179.5	-163.4	1	111.3
366	K	28.5	Very low	31.9	Very low	212 Å²	212	151.6 Å²	151.6	92%	0.922	81%	0.807	S	S	*	*			trans	-80.9	161.4	154.9	-88	-176	172.4	-178.4	0	109.7
367	A	31.8	Very low	32	Very low	102 Å²	102	151.2 Å²	151.2	84%	0.843	81%	0.81	S	S	*	*			trans	-134	143.8	159.4	0	0	0	0	0	108.9
368	K	29.1	Very low	32.6	Very low	177 Å²	177	148.5 Å²	148.5	77%	0.77	81%	0.806	S	S	*	*			trans	-160.3	103.2	161.7	-166.1	171.3	-175.7	-170.8	0	112.7
369	E	31.2	Very low	32.6	Very low	173 Å²	173	150.4 Å²	150.4	81%	0.808	82%	0.816	S	S	*	*				63.3	134.6	125.7	-141.7	157.6	-92.5	0	0	122
370	G	27.7	Very low	32.3	Very low	71 Å²	71	155.2 Å²	155.2	73%	0.732	82%	0.819	S	S	*	*			trans	170	87.2	173.4	0	0	0	0	0	115.3
371	T	28.6	Very low	32.2	Very low	138 Å²	138	157.3 Å²	157.3	85%	0.847	83%	0.826	S	S	*	*			trans	-20.2	174.2	160.6	22.1	0	0	0	0	121.8
372	P	43.6	Very low	32.2	Very low	127 Å²	127	156.6 Å²	156.6	83%	0.825	82%	0.822	S	S	*	*			cis	-133.4	175.5	-7.7	36.5	-17.7	0	0	0	116.5
373	G	27.6	Very low	32.4	Very low	70 Å²	70	151.1 Å²	151.1	72%	0.722	81%	0.814	S	S	*	*			trans	-172.2	154.7	169.9	0	0	0	0	0	114.4
374	P	38.7	Very low	32.7	Very low	131 Å²	131	154 Å²	154	85%	0.851	82%	0.818	S	S	*	*			trans	-91	172.8	-158.8	36.3	-37.7	0	0	0	116.9
375	P	45.4	Very low	32.9	Very low	120 Å²	120	147.2 Å²	147.2	78%	0.779	81%	0.809	S	S	*	*			trans	-104.4	161.6	-147.2	39.3	-37.2	0	0	0	116.9
376	K	30.8	Very low	33.1	Very low	209 Å²	209	140.7 Å²	140.7	91%	0.909	80%	0.797	S	S	*	*			trans	-140.8	148.6	156.7	-70.1	-163.5	176.3	-175.4	0	112.5
377	V	31.9	Very low	33.2	Very low	140 Å²	140	139.5 Å²	139.5	85%	0.848	79%	0.794	S	S	*	*			trans	-77.2	148	-173.6	173.9	0	0	0	0	111.1
378	P	41.6	Very low	33.1	Very low	121 Å²	121	137.9 Å²	137.9	79%	0.786	79%	0.788	S	S	*	*			trans	-77.1	146.1	-169.9	30.3	-37.3	0	0	0	114.4
379	L	29.8	Very low	33.6	Very low	174 Å²	174	138.8 Å²	138.8	91%	0.911	79%	0.794	S	S	*	*			trans	-111.9	120.5	161.8	-86.3	167	0	0	0	110.1	Q381	L379-Q381 PolarHBondContact O-N 2.92Å
380	R	34.4	Very low	33.9	Very low	216 Å²	216	142.4 Å²	142.4	82%	0.815	80%	0.801	S	S	*	*			trans	-78	109.1	171.5	171.7	-176.5	173	-179.7	-2.6	108.3	E382	R380-E382 IonicContact CZ-OE1 2.6Å; R380-E382 IonicContact NE-OE1 2.93Å; R380-E382 PolarHBondContact NE-OE1 3.23Å; R380-E382 IonicContact NH2-OE1 2.89Å; R380-E382 PolarHBondContact NH2-OE1 3.29Å
381	Q	30.5	Very low	34.3	Very low	170 Å²	170	150.9 Å²	150.9	79%	0.794	81%	0.811	S	S	*	*			trans	-116.7	108.5	168.8	-166.6	167.8	9.4	0	0	110.4	L379 V383	L379-Q381 PolarHBondContact O-N 2.92Å; Q381-V383 HydrophobicContact CG-CG2 4.16Å
382	E	35.1	Very low	34.7	Very low	135 Å²	135	147.7 Å²	147.7	63%	0.631	81%	0.805	S	S	*	*			trans	-74.3	124.8	167.8	-74.6	165.4	-158.7	0	0	108.9	R380	R380-E382 IonicContact CZ-OE1 2.6Å; R380-E382 IonicContact NE-OE1 2.93Å; R380-E382 PolarHBondContact NE-OE1 3.23Å; R380-E382 IonicContact NH2-OE1 2.89Å; R380-E382 PolarHBondContact NH2-OE1 3.29Å
383	V	31.6	Very low	34.7	Very low	113 Å²	113	150.6 Å²	150.6	69%	0.685	81%	0.808	S	S	*	*			trans	-121.1	97	171.1	-177.3	0	0	0	0	108.1	Q381 S385	Q381-V383 HydrophobicContact CG-CG2 4.16Å; V383-S385 PolarHBondContact O-N 3.2Å
384	V	34.4	Very low	35.2	Very low	129 Å²	129	158 Å²	158	78%	0.782	81%	0.814	S	S	*	*			trans	-64.7	113.5	169.3	176.8	0	0	0	0	108.2	V386	V384-V386 HydrophobicContact CG1-CG2 4.15Å
385	S	29.2	Very low	35.7	Very low	114 Å²	114	158.7 Å²	158.7	80%	0.797	81%	0.809	S	S	*	*			trans	-111.4	112.9	173.5	-167.8	0	0	0	0	109.9	V383	V383-S385 PolarHBondContact O-N 3.2Å
386	V	33	Very low	35.6	Very low	113 Å²	113	158.3 Å²	158.3	69%	0.685	80%	0.804	S	S	*	*			trans	-83.3	132	-171.9	176.7	0	0	0	0	111.3	V384	V384-V386 HydrophobicContact CG1-CG2 4.15Å
387	H	30.4	Very low	36.5	Very low	186 Å²	186	151.8 Å²	151.8	86%	0.861	78%	0.781	S	S	*	*			trans	35.4	99.4	162	-74.3	85.6	0	0	0	119.5
388	G	31.3	Very low	37.3	Very low	68 Å²	68	148.7 Å²	148.7	70%	0.701	76%	0.764	S	S	*	*			trans	-130.5	108.4	157.2	0	0	0	0	0	111.9	R390	G388-R390 PolarHBondContact O-N 3.21Å
389	Q	38.4	Very low	37.6	Very low	196 Å²	196	147.5 Å²	147.5	92%	0.916	75%	0.754	S	S	*	*			trans	-66.7	91.4	-178.2	-76.3	-169	-15.6	0	0	113	R391	Q389-R391 PolarHBondContact O-N 3.39Å
390	R	37.4	Very low	38.4	Very low	250 Å²	250	148.1 Å²	148.1	94%	0.943	75%	0.75	S	S	*	*			trans	-81.2	83.5	170.3	-75.8	-165.5	170.9	-170.4	-0.9	112.5	G388 G392	G388-R390 PolarHBondContact O-N 3.21Å; R390-G392 PolarHBondContact O-N 3.29Å
391	R	35.9	Very low	39	Very low	249 Å²	249	145.2 Å²	145.2	94%	0.94	74%	0.743	S	S	*	*			trans	-54.1	119.7	173.4	-157.6	179.5	-162.8	173.9	5.6	111.8	Q389	Q389-R391 PolarHBondContact O-N 3.39Å
392	G	38.3	Very low	39.7	Very low	70 Å²	70	143.3 Å²	143.3	72%	0.722	74%	0.738	S	S	*	*			trans	90.4	84.8	162.1	0	0	0	0	0	116.9	R390 R394	R390-G392 PolarHBondContact O-N 3.29Å; G392-R394 PolarHBondContact O-N 2.89Å
393	Q	42.2	Very low	40	Very low	189 Å²	189	145.2 Å²	145.2	88%	0.883	74%	0.744	S	S	*	*			trans	-60.1	104.1	153.4	-104.9	-173.7	-4.4	0	0	108.9	I395	Q393-I395 PolarHBondContact O-N 2.92Å
394	R	39.3	Very low	40.8	Very low	226 Å²	226	143 Å²	143	85%	0.853	74%	0.737	S	S	*	*			trans	-72.5	99.8	175.3	-158.5	-178.8	-150.8	172	7.8	107.7	G392 V396	G392-R394 PolarHBondContact O-N 2.89Å; R394-V396 HydrophobicContact CB-CG2 4.38Å; R394-V396 HydrophobicContact CG-CG2 4.06Å; R394-V396 PolarHBondContact O-N 2.96Å
395	I	48.7	Very low	41.7	Very low	145 Å²	145	145.7 Å²	145.7	74%	0.744	73%	0.733	S	S	*	*			trans	-68.6	81.2	173.8	-49.7	179	0	0	0	108.4	Q393 V397	Q393-I395 PolarHBondContact O-N 2.92Å; I395-V397 HydrophobicContact CG2-CG2 3.83Å; I395-V397 PolarHBondContact O-N 3.36Å
396	V	44.3	Very low	43	Very low	111 Å²	111	148.9 Å²	148.9	67%	0.673	74%	0.736	S	S	*	*			trans	-73.9	78.1	169.9	-175.1	0	0	0	0	107	R394 P398	R394-V396 HydrophobicContact CB-CG2 4.38Å; R394-V396 HydrophobicContact CG-CG2 4.06Å; R394-V396 PolarHBondContact O-N 2.96Å; V396-P398 VanDerWaalsContact O-CD 3.28Å; V396-P398 WeakPolarHBondContact O-CD 3.29Å; V396-P398 VanDerWaalsContact O-N 3.07Å
397	V	49.1	Very low	44.4	Very low	72 Å²	72	148 Å²	148	44%	0.436	72%	0.723	S	S	.	*			trans	-55.3	115	164.2	-178.8	0	0	0	0	105.8	I395 V399 K401	I395-V397 HydrophobicContact CG2-CG2 3.83Å; I395-V397 PolarHBondContact O-N 3.36Å; V397-V399 PolarHBondContact O-N 2.82Å; V397-K401 HydrophobicContact CG1-CB 4.06Å; V397-K401 HydrophobicContact CG1-CD 4.49Å
398	P	48.9	Very low	46.3	Very low	75 Å²	75	140.4 Å²	140.4	49%	0.487	69%	0.687	S	S	.	*			trans	-62	128.3	-174.8	23.8	-33	0	0	0	108.2	V396 K400 K401	V396-P398 VanDerWaalsContact O-CD 3.28Å; V396-P398 WeakPolarHBondContact O-CD 3.29Å; V396-P398 VanDerWaalsContact O-N 3.07Å; P398-K400 PolarHBondContact O-N 3.41Å; P398-K401 HydrophobicContact CG-CG 4.48Å; P398-K401 PolarHBondContact O-N 3.17Å
399	V	48.1	Very low	47.9	Very low	96 Å²	96	139.7 Å²	139.7	58%	0.582	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-57.2	-22.1	-169.6	-179.5	0	0	0	0	112.7	V397 K401 L402 F403	V397-V399 PolarHBondContact O-N 2.82Å; V399-K401 PolarHBondContact O-N 3.11Å; V399-K401 VanDerWaalsContact O-N 3.16Å; V399-L402 PolarHBondContact O-N 3.23Å; V399-F403 HydrophobicContact CG1-CD2 4.17Å; V399-F403 HydrophobicContact CG1-CE2 4.15Å
400	K	45.8	Very low	49.4	Very low	187 Å²	187	130.8 Å²	130.8	81%	0.813	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-47.8	-36	165.9	-69.9	-169.4	174.7	-172.8	0	113.5	P398 A404	P398-K400 PolarHBondContact O-N 3.41Å; K400-A404 WeakPolarHBondContact O-CB 2.85Å; K400-A404 PolarHBondContact O-N 3.14Å
401	K	47.6	Very low	50.8	Low	155 Å²	155	119 Å²	119	67%	0.674	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-74.8	-17.1	177.2	-77.6	-169.8	173.6	-173.5	0	114.8	V397 P398 V399	V397-K401 HydrophobicContact CG1-CB 4.06Å; V397-K401 HydrophobicContact CG1-CD 4.49Å; P398-K401 HydrophobicContact CG-CG 4.48Å; P398-K401 PolarHBondContact O-N 3.17Å; V399-K401 PolarHBondContact O-N 3.11Å; V399-K401 VanDerWaalsContact O-N 3.16Å
402	L	43.7	Very low	52.6	Low	131 Å²	131	108.3 Å²	108.3	69%	0.686	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-19.6	175.3	-70.7	169.6	0	0	0	112.9	V399	V399-L402 PolarHBondContact O-N 3.23Å
403	F	42.7	Very low	54.3	Low	175 Å²	175	105.1 Å²	105.1	77%	0.768	51%	0.512	S	S	*	.	S	Bend	trans	-111.1	6.6	171.8	-65.7	-77.7	0	0	0	113.2	V399 R405	V399-F403 HydrophobicContact CG1-CD2 4.17Å; V399-F403 HydrophobicContact CG1-CE2 4.15Å; F403-R405 PolarHBondContact O-N 3.05Å
404	A	47.1	Very low	55.7	Low	65 Å²	65	99.9 Å²	99.9	54%	0.537	49%	0.489	S	S	.	.			trans	-68.4	85.6	166.7	0	0	0	0	0	108.9	K400 E406	K400-A404 WeakPolarHBondContact O-CB 2.85Å; K400-A404 PolarHBondContact O-N 3.14Å; A404-E406 PolarHBondContact O-N 3.03Å
405	R	53.7	Low	57.3	Low	186 Å²	186	89.8 Å²	89.8	70%	0.702	45%	0.452	S	S	*	.			trans	-49.2	128.8	162	-165.3	-177.5	-162.1	-171.2	4.9	107.1	F403 K407	F403-R405 PolarHBondContact O-N 3.05Å; R405-K407 PolarHBondContact O-N 2.92Å
406	E	58.1	Low	58.3	Low	181 Å²	181	83 Å²	83	85%	0.846	42%	0.418	S	S	*	.			trans	-56.2	111	-177	-70.3	-176.5	135.5	0	0	110	A404	A404-E406 PolarHBondContact O-N 3.03Å
407	K	61.8	Low	59.9	Low	96 Å²	96	84.8 Å²	84.8	42%	0.417	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-54.7	143.8	173.9	-68.9	-135.7	169.7	178.1	0	109.5	R405 P409 E436 M438 D440	R405-K407 PolarHBondContact O-N 2.92Å; K407-P409 WeakPolarHBondContact O-CD 3.32Å; K407-E436 PolarHBondContact NZ-O 2.93Å; K407-M438 PolarHBondContact NZ-O 2.82Å; K407-D440 WeakPolarHBondContact CA-OD1 3.42Å; K407-D440 WeakPolarHBondContact CA-OD2 3.43Å; K407-D440 WeakPolarHBondContact CB-OD2 3.41Å; K407-D440 VanDerWaalsContact CD-OD2 3.23Å; K407-D440 WeakPolarHBondContact CD-OD2 3.42Å; K407-D440 WeakPolarHBondContact CG-OD2 3.37Å
408	R	69.5	Low	61.1	Low	26 Å²	26	87.6 Å²	87.6	10%	0.098	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-69.6	116.5	169.2	-176.9	-179	-176.4	-95.9	17.2	108.9	Y410 D440 D725 E776	R408-Y410 PolarHBondContact O-N 3.39Å; R408-D440 PolarHBondContact N-OD1 3.02Å; R408-D725 WeakPolarHBondContact CD-O 3.35Å; R408-D725 IonicContact CZ-OD2 3.02Å; R408-D725 VanDerWaalsContact CZ-OD2 3.31Å; R408-D725 PolarHBondContact NE-O 2.77Å; R408-D725 VanDerWaalsContact NE-O 3.17Å; R408-D725 IonicContact NE-OD1 3.81Å; R408-D725 PolarHBondContact NE-OD1 2.93Å; R408-D725 IonicContact NE-OD2 3.96Å; R408-D725 PolarHBondContact NE-OD2 3.47Å; R408-D725 IonicContact NH2-OD2 2.67Å; R408-D725 PolarHBondContact NH2-OD2 3.23Å; R408-E776 IonicContact CZ-OE1 3.87Å; R408-E776 IonicContact CZ-OE2 3.88Å; R408-E776 IonicContact NH1-OE1 3.86Å; R408-E776 PolarHBondContact NH1-OE1 3.07Å; R408-E776 IonicContact NH1-OE2 3.96Å; R408-E776 IonicContact NH2-OE1 2.67Å; R408-E776 PolarHBondContact NH2-OE1 3.3Å; R408-E776 IonicContact NH2-OE2 2.72Å; R408-E776 PolarHBondContact NH2-OE2 3.44Å
409	P	66.3	Low	62.3	Low	52 Å²	52	84.7 Å²	84.7	34%	0.338	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-70.5	129.1	174.2	29.9	-33.3	0	0	0	110.1	K407 L412	K407-P409 WeakPolarHBondContact O-CD 3.32Å; P409-L412 HydrophobicContact CB-CB 3.85Å; P409-L412 HydrophobicContact CB-CD1 4.3Å; P409-L412 HydrophobicContact CG-CB 3.64Å; P409-L412 CarbonylContact O-C 3.52Å; P409-L412 WeakPolarHBondContact O-CA 3.45Å; P409-L412 PolarHBondContact O-N 2.86Å
410	Y	69.7	Low	63.8	Low	10 Å²	10	86.4 Å²	86.4	4%	0.039	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	131.6	-177.8	-155.6	-87.4	0	0	0	111.4	R408 L412 Y423 M438 L729 Q779 C780 P831	R408-Y410 PolarHBondContact O-N 3.39Å; Y410-L412 PolarHBondContact O-N 2.99Å; Y410-Y423 PolarHBondContact N-OH 2.93Å; Y410-Y423 WeakPolarHBondContact O-CE1 3.48Å; Y410-Y423 PolarHBondContact O-OH 2.95Å; Y410-M438 HydrophobicContact CD2-CE 3.74Å; Y410-M438 HydrophobicContact CD2-SD 4.15Å; Y410-M438 HydrophobicContact CE2-CE 3.88Å; Y410-M438 HydrophobicContact CE2-SD 4Å; Y410-L729 HydrophobicContact CD2-CD1 3.57Å; Y410-L729 HydrophobicContact CD2-CD2 4.22Å; Y410-L729 HydrophobicContact CD2-CG 4.15Å; Y410-L729 HydrophobicContact CE2-CD1 4.02Å; Y410-L729 HydrophobicContact CE2-CD2 3.94Å; Y410-L729 HydrophobicContact CE2-CG 4.07Å; Y410-L729 HydrophobicContact CG-CD1 4.32Å; Y410-Q779 PolarHBondContact OH-OE1 2.99Å; Y410-C780 WeakPolarHBondContact CD1-SG 3.31Å; Y410-C780 WeakPolarHBondContact CE1-SG 3.45Å; Y410-P831 PolarHBondContact OH-O 3.02Å
411	G	67.1	Low	65.4	Low	1 Å²	1	78.5 Å²	78.5	1%	0.01	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.4	-6	-175	0	0	0	0	0	116.1	E776	G411-E776 VanDerWaalsContact CA-OE1 3.27Å; G411-E776 WeakPolarHBondContact CA-OE1 2.99Å; G411-E776 PolarHBondContact N-OE1 3.28Å
412	L	72.5	Confident	67	Low	25 Å²	25	75.2 Å²	75.2	13%	0.131	37%	0.374	C	S	.	.			trans	-119.4	28.5	-172.8	-67.4	-178.8	0	0	0	112.5	P409 Y410 R421 Y423	P409-L412 HydrophobicContact CB-CB 3.85Å; P409-L412 HydrophobicContact CB-CD1 4.3Å; P409-L412 HydrophobicContact CG-CB 3.64Å; P409-L412 CarbonylContact O-C 3.52Å; P409-L412 WeakPolarHBondContact O-CA 3.45Å; P409-L412 PolarHBondContact O-N 2.86Å; Y410-L412 PolarHBondContact O-N 2.99Å; L412-R421 HydrophobicContact CD2-CB 3.45Å; L412-R421 VanDerWaalsContact CD2-CB 3.45Å; L412-R421 VanDerWaalsContact CD2-O 3.31Å; L412-R421 WeakPolarHBondContact CD2-O 3.27Å; L412-Y423 HydrophobicContact CD1-CD1 3.8Å; L412-Y423 HydrophobicContact CD1-CD2 3.69Å; L412-Y423 HydrophobicContact CD1-CE1 3.73Å; L412-Y423 HydrophobicContact CD1-CE2 3.64Å; L412-Y423 HydrophobicContact CD1-CG 3.79Å; L412-Y423 HydrophobicContact CG-CD1 4.32Å; L412-Y423 HydrophobicContact CG-CE1 4.05Å
413	G	73.9	Confident	68.7	Low	4 Å²	4	72.3 Å²	72.3	4%	0.041	35%	0.354	C	S	.	.	S	Bend	trans	-63.6	-163	173.6	0	0	0	0	0	114.7	V415 G416 K417 D725	G413-V415 VanDerWaalsContact C-N 3.3Å; G413-V415 PolarHBondContact O-N 3.45Å; G413-G416 CarbonylContact O-C 3.28Å; G413-G416 WeakPolarHBondContact O-CA 3.39Å; G413-G416 PolarHBondContact O-N 3.31Å; G413-K417 PolarHBondContact O-N 3.35Å; G413-D725 WeakPolarHBondContact CA-OD2 3.36Å
414	M	72.9	Confident	70.4	Confident	78 Å²	78	71.8 Å²	71.8	38%	0.384	35%	0.347	S	S	.	.	H	α-helix	trans	-59.5	-41.1	-175.2	-155.8	-164.2	83.6	0	0	112.4	G416 K417 L418 T721 D725	M414-G416 VanDerWaalsContact C-N 3.31Å; M414-G416 PolarHBondContact O-N 3.49Å; M414-K417 PolarHBondContact O-N 2.8Å; M414-L418 PolarHBondContact O-N 3.43Å; M414-T721 HydrophobicContact CE-CG2 3.86Å; M414-T721 HydrophobicContact SD-CG2 3.91Å; M414-D725 PolarHBondContact N-OD2 3.31Å
415	V	72.2	Confident	71.7	Confident	15 Å²	15	79.3 Å²	79.3	9%	0.091	37%	0.368	C	S	.	.	H	α-helix	trans	-68	-30.7	174	179	0	0	0	0	111.9	G413 L418 T419 I722 L773 L794	G413-V415 VanDerWaalsContact C-N 3.3Å; G413-V415 PolarHBondContact O-N 3.45Å; V415-L418 PolarHBondContact O-N 3.29Å; V415-T419 HydrophobicContact CG1-CG2 4.48Å; V415-T419 WeakPolarHBondContact O-CB 3.29Å; V415-T419 PolarHBondContact O-N 3.39Å; V415-T419 PolarHBondContact O-OG1 3.28Å; V415-I722 HydrophobicContact CG2-CD1 4.25Å; V415-I722 HydrophobicContact CG2-CG1 4.02Å; V415-L773 HydrophobicContact CG2-CD1 3.88Å; V415-L773 HydrophobicContact CG2-CD2 4.41Å; V415-L794 HydrophobicContact CG1-CD1 4.15Å
416	G	69.8	Low	72.7	Confident	3 Å²	3	81.1 Å²	81.1	3%	0.031	37%	0.374	C	S	.	.	H	α-helix	trans	-67.4	-37.9	173.3	0	0	0	0	0	112.9	G413 M414 N420 R421	G413-G416 CarbonylContact O-C 3.28Å; G413-G416 WeakPolarHBondContact O-CA 3.39Å; G413-G416 PolarHBondContact O-N 3.31Å; M414-G416 VanDerWaalsContact C-N 3.31Å; M414-G416 PolarHBondContact O-N 3.49Å; G416-N420 PolarHBondContact O-N 2.72Å; G416-R421 PolarHBondContact O-N 3.01Å
417	K	76.6	Confident	73.6	Confident	147 Å²	147	75.3 Å²	75.3	64%	0.639	35%	0.348	S	S	*	.	H	α-helix	trans	-64.9	-47.4	170.9	-65.6	179.4	-179.9	-179.2	0	111.3	G413 M414 T419 N420	G413-K417 PolarHBondContact O-N 3.35Å; M414-K417 PolarHBondContact O-N 2.8Å; K417-T419 VanDerWaalsContact C-N 3.32Å; K417-T419 PolarHBondContact O-N 2.97Å; K417-N420 PolarHBondContact O-N 3.45Å; K417-N420 PolarHBondContact O-OD1 3.27Å
418	L	75	Confident	74.3	Confident	132 Å²	132	75 Å²	75	69%	0.691	35%	0.351	S	S	*	.	H	α-helix	trans	-59.4	-40.1	177.4	-177.7	63.4	0	0	0	112.7	M414 V415 N420	M414-L418 PolarHBondContact O-N 3.43Å; V415-L418 PolarHBondContact O-N 3.29Å; L418-N420 VanDerWaalsContact C-N 3.33Å; L418-N420 PolarHBondContact O-N 3.12Å
419	T	74.1	Confident	74.5	Confident	13 Å²	13	78.1 Å²	78.1	8%	0.08	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-0.2	-179.2	52	0	0	0	0	114.3	V415 K417 R421 K793	V415-T419 HydrophobicContact CG1-CG2 4.48Å; V415-T419 WeakPolarHBondContact O-CB 3.29Å; V415-T419 PolarHBondContact O-N 3.39Å; V415-T419 PolarHBondContact O-OG1 3.28Å; K417-T419 VanDerWaalsContact C-N 3.32Å; K417-T419 PolarHBondContact O-N 2.97Å; T419-R421 WeakPolarHBondContact OG1-CG 3.46Å; T419-R421 PolarHBondContact OG1-NE 2.9Å; T419-K793 HydrophobicContact CG2-CB 3.84Å; T419-K793 HydrophobicContact CG2-CD 4.11Å; T419-K793 PolarHBondContact O-NZ 3.36Å
420	N	80.6	Confident	75.1	Confident	132 Å²	132	81.9 Å²	81.9	71%	0.706	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	45.8	-173.3	-73.4	-34.5	0	0	0	113.4	G416 K417 L418	G416-N420 PolarHBondContact O-N 2.72Å; K417-N420 PolarHBondContact O-N 3.45Å; K417-N420 PolarHBondContact O-OD1 3.27Å; L418-N420 VanDerWaalsContact C-N 3.33Å; L418-N420 PolarHBondContact O-N 3.12Å
421	R	78.9	Confident	75.5	Confident	22 Å²	22	82.2 Å²	82.2	8%	0.083	39%	0.388	C	S	.	.			trans	-70.9	143.9	173.1	-66.3	175.8	-165.7	-164.8	-11.8	110.6	L412 G416 T419 L784 A790	L412-R421 HydrophobicContact CD2-CB 3.45Å; L412-R421 VanDerWaalsContact CD2-CB 3.45Å; L412-R421 VanDerWaalsContact CD2-O 3.31Å; L412-R421 WeakPolarHBondContact CD2-O 3.27Å; G416-R421 PolarHBondContact O-N 3.01Å; T419-R421 WeakPolarHBondContact OG1-CG 3.46Å; T419-R421 PolarHBondContact OG1-NE 2.9Å; R421-L784 HydrophobicContact CB-CD2 4.4Å; R421-L784 HydrophobicContact CG-CD2 4.12Å; R421-A790 HydrophobicContact CG-CB 3.82Å; R421-A790 PolarHBondContact NH2-O 3.11Å
422	T	80.3	Confident	76	Confident	86 Å²	86	87.6 Å²	87.6	53%	0.528	41%	0.412	S	S	.	.			trans	-140.1	148.9	172.3	52.9	0	0	0	0	110.7	A785	T422-A785 PolarHBondContact O-N 3.04Å
423	Y	80.7	Confident	76.1	Confident	69 Å²	69	95.4 Å²	95.4	27%	0.271	44%	0.439	S	S	.	.	B	Isolated β-bridge	trans	-69.5	152.1	170.5	-72.9	-34.5	0	0	0	111.7	Y410 L412 I427 I783	Y410-Y423 PolarHBondContact N-OH 2.93Å; Y410-Y423 WeakPolarHBondContact O-CE1 3.48Å; Y410-Y423 PolarHBondContact O-OH 2.95Å; L412-Y423 HydrophobicContact CD1-CD1 3.8Å; L412-Y423 HydrophobicContact CD1-CD2 3.69Å; L412-Y423 HydrophobicContact CD1-CE1 3.73Å; L412-Y423 HydrophobicContact CD1-CE2 3.64Å; L412-Y423 HydrophobicContact CD1-CG 3.79Å; L412-Y423 HydrophobicContact CG-CD1 4.32Å; L412-Y423 HydrophobicContact CG-CE1 4.05Å; Y423-I427 HydrophobicContact CD1-CD1 4.47Å; Y423-I427 HydrophobicContact CG-CD1 4.12Å; Y423-I783 HydrophobicContact CD1-CG2 3.82Å; Y423-I783 HydrophobicContact CE1-CG2 4.02Å
424	R	78.8	Confident	76	Confident	164 Å²	164	97.9 Å²	97.9	62%	0.619	45%	0.45	S	S	*	.			trans	-63.4	140.7	171.1	-165.7	175.6	-172.7	175	0.2	110.4	R426 I427 I783	R424-R426 PolarHBondContact O-N 3.34Å; R424-R426 VanDerWaalsContact O-N 3.13Å; R424-I427 HydrophobicContact CB-CG1 4.29Å; R424-I427 WeakPolarHBondContact O-CD1 3.35Å; R424-I783 PolarHBondContact N-O 2.96Å
425	K	73.8	Confident	76.2	Confident	224 Å²	224	95.7 Å²	95.7	97%	0.974	44%	0.439	S	S	*	.	S	Bend	trans	-60.6	-22.3	-178.9	-69.5	-175	179.6	179.3	0	114.4
426	R	73.6	Confident	76.1	Confident	224 Å²	224	100.6 Å²	100.6	85%	0.845	46%	0.461	S	S	*	.			trans	-126.3	114	177.7	-156.6	-176.8	-65.4	-162.4	3	107.2	R424	R424-R426 PolarHBondContact O-N 3.34Å; R424-R426 VanDerWaalsContact O-N 3.13Å
427	I	77.3	Confident	76.3	Confident	58 Å²	58	106.7 Å²	106.7	30%	0.297	49%	0.493	S	S	.	.			trans	-131.9	142.6	177	-70	164.8	0	0	0	105.9	Y423 R424 V431 I783	Y423-I427 HydrophobicContact CD1-CD1 4.47Å; Y423-I427 HydrophobicContact CG-CD1 4.12Å; R424-I427 HydrophobicContact CB-CG1 4.29Å; R424-I427 WeakPolarHBondContact O-CD1 3.35Å; I427-V431 HydrophobicContact CG2-CB 4.16Å; I427-V431 HydrophobicContact CG2-CG1 4.36Å; I427-I783 HydrophobicContact CD1-CG2 3.6Å; I427-I783 HydrophobicContact CG1-CG2 4.24Å
428	D	76.8	Confident	76.1	Confident	90 Å²	90	102.3 Å²	102.3	48%	0.481	48%	0.476	S	S	.	.			trans	-64.7	146.6	179.1	167.1	57	0	0	0	112.7	Y430 V431 K432	D428-Y430 PolarHBondContact O-N 3.42Å; D428-Y430 VanDerWaalsContact OD2-CB 3.24Å; D428-Y430 WeakPolarHBondContact OD2-CB 3.49Å; D428-Y430 PolarHBondContact OD2-N 2.9Å; D428-V431 HydrophobicContact CB-CG2 4.06Å; D428-V431 PolarHBondContact O-N 3.31Å; D428-K432 WeakPolarHBondContact O-CB 3.36Å; D428-K432 PolarHBondContact O-N 2.87Å
429	S	74.4	Confident	75.8	Confident	92 Å²	92	101.7 Å²	101.7	64%	0.643	47%	0.473	S	S	*	.	H	α-helix	trans	-60.5	-36.6	-177	65.1	0	0	0	0	114	R433	S429-R433 WeakPolarHBondContact O-CB 3.1Å; S429-R433 PolarHBondContact O-N 3.36Å
430	Y	78.8	Confident	75.7	Confident	131 Å²	131	104.1 Å²	104.1	51%	0.514	49%	0.486	S	S	.	.	H	α-helix	trans	-68.6	-48.8	177.6	179.5	-91.8	0	0	0	110.3	D428 K432 R433 Q434	D428-Y430 PolarHBondContact O-N 3.42Å; D428-Y430 VanDerWaalsContact OD2-CB 3.24Å; D428-Y430 WeakPolarHBondContact OD2-CB 3.49Å; D428-Y430 PolarHBondContact OD2-N 2.9Å; Y430-K432 PolarHBondContact O-N 3.17Å; Y430-R433 PolarHBondContact O-N 2.7Å; Y430-R433 VanDerWaalsContact O-N 3.17Å; Y430-Q434 PolarHBondContact O-N 3.12Å
431	V	76.8	Confident	75.9	Confident	16 Å²	16	101.6 Å²	101.6	10%	0.097	47%	0.469	C	S	.	.	H	α-helix	trans	-58.2	-47.4	177.8	-168.9	0	0	0	0	111.2	I427 D428 R433 Q434 I435 I783 V833 F835	I427-V431 HydrophobicContact CG2-CB 4.16Å; I427-V431 HydrophobicContact CG2-CG1 4.36Å; D428-V431 HydrophobicContact CB-CG2 4.06Å; D428-V431 PolarHBondContact O-N 3.31Å; V431-R433 VanDerWaalsContact C-N 3.34Å; V431-R433 PolarHBondContact O-N 2.94Å; V431-Q434 PolarHBondContact O-N 3.39Å; V431-I435 HydrophobicContact CG1-CD1 4.19Å; V431-I435 WeakPolarHBondContact O-CG1 3.41Å; V431-I435 PolarHBondContact O-N 2.65Å; V431-I435 VanDerWaalsContact O-N 3.09Å; V431-I783 HydrophobicContact CG1-CD1 4.13Å; V431-V833 HydrophobicContact CG1-CG1 4.36Å; V431-F835 HydrophobicContact CB-CE1 4.22Å; V431-F835 HydrophobicContact CG1-CE1 3.9Å; V431-F835 HydrophobicContact CG1-CZ 4.16Å; V431-F835 HydrophobicContact CG2-CD1 4.11Å; V431-F835 HydrophobicContact CG2-CE1 3.53Å; V431-F835 HydrophobicContact CG2-CZ 4.26Å
432	K	77.8	Confident	76.3	Confident	115 Å²	115	108.4 Å²	108.4	50%	0.5	50%	0.495	S	S	.	.	H	α-helix	trans	-59.4	-44.4	177.1	179.2	178.6	170.6	-176.1	0	111.6	D428 Y430 I435 E436	D428-K432 WeakPolarHBondContact O-CB 3.36Å; D428-K432 PolarHBondContact O-N 2.87Å; Y430-K432 PolarHBondContact O-N 3.17Å; K432-I435 PolarHBondContact O-N 2.95Å; K432-E436 WeakPolarHBondContact CE-OE1 3.5Å; K432-E436 IonicContact NZ-OE1 3.4Å; K432-E436 WeakPolarHBondContact O-CG 3.43Å; K432-E436 PolarHBondContact O-N 2.96Å
433	R	74.4	Confident	76.8	Confident	189 Å²	189	104.7 Å²	104.7	71%	0.713	47%	0.472	S	S	*	.	H	α-helix	trans	-63.1	-42.5	178.2	-171.9	175	-177.4	165.1	0.6	111.7	S429 Y430 V431 I435 E436 D437	S429-R433 WeakPolarHBondContact O-CB 3.1Å; S429-R433 PolarHBondContact O-N 3.36Å; Y430-R433 PolarHBondContact O-N 2.7Å; Y430-R433 VanDerWaalsContact O-N 3.17Å; V431-R433 VanDerWaalsContact C-N 3.34Å; V431-R433 PolarHBondContact O-N 2.94Å; R433-I435 VanDerWaalsContact C-N 3.3Å; R433-I435 PolarHBondContact O-N 3.38Å; R433-E436 PolarHBondContact O-N 3.47Å; R433-D437 WeakPolarHBondContact O-CB 3.4Å; R433-D437 PolarHBondContact O-N 2.68Å
434	Q	73.7	Confident	77.4	Confident	56 Å²	56	107.3 Å²	107.3	26%	0.262	49%	0.485	S	S	.	.	H	α-helix	trans	-63.4	-34.1	177.3	-169.5	171.1	9.7	0	0	112.6	Y430 V431 V833	Y430-Q434 PolarHBondContact O-N 3.12Å; V431-Q434 PolarHBondContact O-N 3.39Å; Q434-V833 HydrophobicContact CG-CG1 4.4Å
435	I	76.1	Confident	78.2	Confident	31 Å²	31	100.1 Å²	100.1	16%	0.159	46%	0.458	C	S	.	.	H	α-helix	trans	-71.6	-38.5	173.4	-66.3	165.7	0	0	0	111.7	V431 K432 R433 I783	V431-I435 HydrophobicContact CG1-CD1 4.19Å; V431-I435 WeakPolarHBondContact O-CG1 3.41Å; V431-I435 PolarHBondContact O-N 2.65Å; V431-I435 VanDerWaalsContact O-N 3.09Å; K432-I435 PolarHBondContact O-N 2.95Å; R433-I435 VanDerWaalsContact C-N 3.3Å; R433-I435 PolarHBondContact O-N 3.38Å; I435-I783 HydrophobicContact CD1-CD1 4.25Å
436	E	71	Confident	79.3	Confident	118 Å²	118	89.4 Å²	89.4	55%	0.551	41%	0.412	S	S	*	.	H	α-helix	trans	-71.4	-30.9	178.5	-73.5	177.6	178.6	0	0	113	K407 K432 R433	K407-E436 PolarHBondContact NZ-O 2.93Å; K432-E436 WeakPolarHBondContact CE-OE1 3.5Å; K432-E436 IonicContact NZ-OE1 3.4Å; K432-E436 WeakPolarHBondContact O-CG 3.43Å; K432-E436 PolarHBondContact O-N 2.96Å; R433-E436 PolarHBondContact O-N 3.47Å
437	D	72.7	Confident	80.3	Confident	131 Å²	131	84.2 Å²	84.2	70%	0.701	39%	0.393	S	S	*	.	H	α-helix	trans	-76.2	-23.4	-178.8	-151.3	46.4	0	0	0	113.4	R433	R433-D437 WeakPolarHBondContact O-CB 3.4Å; R433-D437 PolarHBondContact O-N 2.68Å
438	M	72	Confident	81.2	Confident	56 Å²	56	87.8 Å²	87.8	28%	0.276	40%	0.403	S	S	.	.	S	Bend	trans	-66.2	137.7	-173.7	-152.6	179.7	81.4	0	0	113.7	K407 Y410 L729	K407-M438 PolarHBondContact NZ-O 2.82Å; Y410-M438 HydrophobicContact CD2-CE 3.74Å; Y410-M438 HydrophobicContact CD2-SD 4.15Å; Y410-M438 HydrophobicContact CE2-CE 3.88Å; Y410-M438 HydrophobicContact CE2-SD 4Å; M438-L729 HydrophobicContact CE-CD1 3.6Å; M438-L729 HydrophobicContact CE-CG 3.92Å; M438-L729 WeakPolarHBondContact CE-O 3.42Å
439	D	70.2	Confident	82.2	Confident	118 Å²	118	83.6 Å²	83.6	63%	0.631	38%	0.381	S	S	*	.			trans	-79.7	130.7	-173.5	-78.6	-50.9	0	0	0	114.9	H441	D439-H441 PolarHBondContact O-N 3.36Å; D439-H441 PolarHBondContact O-ND1 3.41Å
440	D	72.1	Confident	83.2	Confident	65 Å²	65	79.5 Å²	79.5	35%	0.348	35%	0.351	S	S	.	.			trans	-73.4	111.7	168.8	-68.7	-81.8	0	0	0	111	K407 R408	K407-D440 WeakPolarHBondContact CA-OD1 3.42Å; K407-D440 WeakPolarHBondContact CA-OD2 3.43Å; K407-D440 WeakPolarHBondContact CB-OD2 3.41Å; K407-D440 VanDerWaalsContact CD-OD2 3.23Å; K407-D440 WeakPolarHBondContact CD-OD2 3.42Å; K407-D440 WeakPolarHBondContact CG-OD2 3.37Å; R408-D440 PolarHBondContact N-OD1 3.02Å
441	H	83.4	Confident	84.1	Confident	78 Å²	78	79.5 Å²	79.5	36%	0.361	35%	0.354	S	S	.	.			trans	-77.5	152.4	176.7	-68.7	66.6	0	0	0	111.6	D439 E727 K728 G731	D439-H441 PolarHBondContact O-N 3.36Å; D439-H441 PolarHBondContact O-ND1 3.41Å; H441-E727 WeakPolarHBondContact CB-O 3.41Å; H441-K728 PolarHBondContact N-O 3.01Å; H441-G731 WeakPolarHBondContact CD2-CA 3.4Å
442	R	87.1	Confident	85.1	Confident	166 Å²	166	79.9 Å²	79.9	63%	0.626	36%	0.357	S	S	*	.			trans	-83.6	130.5	171.2	-68.7	-175.4	-179.6	-142	3.8	109	F444	R442-F444 VanDerWaalsContact C-N 3.25Å; R442-F444 HydrophobicContact CB-CD2 3.89Å; R442-F444 HydrophobicContact CB-CE1 4.34Å; R442-F444 HydrophobicContact CB-CE2 3.56Å; R442-F444 HydrophobicContact CB-CG 4.43Å; R442-F444 HydrophobicContact CB-CZ 3.82Å; R442-F444 HydrophobicContact CG-CE2 4.37Å; R442-F444 HydrophobicContact CG-CZ 4.36Å; R442-F444 PolarHBondContact O-N 3.01Å
443	P	91.9	Very high	86	Confident	7 Å²	7	74.4 Å²	74.4	5%	0.045	33%	0.333	C	S	.	.			trans	-81.5	69.2	-175.1	32.8	-35.4	0	0	0	111.7	Y447 R724 E727 K728	P443-Y447 HydrophobicContact CG-CD2 4.42Å; P443-Y447 HydrophobicContact CG-CE2 3.81Å; P443-Y447 WeakPolarHBondContact O-CD2 3.45Å; P443-Y447 PolarHBondContact O-N 3.21Å; P443-R724 HydrophobicContact CB-CG 3.82Å; P443-R724 HydrophobicContact CG-CG 3.76Å; P443-E727 VanDerWaalsContact C-CD 3.47Å; P443-E727 VanDerWaalsContact C-OE2 3.25Å; P443-E727 VanDerWaalsContact CA-OE1 3.25Å; P443-E727 WeakPolarHBondContact CA-OE1 3.4Å; P443-E727 WeakPolarHBondContact CA-OE2 3.35Å; P443-E727 HydrophobicContact CB-CB 4.11Å; P443-E727 HydrophobicContact CB-CG 4.42Å; P443-E727 WeakPolarHBondContact CB-OE2 3.47Å; P443-K728 HydrophobicContact CG-CG 4.4Å
444	F	93.4	Very high	87.1	Confident	124 Å²	124	69.1 Å²	69.1	54%	0.544	32%	0.319	S	S	.	.	H	α-helix	trans	-71.4	-42.6	-178.2	-68.9	-62.9	0	0	0	112.6	R442 T446 Y447 W448 E727	R442-F444 VanDerWaalsContact C-N 3.25Å; R442-F444 HydrophobicContact CB-CD2 3.89Å; R442-F444 HydrophobicContact CB-CE1 4.34Å; R442-F444 HydrophobicContact CB-CE2 3.56Å; R442-F444 HydrophobicContact CB-CG 4.43Å; R442-F444 HydrophobicContact CB-CZ 3.82Å; R442-F444 HydrophobicContact CG-CE2 4.37Å; R442-F444 HydrophobicContact CG-CZ 4.36Å; R442-F444 PolarHBondContact O-N 3.01Å; F444-T446 VanDerWaalsContact C-N 3.35Å; F444-T446 PolarHBondContact O-N 3.37Å; F444-Y447 PolarHBondContact O-N 2.9Å; F444-W448 WeakPolarHBondContact O-CB 3.28Å; F444-W448 PolarHBondContact O-N 3.44Å; F444-E727 PolarHBondContact N-OE1 3.29Å
445	F	95.6	Very high	88.2	Confident	13 Å²	13	70.2 Å²	70.2	6%	0.057	33%	0.326	C	S	.	.	H	α-helix	trans	-62.3	-43.1	179.6	174.3	-109.3	0	0	0	110.8	Y447 W448 I449 L723 E727 W732 I735 S736 Y739	F445-Y447 VanDerWaalsContact C-N 3.34Å; F445-Y447 PolarHBondContact O-N 2.92Å; F445-W448 AromaticContact CD2-CE3 3.98Å; F445-W448 HydrophobicContact CD2-CE3 3.98Å; F445-W448 HydrophobicContact CD2-CZ3 4.33Å; F445-W448 HydrophobicContact CE2-CE3 4.01Å; F445-W448 AromaticContact CE2-CZ3 3.94Å; F445-W448 HydrophobicContact CE2-CZ3 3.94Å; F445-W448 PolarHBondContact O-N 2.91Å; F445-I449 HydrophobicContact CE2-CB 4.43Å; F445-I449 HydrophobicContact CZ-CB 4.39Å; F445-I449 HydrophobicContact CZ-CG1 4.42Å; F445-I449 WeakPolarHBondContact O-CB 3.35Å; F445-I449 VanDerWaalsContact O-CG2 3.26Å; F445-I449 WeakPolarHBondContact O-CG2 3.33Å; F445-I449 PolarHBondContact O-N 3Å; F445-L723 HydrophobicContact CD1-CD2 4.28Å; F445-L723 HydrophobicContact CE1-CD2 4.12Å; F445-E727 WeakPolarHBondContact CB-OE1 3.36Å; F445-E727 PolarHBondContact N-OE1 3.05Å; F445-W732 HydrophobicContact CB-CB 4.17Å; F445-I735 HydrophobicContact CD1-CG2 4.32Å; F445-S736 VanDerWaalsContact CD2-CB 3.49Å; F445-Y739 HydrophobicContact CE1-CD1 4.06Å; F445-Y739 HydrophobicContact CE1-CD2 4.17Å; F445-Y739 AromaticContact CE1-CG 3.81Å; F445-Y739 HydrophobicContact CE1-CG 3.81Å; F445-Y739 AromaticContact CZ-CD1 3.68Å; F445-Y739 HydrophobicContact CZ-CD1 3.68Å; F445-Y739 HydrophobicContact CZ-CE1 4.19Å; F445-Y739 AromaticContact CZ-CG 3.9Å; F445-Y739 HydrophobicContact CZ-CG 3.9Å
446	T	95.4	Very high	89.1	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-62.4	-39.7	177.7	-54.5	0	0	0	0	112.3	F444 I449 T450 Q719 L723 R724 E727	F444-T446 VanDerWaalsContact C-N 3.35Å; F444-T446 PolarHBondContact O-N 3.37Å; T446-I449 WeakPolarHBondContact O-CG2 3.47Å; T446-T450 HydrophobicContact CG2-CG2 4.43Å; T446-T450 WeakPolarHBondContact O-CB 3.4Å; T446-T450 VanDerWaalsContact O-CG2 3.31Å; T446-T450 WeakPolarHBondContact O-CG2 3.13Å; T446-T450 PolarHBondContact O-N 2.97Å; T446-T450 PolarHBondContact O-OG1 3.27Å; T446-Q719 HydrophobicContact CG2-CB 4.38Å; T446-Q719 WeakPolarHBondContact CG2-O 3.4Å; T446-L723 HydrophobicContact CG2-CB 4.42Å; T446-L723 HydrophobicContact CG2-CD2 4.24Å; T446-L723 HydrophobicContact CG2-CG 4.49Å; T446-R724 HydrophobicContact CG2-CB 3.76Å; T446-R724 HydrophobicContact CG2-CG 4.3Å; T446-R724 WeakPolarHBondContact OG1-CA 3.33Å; T446-R724 PolarHBondContact OG1-N 2.9Å; T446-E727 VanDerWaalsContact CB-OE2 3.22Å; T446-E727 WeakPolarHBondContact CB-OE2 3.46Å; T446-E727 PolarHBondContact N-OE2 3.34Å; T446-E727 PolarHBondContact OG1-OE2 3.14Å
447	Y	95.9	Very high	90.3	Very high	115 Å²	115	65.7 Å²	65.7	45%	0.451	31%	0.305	S	S	.	.	H	α-helix	trans	-71.6	-34.5	176.4	-67.9	-47.6	0	0	0	112.6	P443 F444 F445 T450 F451 M720	P443-Y447 HydrophobicContact CG-CD2 4.42Å; P443-Y447 HydrophobicContact CG-CE2 3.81Å; P443-Y447 WeakPolarHBondContact O-CD2 3.45Å; P443-Y447 PolarHBondContact O-N 3.21Å; F444-Y447 PolarHBondContact O-N 2.9Å; F445-Y447 VanDerWaalsContact C-N 3.34Å; F445-Y447 PolarHBondContact O-N 2.92Å; Y447-T450 PolarHBondContact O-OG1 3.49Å; Y447-F451 WeakPolarHBondContact O-CB 3.28Å; Y447-F451 PolarHBondContact O-N 3.43Å; Y447-M720 HydrophobicContact CD1-CE 4.16Å; Y447-M720 HydrophobicContact CD1-SD 4.37Å; Y447-M720 HydrophobicContact CE1-CE 4.4Å; Y447-M720 HydrophobicContact CE1-SD 4.19Å
448	W	96.8	Very high	91.4	Very high	133 Å²	133	64.2 Å²	64.2	50%	0.504	30%	0.297	S	S	.	.	H	α-helix	trans	-68.6	-51.9	175.6	175.3	80.1	0	0	0	111.7	F444 F445 T450 F451 V452 F704	F444-W448 WeakPolarHBondContact O-CB 3.28Å; F444-W448 PolarHBondContact O-N 3.44Å; F445-W448 AromaticContact CD2-CE3 3.98Å; F445-W448 HydrophobicContact CD2-CE3 3.98Å; F445-W448 HydrophobicContact CD2-CZ3 4.33Å; F445-W448 HydrophobicContact CE2-CE3 4.01Å; F445-W448 AromaticContact CE2-CZ3 3.94Å; F445-W448 HydrophobicContact CE2-CZ3 3.94Å; F445-W448 PolarHBondContact O-N 2.91Å; W448-T450 PolarHBondContact O-N 2.99Å; W448-F451 WeakPolarHBondContact O-CB 3.44Å; W448-F451 PolarHBondContact O-N 3.22Å; W448-V452 HydrophobicContact CD2-CG2 4.25Å; W448-V452 HydrophobicContact CZ2-CG2 4.03Å; W448-V452 WeakPolarHBondContact O-CG2 3.19Å; W448-V452 PolarHBondContact O-N 3.14Å; W448-F704 AromaticContact CH2-CE1 3.8Å; W448-F704 HydrophobicContact CH2-CE1 3.8Å; W448-F704 HydrophobicContact CH2-CZ 4.23Å; W448-F704 HydrophobicContact CZ3-CE1 4.05Å
449	I	96.6	Very high	92.6	Very high	2 Å²	2	65.8 Å²	65.8	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-63.9	-40	-176.9	-164.7	63.9	0	0	0	111.8	F445 T446 F451 V452 H453 F704 L723 Y739	F445-I449 HydrophobicContact CE2-CB 4.43Å; F445-I449 HydrophobicContact CZ-CB 4.39Å; F445-I449 HydrophobicContact CZ-CG1 4.42Å; F445-I449 WeakPolarHBondContact O-CB 3.35Å; F445-I449 VanDerWaalsContact O-CG2 3.26Å; F445-I449 WeakPolarHBondContact O-CG2 3.33Å; F445-I449 PolarHBondContact O-N 3Å; T446-I449 WeakPolarHBondContact O-CG2 3.47Å; I449-F451 PolarHBondContact O-N 2.04Å; I449-V452 PolarHBondContact O-N 2.9Å; I449-H453 VanDerWaalsContact CG1-CE1 3.42Å; I449-H453 WeakPolarHBondContact CG1-CE1 3.29Å; I449-H453 PolarHBondContact O-N 3.38Å; I449-H453 PolarHBondContact O-ND1 3.2Å; I449-F704 HydrophobicContact CD1-CD1 3.56Å; I449-F704 HydrophobicContact CD1-CE1 3.39Å; I449-L723 HydrophobicContact CG2-CD2 4.03Å; I449-Y739 HydrophobicContact CD1-CE1 4.28Å; I449-Y739 HydrophobicContact CG1-CE1 4.1Å
450	T	96.3	Very high	93.7	Very high	5 Å²	5	60.5 Å²	60.5	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-68.4	-34	175.9	51.3	0	0	0	0	112.9	T446 Y447 W448 L454 V716 Q719 M720	T446-T450 HydrophobicContact CG2-CG2 4.43Å; T446-T450 WeakPolarHBondContact O-CB 3.4Å; T446-T450 VanDerWaalsContact O-CG2 3.31Å; T446-T450 WeakPolarHBondContact O-CG2 3.13Å; T446-T450 PolarHBondContact O-N 2.97Å; T446-T450 PolarHBondContact O-OG1 3.27Å; Y447-T450 PolarHBondContact O-OG1 3.49Å; W448-T450 PolarHBondContact O-N 2.99Å; T450-L454 WeakPolarHBondContact O-CD1 3.4Å; T450-L454 VanDerWaalsContact O-CG 3.26Å; T450-L454 WeakPolarHBondContact O-CG 3.44Å; T450-L454 PolarHBondContact O-N 3.34Å; T450-L454 VanDerWaalsContact O-N 3.16Å; T450-V716 HydrophobicContact CG2-CG1 4.2Å; T450-V716 HydrophobicContact CG2-CG2 4.33Å; T450-Q719 HydrophobicContact CG2-CB 3.58Å; T450-Q719 HydrophobicContact CG2-CG 4.42Å; T450-M720 HydrophobicContact CG2-CE 4.02Å; T450-M720 HydrophobicContact CG2-CG 4.41Å; T450-M720 VanDerWaalsContact OG1-CE 3.31Å; T450-M720 WeakPolarHBondContact OG1-CE 3.29Å
451	F	97.2	Very high	94.8	Very high	131 Å²	131	58.5 Å²	58.5	58%	0.575	27%	0.269	S	S	*	.	H	α-helix	trans	-65.9	-44.6	171.8	173.6	-98	0	0	0	111.6	Y447 W448 I449 L454 L455	Y447-F451 WeakPolarHBondContact O-CB 3.28Å; Y447-F451 PolarHBondContact O-N 3.43Å; W448-F451 WeakPolarHBondContact O-CB 3.44Å; W448-F451 PolarHBondContact O-N 3.22Å; I449-F451 PolarHBondContact O-N 2.04Å; F451-L454 PolarHBondContact O-N 2.98Å; F451-L455 HydrophobicContact CE1-CD2 4.09Å; F451-L455 HydrophobicContact CZ-CD2 4.3Å; F451-L455 WeakPolarHBondContact O-CB 3.4Å; F451-L455 PolarHBondContact O-N 3.47Å
452	V	97.1	Very high	95.4	Very high	24 Å²	24	59.6 Å²	59.6	15%	0.145	28%	0.284	C	S	.	.	H	α-helix	trans	-60.6	-45.9	177.7	170.2	0	0	0	0	111.3	W448 I449 L454 L455 I456 F704	W448-V452 HydrophobicContact CD2-CG2 4.25Å; W448-V452 HydrophobicContact CZ2-CG2 4.03Å; W448-V452 WeakPolarHBondContact O-CG2 3.19Å; W448-V452 PolarHBondContact O-N 3.14Å; I449-V452 PolarHBondContact O-N 2.9Å; V452-L454 PolarHBondContact O-N 3.34Å; V452-L455 PolarHBondContact O-N 2.84Å; V452-I456 HydrophobicContact CG1-CD1 3.58Å; V452-I456 HydrophobicContact CG1-CG1 4.39Å; V452-I456 WeakPolarHBondContact O-CB 3.24Å; V452-I456 WeakPolarHBondContact O-CG1 3.21Å; V452-I456 PolarHBondContact O-N 3.12Å; V452-F704 HydrophobicContact CG1-CB 4.37Å; V452-F704 HydrophobicContact CG1-CD1 3.68Å; V452-F704 HydrophobicContact CG1-CE1 4.37Å; V452-F704 HydrophobicContact CG1-CG 4.35Å
453	H	97	Very high	95.7	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.9	-45.2	176.8	-64.7	159.6	0	0	0	113.3	I449 T457 L703 F704 H706 Q719 Y739	I449-H453 VanDerWaalsContact CG1-CE1 3.42Å; I449-H453 WeakPolarHBondContact CG1-CE1 3.29Å; I449-H453 PolarHBondContact O-N 3.38Å; I449-H453 PolarHBondContact O-ND1 3.2Å; H453-T457 VanDerWaalsContact O-CB 3.3Å; H453-T457 WeakPolarHBondContact O-CB 3.45Å; H453-T457 PolarHBondContact O-N 2.83Å; H453-T457 PolarHBondContact O-OG1 2.85Å; H453-L703 PolarHBondContact NE2-O 3.03Å; H453-F704 PolarHBondContact CD2-O 2.88Å; H453-H706 AromaticContact CD2-CE1 3.56Å; H453-H706 AromaticContact CE1-CE1 3.91Å; H453-H706 AromaticContact CG-CE1 3.42Å; H453-H706 VanDerWaalsContact CG-CE1 3.42Å; H453-H706 AromaticContact ND1-CE1 3.68Å; H453-H706 AromaticContact NE2-CE1 3.89Å; H453-Q719 PolarHBondContact CE1-NE2 3.26Å; H453-Q719 VanDerWaalsContact CE1-NE2 3.31Å; H453-Q719 PolarHBondContact CE1-OE1 2.86Å; H453-Q719 PolarHBondContact ND1-NE2 3.28Å; H453-Q719 PolarHBondContact ND1-OE1 3.47Å; H453-Y739 PolarHBondContact CE1-OH 3.26Å
454	L	97	Very high	95.7	Very high	79 Å²	79	61 Å²	61	41%	0.414	30%	0.297	S	S	.	.	H	α-helix	trans	-63.5	-45	177.8	-71.7	168.3	0	0	0	111	T450 F451 V452 I458 V716	T450-L454 WeakPolarHBondContact O-CD1 3.4Å; T450-L454 VanDerWaalsContact O-CG 3.26Å; T450-L454 WeakPolarHBondContact O-CG 3.44Å; T450-L454 PolarHBondContact O-N 3.34Å; T450-L454 VanDerWaalsContact O-N 3.16Å; F451-L454 PolarHBondContact O-N 2.98Å; V452-L454 PolarHBondContact O-N 3.34Å; L454-I458 WeakPolarHBondContact O-CB 3.4Å; L454-I458 WeakPolarHBondContact O-CD1 3.47Å; L454-I458 WeakPolarHBondContact O-CG1 3.27Å; L454-I458 PolarHBondContact O-N 3.46Å; L454-V716 HydrophobicContact CD2-CG2 4.32Å; L454-V716 HydrophobicContact CG-CG2 4.24Å
455	L	97.2	Very high	95.6	Very high	78 Å²	78	56.7 Å²	56.7	41%	0.408	29%	0.286	S	S	.	.	H	α-helix	trans	-61.7	-49.4	178.3	179.1	61.2	0	0	0	112	F451 V452 I458 L459	F451-L455 HydrophobicContact CE1-CD2 4.09Å; F451-L455 HydrophobicContact CZ-CD2 4.3Å; F451-L455 WeakPolarHBondContact O-CB 3.4Å; F451-L455 PolarHBondContact O-N 3.47Å; V452-L455 PolarHBondContact O-N 2.84Å; L455-I458 PolarHBondContact O-N 3.04Å; L455-L459 HydrophobicContact CD1-CD1 3.98Å; L455-L459 HydrophobicContact CD1-CG 4.29Å; L455-L459 HydrophobicContact CG-CD1 4.01Å; L455-L459 WeakPolarHBondContact O-CB 3.26Å; L455-L459 VanDerWaalsContact O-CG 3.31Å; L455-L459 WeakPolarHBondContact O-CG 3.4Å; L455-L459 PolarHBondContact O-N 3.19Å
456	I	96.4	Very high	95.5	Very high	45 Å²	45	60.5 Å²	60.5	23%	0.231	31%	0.306	C	S	.	.	H	α-helix	trans	-66.1	-41.9	-179	-71.2	173.4	0	0	0	111.3	V452 I458 L459 A460 F704 L705	V452-I456 HydrophobicContact CG1-CD1 3.58Å; V452-I456 HydrophobicContact CG1-CG1 4.39Å; V452-I456 WeakPolarHBondContact O-CB 3.24Å; V452-I456 WeakPolarHBondContact O-CG1 3.21Å; V452-I456 PolarHBondContact O-N 3.12Å; I456-I458 PolarHBondContact O-N 3.26Å; I456-L459 PolarHBondContact O-N 3.3Å; I456-A460 WeakPolarHBondContact O-CB 3.31Å; I456-A460 PolarHBondContact O-N 3.35Å; I456-F704 HydrophobicContact CD1-CB 3.82Å; I456-L705 HydrophobicContact CG2-CD2 3.82Å
457	T	95.8	Very high	95.2	Very high	9 Å²	9	60.8 Å²	60.8	6%	0.055	31%	0.309	C	S	.	.	H	α-helix	trans	-64.7	-40.5	178.3	-52.1	0	0	0	0	111.5	H453 V461 C712	H453-T457 VanDerWaalsContact O-CB 3.3Å; H453-T457 WeakPolarHBondContact O-CB 3.45Å; H453-T457 PolarHBondContact O-N 2.83Å; H453-T457 PolarHBondContact O-OG1 2.85Å; T457-V461 WeakPolarHBondContact O-CG2 3.27Å; T457-V461 PolarHBondContact O-N 3.23Å; T457-V461 VanDerWaalsContact O-N 3.15Å; T457-C712 HydrophobicContact CG2-CB 3.86Å; T457-C712 PolarHBondContact OG1-SG 2.98Å
458	I	95.9	Very high	94.7	Very high	101 Å²	101	57.3 Å²	57.3	52%	0.518	30%	0.3	S	S	.	.	H	α-helix	trans	-63	-48.5	174.5	-70.4	165.2	0	0	0	110.3	L454 L455 I456 A460 V461 C462	L454-I458 WeakPolarHBondContact O-CB 3.4Å; L454-I458 WeakPolarHBondContact O-CD1 3.47Å; L454-I458 WeakPolarHBondContact O-CG1 3.27Å; L454-I458 PolarHBondContact O-N 3.46Å; L455-I458 PolarHBondContact O-N 3.04Å; I456-I458 PolarHBondContact O-N 3.26Å; I458-A460 PolarHBondContact O-N 3.37Å; I458-V461 PolarHBondContact O-N 3.48Å; I458-C462 VanDerWaalsContact O-CB 3.3Å; I458-C462 WeakPolarHBondContact O-CB 3.43Å; I458-C462 PolarHBondContact O-N 2.97Å; I458-C462 PolarHBondContact O-SG 2.87Å
459	L	95.8	Very high	94.2	Very high	88 Å²	88	54.8 Å²	54.8	46%	0.461	30%	0.3	S	S	.	.	H	α-helix	trans	-62.2	-42.8	179.6	-71.6	170.5	0	0	0	112.4	L455 I456 C462 I463	L455-L459 HydrophobicContact CD1-CD1 3.98Å; L455-L459 HydrophobicContact CD1-CG 4.29Å; L455-L459 HydrophobicContact CG-CD1 4.01Å; L455-L459 WeakPolarHBondContact O-CB 3.26Å; L455-L459 VanDerWaalsContact O-CG 3.31Å; L455-L459 WeakPolarHBondContact O-CG 3.4Å; L455-L459 PolarHBondContact O-N 3.19Å; I456-L459 PolarHBondContact O-N 3.3Å; L459-C462 PolarHBondContact O-N 3.4Å; L459-I463 WeakPolarHBondContact O-CB 3.01Å; L459-I463 VanDerWaalsContact O-CG1 3.26Å; L459-I463 WeakPolarHBondContact O-CG1 3.5Å; L459-I463 PolarHBondContact O-N 3.4Å
460	A	94.8	Very high	93.5	Very high	7 Å²	7	55.4 Å²	55.4	6%	0.058	31%	0.307	C	S	.	.	H	α-helix	trans	-59.6	-47.9	177.7	0	0	0	0	0	111.9	I456 I458 I463 Y464 L510	I456-A460 WeakPolarHBondContact O-CB 3.31Å; I456-A460 PolarHBondContact O-N 3.35Å; I458-A460 PolarHBondContact O-N 3.37Å; A460-I463 PolarHBondContact O-N 3.25Å; A460-Y464 PolarHBondContact O-N 3.01Å; A460-L510 HydrophobicContact CB-CD1 3.7Å
461	V	94.8	Very high	92.5	Very high	24 Å²	24	61.3 Å²	61.3	15%	0.145	33%	0.332	C	S	.	.	H	α-helix	trans	-68.4	-36.1	177.8	173.1	0	0	0	0	112.1	T457 I458 G465 I466 I709	T457-V461 WeakPolarHBondContact O-CG2 3.27Å; T457-V461 PolarHBondContact O-N 3.23Å; T457-V461 VanDerWaalsContact O-N 3.15Å; I458-V461 PolarHBondContact O-N 3.48Å; V461-G465 VanDerWaalsContact O-CA 3.22Å; V461-G465 WeakPolarHBondContact O-CA 3.31Å; V461-G465 PolarHBondContact O-N 3.38Å; V461-I466 HydrophobicContact CG1-CD1 4.02Å; V461-I466 HydrophobicContact CG1-CG1 3.71Å; V461-I709 HydrophobicContact CG2-CG1 4.29Å
462	C	94.7	Very high	91.4	Very high	101 Å²	101	58.5 Å²	58.5	68%	0.682	33%	0.329	S	S	*	.	H	α-helix	trans	-72.4	-23.8	177.9	-73.5	0	0	0	0	114.2	I458 L459	I458-C462 VanDerWaalsContact O-CB 3.3Å; I458-C462 WeakPolarHBondContact O-CB 3.43Å; I458-C462 PolarHBondContact O-N 2.97Å; I458-C462 PolarHBondContact O-SG 2.87Å; L459-C462 PolarHBondContact O-N 3.4Å
463	I	94.4	Very high	90.4	Very high	119 Å²	119	60.9 Å²	60.9	61%	0.61	34%	0.338	S	S	*	.	H	α-helix	trans	-96.2	-45.7	-179	-65	167.1	0	0	0	111.5	L459 A460	L459-I463 WeakPolarHBondContact O-CB 3.01Å; L459-I463 VanDerWaalsContact O-CG1 3.26Å; L459-I463 WeakPolarHBondContact O-CG1 3.5Å; L459-I463 PolarHBondContact O-N 3.4Å; A460-I463 PolarHBondContact O-N 3.25Å
464	Y	91.8	Very high	89.6	Confident	84 Å²	84	64.7 Å²	64.7	33%	0.329	36%	0.356	S	S	.	.	H	α-helix	trans	-103.3	-0.6	-173.8	-62.9	-89.7	0	0	0	113.8	A460 H509 L510	A460-Y464 PolarHBondContact O-N 3.01Å; Y464-H509 AromaticContact CZ-ND1 3.85Å; Y464-H509 PolarHBondContact OH-CE1 3.47Å; Y464-H509 PolarHBondContact OH-ND1 3.41Å; Y464-L510 HydrophobicContact CD2-CD1 3.83Å; Y464-L510 HydrophobicContact CD2-CG 4.22Å; Y464-L510 HydrophobicContact CE2-CD1 3.83Å; Y464-L510 HydrophobicContact CE2-CD2 3.78Å; Y464-L510 HydrophobicContact CE2-CG 3.7Å
465	G	92.3	Very high	89	Confident	32 Å²	32	66.8 Å²	66.8	33%	0.33	36%	0.364	S	S	.	.			trans	72.9	-154.7	179.8	0	0	0	0	0	114	V461	V461-G465 VanDerWaalsContact O-CA 3.22Å; V461-G465 WeakPolarHBondContact O-CA 3.31Å; V461-G465 PolarHBondContact O-N 3.38Å
466	I	92.1	Very high	88.4	Confident	93 Å²	93	65.6 Å²	65.6	48%	0.477	36%	0.359	S	S	.	.			trans	-127.3	124.5	-178.7	-59.6	175.4	0	0	0	107.6	V461 V469 I500 G501	V461-I466 HydrophobicContact CG1-CD1 4.02Å; V461-I466 HydrophobicContact CG1-CG1 3.71Å; I466-V469 HydrophobicContact CG2-CG2 4.15Å; I466-I500 HydrophobicContact CD1-CG2 4.2Å; I466-I500 HydrophobicContact CG2-CG2 4.04Å; I466-G501 WeakPolarHBondContact CA-O 3.45Å
467	A	88.6	Confident	88.1	Confident	7 Å²	7	68 Å²	68	6%	0.058	38%	0.376	C	S	.	.			trans	-70	157.8	172.2	0	0	0	0	0	110.8	V469 N497 G501	A467-V469 PolarHBondContact O-N 3.29Å; A467-N497 HydrophobicContact CB-CB 4.04Å; A467-G501 PolarHBondContact N-O 2.93Å
468	P	86.5	Confident	87.8	Confident	41 Å²	41	71.9 Å²	71.9	27%	0.266	40%	0.396	S	S	.	.			trans	-52	136.1	176.7	21.8	-33.8	0	0	0	111.2	H474 E496 N497	P468-H474 HydrophobicContact CB-CB 4.4Å; P468-H474 HydrophobicContact CG-CB 3.94Å; P468-E496 HydrophobicContact CB-CG 4.21Å; P468-E496 HydrophobicContact CG-CG 4.24Å; P468-E496 CarbonylContact O-C 3.51Å; P468-E496 WeakPolarHBondContact O-CA 3.17Å; P468-E496 WeakPolarHBondContact O-CB 3.31Å; P468-N497 PolarHBondContact O-N 2.87Å
469	V	86.9	Confident	87.5	Confident	81 Å²	81	70 Å²	70	49%	0.491	39%	0.392	S	S	.	.			trans	-99.3	115.1	-169.9	180	0	0	0	0	110.1	I466 A467 I500	I466-V469 HydrophobicContact CG2-CG2 4.15Å; A467-V469 PolarHBondContact O-N 3.29Å; V469-I500 HydrophobicContact CG1-CG1 4.02Å; V469-I500 HydrophobicContact CG2-CG1 4.18Å; V469-I500 HydrophobicContact CG2-CG2 4.47Å
470	G	80.9	Confident	87.2	Confident	15 Å²	15	66.1 Å²	66.1	16%	0.155	37%	0.373	C	S	.	.	S	Bend	trans	176.2	-159	-177.7	0	0	0	0	0	111.2	E496 F498	G470-E496 VanDerWaalsContact CA-OE2 3.28Å; G470-E496 WeakPolarHBondContact CA-OE2 3.27Å; G470-F498 WeakPolarHBondContact O-CA 3.31Å; G470-F498 WeakPolarHBondContact O-CB 3.34Å; G470-F498 PolarHBondContact O-N 3.04Å; G470-F498 VanDerWaalsContact O-N 3.15Å
471	F	74.5	Confident	86.9	Confident	128 Å²	128	68.1 Å²	68.1	56%	0.561	38%	0.382	S	S	*	.	S	Bend	trans	-124.8	0.5	-179	-67.7	-85.1	0	0	0	112.8	E496 F498	F471-E496 PolarHBondContact N-OE2 2.92Å; F471-E496 VanDerWaalsContact N-OE2 3.15Å; F471-F498 HydrophobicContact CD1-CB 4.23Å; F471-F498 HydrophobicContact CD1-CG 4.37Å; F471-F498 HydrophobicContact CD2-CD2 4.4Å; F471-F498 HydrophobicContact CE1-CB 3.94Å; F471-F498 AromaticContact CE1-CD1 4Å; F471-F498 HydrophobicContact CE1-CD1 4Å; F471-F498 AromaticContact CE1-CD2 3.8Å; F471-F498 HydrophobicContact CE1-CD2 3.8Å; F471-F498 HydrophobicContact CE1-CE2 4.33Å; F471-F498 AromaticContact CE1-CG 3.61Å; F471-F498 HydrophobicContact CE1-CG 3.61Å; F471-F498 AromaticContact CE2-CD2 3.55Å; F471-F498 HydrophobicContact CE2-CD2 3.55Å; F471-F498 AromaticContact CE2-CE2 3.87Å; F471-F498 HydrophobicContact CE2-CE2 3.87Å; F471-F498 HydrophobicContact CE2-CG 4.22Å; F471-F498 HydrophobicContact CZ-CB 4.22Å; F471-F498 HydrophobicContact CZ-CD1 4.04Å; F471-F498 AromaticContact CZ-CD2 3.19Å; F471-F498 HydrophobicContact CZ-CD2 3.19Å; F471-F498 HydrophobicContact CZ-CE1 4.23Å; F471-F498 AromaticContact CZ-CE2 3.43Å; F471-F498 HydrophobicContact CZ-CE2 3.43Å; F471-F498 VanDerWaalsContact CZ-CE2 3.43Å; F471-F498 AromaticContact CZ-CG 3.53Å; F471-F498 HydrophobicContact CZ-CG 3.53Å; F471-F498 AromaticContact CZ-CZ 3.95Å; F471-F498 HydrophobicContact CZ-CZ 3.95Å
472	S	75.9	Confident	86.4	Confident	73 Å²	73	69 Å²	69	51%	0.51	38%	0.383	S	S	.	.	S	Bend	trans	-101.9	179.6	-169.2	-4.2	0	0	0	0	111.2	E496	S472-E496 WeakPolarHBondContact CA-OE2 3.41Å; S472-E496 VanDerWaalsContact CB-OE2 3.22Å; S472-E496 WeakPolarHBondContact CB-OE2 3.43Å; S472-E496 PolarHBondContact N-OE2 2.96Å; S472-E496 WeakPolarHBondContact O-CB 3.47Å; S472-E496 VanDerWaalsContact O-CG 3.31Å; S472-E496 WeakPolarHBondContact O-CG 3.36Å; S472-E496 PolarHBondContact O-N 3.41Å; S472-E496 PolarHBondContact OG-OE2 3.34Å
473	Q	76.1	Confident	85.8	Confident	73 Å²	73	65.8 Å²	65.8	34%	0.341	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	131.7	159.5	-50.2	-166	43.8	0	0	108.3	V493 E889	Q473-V493 HydrophobicContact CB-CG1 3.92Å; Q473-V493 VanDerWaalsContact OE1-CG1 3.29Å; Q473-E889 PolarHBondContact NE2-OE2 2.91Å
474	H	79.9	Confident	84.9	Confident	81 Å²	81	65.6 Å²	65.6	38%	0.375	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	111.8	176.1	-167.3	83.9	0	0	0	109.1	P468 Q494 E496	P468-H474 HydrophobicContact CB-CB 4.4Å; P468-H474 HydrophobicContact CG-CB 3.94Å; H474-Q494 WeakPolarHBondContact CB-O 3.25Å; H474-Q494 PolarHBondContact N-O 3.4Å; H474-Q494 PolarHBondContact O-N 2.88Å; H474-E496 HydrophobicContact CB-CG 3.87Å; H474-E496 IonicContact ND1-OE1 3.13Å
475	E	84	Confident	84.2	Confident	123 Å²	123	63.2 Å²	63.2	58%	0.575	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	123.4	179.1	-60.2	-171.5	-165.7	0	0	110.6	V493	E475-V493 HydrophobicContact CG-CG1 4.25Å; E475-V493 HydrophobicContact CG-CG2 4.19Å
476	T	85.1	Confident	83.7	Confident	52 Å²	52	65.8 Å²	65.8	32%	0.319	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	128.7	169.4	47.1	0	0	0	0	108.9	K491 F492	T476-K491 WeakPolarHBondContact O-CA 3.2Å; T476-F492 PolarHBondContact N-O 3.43Å; T476-F492 PolarHBondContact O-N 2.63Å; T476-F492 PolarHBondContact OG1-O 2.79Å; T476-F492 VanDerWaalsContact OG1-O 3.06Å
477	V	89.3	Confident	83.5	Confident	96 Å²	96	68.1 Å²	68.1	58%	0.582	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.4	131.2	179.6	-175.2	0	0	0	0	109.1	N489 V490 K491	V477-N489 HydrophobicContact CG1-CB 4.45Å; V477-V490 WeakPolarHBondContact CA-O 2.97Å; V477-K491 HydrophobicContact CG2-CB 4.03Å
478	D	88.8	Confident	83.5	Confident	90 Å²	90	71.1 Å²	71.1	48%	0.481	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	159.9	175.8	-156.6	-5.1	0	0	0	111.1	V480 N489 V490 F660	D478-V480 HydrophobicContact CB-CG2 4.27Å; D478-N489 WeakPolarHBondContact O-CA 3.26Å; D478-V490 PolarHBondContact N-O 3.34Å; D478-V490 VanDerWaalsContact N-O 3.15Å; D478-V490 PolarHBondContact O-N 3.13Å; D478-F660 HydrophobicContact CB-CD2 3.88Å; D478-F660 HydrophobicContact CB-CE2 3.36Å; D478-F660 HydrophobicContact CB-CZ 3.97Å
479	S	90.5	Very high	83.6	Confident	62 Å²	62	75.5 Å²	75.5	43%	0.434	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	106.9	-179.9	59.5	0	0	0	0	110.5	N489	S479-N489 WeakPolarHBondContact CB-OD1 2.9Å
480	V	90.3	Very high	83.6	Confident	7 Å²	7	72.3 Å²	72.3	4%	0.042	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	138.9	-166.8	-166.7	0	0	0	0	111.7	D478 R482 Y487 E488 V490 E656 F660	D478-V480 HydrophobicContact CB-CG2 4.27Å; V480-R482 PolarHBondContact O-N 2.75Å; V480-Y487 WeakPolarHBondContact O-CA 3.36Å; V480-E488 PolarHBondContact N-O 3.28Å; V480-E488 PolarHBondContact O-N 3.09Å; V480-V490 HydrophobicContact CB-CG2 4.44Å; V480-E656 VanDerWaalsContact CG1-C 3.45Å; V480-E656 HydrophobicContact CG1-CB 3.67Å; V480-F660 HydrophobicContact CG2-CB 4.13Å; V480-F660 HydrophobicContact CG2-CD1 4.14Å; V480-F660 HydrophobicContact CG2-CD2 4.24Å; V480-F660 HydrophobicContact CG2-CG 3.9Å
481	L	86.9	Confident	84	Confident	48 Å²	48	75.5 Å²	75.5	25%	0.251	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	115.6	-179.4	-174.2	63.3	0	0	0	110.7	Y487 S654 E656	L481-Y487 HydrophobicContact CB-CD1 4.1Å; L481-Y487 HydrophobicContact CB-CE1 3.69Å; L481-Y487 HydrophobicContact CD1-CD2 4.26Å; L481-Y487 HydrophobicContact CD1-CE2 4.05Å; L481-S654 VanDerWaalsContact O-CB 3.29Å; L481-S654 WeakPolarHBondContact O-CB 3.39Å; L481-S654 PolarHBondContact O-OG 3.37Å; L481-E656 WeakPolarHBondContact CB-OE2 3.37Å; L481-E656 PolarHBondContact N-OE2 2.87Å
482	R	85	Confident	84.5	Confident	44 Å²	44	69.7 Å²	69.7	17%	0.166	37%	0.366	C	S	.	.			trans	-83.7	167.3	174.9	-79	-69.1	-148.8	164.9	2.4	112.7	V480 K484 G485 V486 E488 E651 Y657	V480-R482 PolarHBondContact O-N 2.75Å; R482-K484 PolarHBondContact O-N 2.92Å; R482-K484 VanDerWaalsContact O-N 3.17Å; R482-G485 WeakPolarHBondContact O-CA 3.06Å; R482-G485 PolarHBondContact O-N 2.68Å; R482-V486 PolarHBondContact N-O 2.98Å; R482-E488 HydrophobicContact CB-CG 4.49Å; R482-E488 HydrophobicContact CG-CB 3.96Å; R482-E488 HydrophobicContact CG-CG 3.96Å; R482-E488 WeakPolarHBondContact CG-OE2 3.48Å; R482-E488 IonicContact NE-OE2 3.21Å; R482-E651 IonicContact CZ-OE1 3.69Å; R482-E651 IonicContact NH1-OE1 3.96Å; R482-E651 PolarHBondContact NH1-OE1 2.94Å; R482-E651 IonicContact NH2-OE1 3.61Å; R482-Y657 VanDerWaalsContact CZ-CZ 3.47Å; R482-Y657 VanDerWaalsContact NH1-CE2 3.32Å; R482-Y657 PolarHBondContact NH2-OH 3.14Å
483	N	81.6	Confident	84.7	Confident	33 Å²	33	67 Å²	67	18%	0.176	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-29.2	173.5	60.1	-6.6	0	0	0	113.6	G485 V550 I652	N483-G485 PolarHBondContact O-N 3.1Å; N483-G485 VanDerWaalsContact O-N 3.15Å; N483-V550 HydrophobicContact CB-CG2 4.22Å; N483-I652 PolarHBondContact ND2-O 3.02Å
484	K	75.9	Confident	84.9	Confident	114 Å²	114	65.2 Å²	65.2	50%	0.496	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-9.4	170.5	-68.7	177.6	-179.4	172.3	0	114.3	R482 R543	R482-K484 PolarHBondContact O-N 2.92Å; R482-K484 VanDerWaalsContact O-N 3.17Å; K484-R543 PolarHBondContact O-NH2 2.98Å
485	G	76.3	Confident	84.8	Confident	35 Å²	35	63.6 Å²	63.6	36%	0.361	33%	0.331	S	S	.	.	S	Bend	trans	69.5	36	-177.7	0	0	0	0	0	113	R482 N483	R482-G485 WeakPolarHBondContact O-CA 3.06Å; R482-G485 PolarHBondContact O-N 2.68Å; N483-G485 PolarHBondContact O-N 3.1Å; N483-G485 VanDerWaalsContact O-N 3.15Å
486	V	82.9	Confident	84.7	Confident	86 Å²	86	58.9 Å²	58.9	52%	0.521	31%	0.309	S	S	.	.	S	Bend	trans	-132.6	144.6	176.3	-179.6	0	0	0	0	107.4	R482	R482-V486 PolarHBondContact N-O 2.98Å
487	Y	86.9	Confident	84.7	Confident	141 Å²	141	57.1 Å²	57.1	55%	0.553	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	121.6	172	-72.2	-84.8	0	0	0	109.8	V480 L481	V480-Y487 WeakPolarHBondContact O-CA 3.36Å; L481-Y487 HydrophobicContact CB-CD1 4.1Å; L481-Y487 HydrophobicContact CB-CE1 3.69Å; L481-Y487 HydrophobicContact CD1-CD2 4.26Å; L481-Y487 HydrophobicContact CD1-CE2 4.05Å
488	E	88.3	Confident	84.5	Confident	71 Å²	71	56 Å²	56	33%	0.332	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	143.4	174.8	-68.3	-179.9	-169.1	0	0	109.5	V480 R482 V490	V480-E488 PolarHBondContact N-O 3.28Å; V480-E488 PolarHBondContact O-N 3.09Å; R482-E488 HydrophobicContact CB-CG 4.49Å; R482-E488 HydrophobicContact CG-CB 3.96Å; R482-E488 HydrophobicContact CG-CG 3.96Å; R482-E488 WeakPolarHBondContact CG-OE2 3.48Å; R482-E488 IonicContact NE-OE2 3.21Å; E488-V490 PolarHBondContact O-N 2.69Å
489	N	89.3	Confident	84.5	Confident	133 Å²	133	53.9 Å²	53.9	71%	0.711	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	108.9	175	-69.4	-11.8	0	0	0	109.2	V477 D478 S479	V477-N489 HydrophobicContact CG1-CB 4.45Å; D478-N489 WeakPolarHBondContact O-CA 3.26Å; S479-N489 WeakPolarHBondContact CB-OD1 2.9Å
490	V	87.6	Confident	84.5	Confident	13 Å²	13	53.6 Å²	53.6	8%	0.079	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	133.5	-176.8	-176.1	0	0	0	0	109.4	V477 D478 V480 E488 Y657 F660 M661	V477-V490 WeakPolarHBondContact CA-O 2.97Å; D478-V490 PolarHBondContact N-O 3.34Å; D478-V490 VanDerWaalsContact N-O 3.15Å; D478-V490 PolarHBondContact O-N 3.13Å; V480-V490 HydrophobicContact CB-CG2 4.44Å; E488-V490 PolarHBondContact O-N 2.69Å; V490-Y657 HydrophobicContact CB-CE2 4.34Å; V490-Y657 HydrophobicContact CG1-CD2 4.39Å; V490-Y657 HydrophobicContact CG1-CE2 3.64Å; V490-Y657 HydrophobicContact CG2-CD2 4Å; V490-Y657 HydrophobicContact CG2-CE2 3.8Å; V490-F660 HydrophobicContact CB-CD1 4.24Å; V490-F660 HydrophobicContact CB-CE1 3.82Å; V490-F660 HydrophobicContact CG1-CD1 4.07Å; V490-F660 HydrophobicContact CG1-CE1 3.7Å; V490-F660 WeakPolarHBondContact O-CE1 3.42Å; V490-F660 WeakPolarHBondContact O-CZ 3.35Å; V490-M661 HydrophobicContact CG1-SD 3.95Å
491	K	87.9	Confident	84.6	Confident	82 Å²	82	53.2 Å²	53.2	36%	0.357	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	121.5	166.7	63.3	-179.3	178	-179.2	0	111	T476 V477 H898	T476-K491 WeakPolarHBondContact O-CA 3.2Å; V477-K491 HydrophobicContact CG2-CB 4.03Å; K491-H898 WeakPolarHBondContact CE-O 3.4Å; K491-H898 PolarHBondContact NZ-O 2.72Å
492	F	85	Confident	84.9	Confident	7 Å²	7	51 Å²	51	3%	0.031	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	128.9	162.2	177.9	-102.8	0	0	0	108.2	T476 Q494 F660 M661 K662	T476-F492 PolarHBondContact N-O 3.43Å; T476-F492 PolarHBondContact O-N 2.63Å; T476-F492 PolarHBondContact OG1-O 2.79Å; T476-F492 VanDerWaalsContact OG1-O 3.06Å; F492-Q494 HydrophobicContact CD1-CB 4.4Å; F492-Q494 HydrophobicContact CE1-CB 3.79Å; F492-Q494 HydrophobicContact CE1-CG 4.38Å; F492-F660 HydrophobicContact CB-CD1 4.27Å; F492-F660 HydrophobicContact CB-CE1 3.58Å; F492-F660 HydrophobicContact CB-CZ 3.78Å; F492-M661 HydrophobicContact CB-SD 4.15Å; F492-M661 HydrophobicContact CD2-CE 3.96Å; F492-M661 HydrophobicContact CD2-SD 3.87Å; F492-M661 WeakPolarHBondContact CE2-O 3.12Å; F492-K662 HydrophobicContact CE1-CD 3.8Å; F492-K662 VanDerWaalsContact CE1-CE 3.48Å; F492-K662 HydrophobicContact CE1-CG 4.4Å; F492-K662 HydrophobicContact CZ-CD 3.84Å; F492-K662 HydrophobicContact CZ-CG 4.21Å
493	V	81.6	Confident	85	Confident	17 Å²	17	49.2 Å²	49.2	10%	0.103	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	114.9	-174.2	-173.8	0	0	0	0	108.3	Q473 E475	Q473-V493 HydrophobicContact CB-CG1 3.92Å; Q473-V493 VanDerWaalsContact OE1-CG1 3.29Å; E475-V493 HydrophobicContact CG-CG1 4.25Å; E475-V493 HydrophobicContact CG-CG2 4.19Å
494	Q	80.7	Confident	85.2	Confident	35 Å²	35	49 Å²	49	16%	0.164	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	131.4	-178.9	-170.8	166.8	-2.9	0	0	110.9	H474 F492	H474-Q494 WeakPolarHBondContact CB-O 3.25Å; H474-Q494 PolarHBondContact N-O 3.4Å; H474-Q494 PolarHBondContact O-N 2.88Å; F492-Q494 HydrophobicContact CD1-CB 4.4Å; F492-Q494 HydrophobicContact CE1-CB 3.79Å; F492-Q494 HydrophobicContact CE1-CG 4.38Å
495	Q	77.4	Confident	85.8	Confident	47 Å²	47	46.6 Å²	46.6	22%	0.22	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	135	173.9	-64.6	174.9	-37.5	0	0	111.1	W809 Y891	Q495-W809 HydrophobicContact CB-CH2 3.73Å; Q495-W809 HydrophobicContact CB-CZ2 4.16Å; Q495-W809 HydrophobicContact CG-CH2 4.19Å; Q495-Y891 VanDerWaalsContact OE1-CE1 3.3Å
496	E	81.9	Confident	86.5	Confident	24 Å²	24	46.4 Å²	46.4	11%	0.112	23%	0.229	C	C	.	.			trans	-74.7	143.2	175.8	-63.9	-179.1	146.2	0	0	111.7	P468 G470 F471 S472 H474	P468-E496 HydrophobicContact CB-CG 4.21Å; P468-E496 HydrophobicContact CG-CG 4.24Å; P468-E496 CarbonylContact O-C 3.51Å; P468-E496 WeakPolarHBondContact O-CA 3.17Å; P468-E496 WeakPolarHBondContact O-CB 3.31Å; G470-E496 VanDerWaalsContact CA-OE2 3.28Å; G470-E496 WeakPolarHBondContact CA-OE2 3.27Å; F471-E496 PolarHBondContact N-OE2 2.92Å; F471-E496 VanDerWaalsContact N-OE2 3.15Å; S472-E496 WeakPolarHBondContact CA-OE2 3.41Å; S472-E496 VanDerWaalsContact CB-OE2 3.22Å; S472-E496 WeakPolarHBondContact CB-OE2 3.43Å; S472-E496 PolarHBondContact N-OE2 2.96Å; S472-E496 WeakPolarHBondContact O-CB 3.47Å; S472-E496 VanDerWaalsContact O-CG 3.31Å; S472-E496 WeakPolarHBondContact O-CG 3.36Å; S472-E496 PolarHBondContact O-N 3.41Å; S472-E496 PolarHBondContact OG-OE2 3.34Å; H474-E496 HydrophobicContact CB-CG 3.87Å; H474-E496 IonicContact ND1-OE1 3.13Å
497	N	84.8	Confident	86.9	Confident	14 Å²	14	42.8 Å²	42.8	8%	0.075	21%	0.207	C	C	.	.			trans	-110.2	92.7	-179.2	-174.7	-6.1	0	0	0	111.6	A467 P468 W499 I500 G501 P502 A707	A467-N497 HydrophobicContact CB-CB 4.04Å; P468-N497 PolarHBondContact O-N 2.87Å; N497-W499 PolarHBondContact O-N 3.39Å; N497-W499 VanDerWaalsContact O-N 3.08Å; N497-W499 WeakPolarHBondContact OD1-CB 3.27Å; N497-W499 PolarHBondContact OD1-N 3.02Å; N497-I500 PolarHBondContact O-N 2.89Å; N497-G501 PolarHBondContact ND2-O 2.95Å; N497-P502 PolarHBondContact ND2-O 3.14Å; N497-A707 PolarHBondContact ND2-O 3.04Å
498	F	85.9	Confident	87.2	Confident	74 Å²	74	36.1 Å²	36.1	33%	0.325	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50	-31.3	173.8	173.4	-112.2	0	0	0	114.2	G470 F471 I500	G470-F498 WeakPolarHBondContact O-CA 3.31Å; G470-F498 WeakPolarHBondContact O-CB 3.34Å; G470-F498 PolarHBondContact O-N 3.04Å; G470-F498 VanDerWaalsContact O-N 3.15Å; F471-F498 HydrophobicContact CD1-CB 4.23Å; F471-F498 HydrophobicContact CD1-CG 4.37Å; F471-F498 HydrophobicContact CD2-CD2 4.4Å; F471-F498 HydrophobicContact CE1-CB 3.94Å; F471-F498 AromaticContact CE1-CD1 4Å; F471-F498 HydrophobicContact CE1-CD1 4Å; F471-F498 AromaticContact CE1-CD2 3.8Å; F471-F498 HydrophobicContact CE1-CD2 3.8Å; F471-F498 HydrophobicContact CE1-CE2 4.33Å; F471-F498 AromaticContact CE1-CG 3.61Å; F471-F498 HydrophobicContact CE1-CG 3.61Å; F471-F498 AromaticContact CE2-CD2 3.55Å; F471-F498 HydrophobicContact CE2-CD2 3.55Å; F471-F498 AromaticContact CE2-CE2 3.87Å; F471-F498 HydrophobicContact CE2-CE2 3.87Å; F471-F498 HydrophobicContact CE2-CG 4.22Å; F471-F498 HydrophobicContact CZ-CB 4.22Å; F471-F498 HydrophobicContact CZ-CD1 4.04Å; F471-F498 AromaticContact CZ-CD2 3.19Å; F471-F498 HydrophobicContact CZ-CD2 3.19Å; F471-F498 HydrophobicContact CZ-CE1 4.23Å; F471-F498 AromaticContact CZ-CE2 3.43Å; F471-F498 HydrophobicContact CZ-CE2 3.43Å; F471-F498 VanDerWaalsContact CZ-CE2 3.43Å; F471-F498 AromaticContact CZ-CG 3.53Å; F471-F498 HydrophobicContact CZ-CG 3.53Å; F471-F498 AromaticContact CZ-CZ 3.95Å; F471-F498 HydrophobicContact CZ-CZ 3.95Å; F498-I500 PolarHBondContact O-N 3.09Å
499	W	87.6	Confident	87.3	Confident	45 Å²	45	34.9 Å²	34.9	17%	0.17	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-2.7	-174.9	-59.8	108.3	0	0	0	114.5	N497 A707 G708 I709 L710 H711 I810	N497-W499 PolarHBondContact O-N 3.39Å; N497-W499 VanDerWaalsContact O-N 3.08Å; N497-W499 WeakPolarHBondContact OD1-CB 3.27Å; N497-W499 PolarHBondContact OD1-N 3.02Å; W499-A707 HydrophobicContact CB-CB 4.14Å; W499-A707 HydrophobicContact CG-CB 4.06Å; W499-G708 CarbonylContact O-C 3.51Å; W499-G708 VanDerWaalsContact O-C 3.29Å; W499-G708 WeakPolarHBondContact O-CA 3.46Å; W499-I709 PolarHBondContact O-N 3.43Å; W499-I709 VanDerWaalsContact O-N 3.1Å; W499-L710 HydrophobicContact CE3-CB 4.08Å; W499-L710 WeakPolarHBondContact O-CB 3.45Å; W499-L710 PolarHBondContact O-N 3.33Å; W499-H711 HydrophobicContact CB-CB 4.16Å; W499-H711 HydrophobicContact CD2-CB 3.86Å; W499-H711 HydrophobicContact CE3-CB 3.75Å; W499-H711 HydrophobicContact CG-CB 4.06Å; W499-H711 HydrophobicContact CZ3-CB 4.43Å; W499-I810 HydrophobicContact CZ2-CG1 4.32Å
500	I	91	Very high	87.4	Confident	55 Å²	55	30.2 Å²	30.2	28%	0.282	15%	0.15	S	C	.	.	S	Bend	trans	59.7	77.7	-175.8	-47.4	-179.9	0	0	0	110.3	I466 V469 N497 F498 G708 I709 L710	I466-I500 HydrophobicContact CD1-CG2 4.2Å; I466-I500 HydrophobicContact CG2-CG2 4.04Å; V469-I500 HydrophobicContact CG1-CG1 4.02Å; V469-I500 HydrophobicContact CG2-CG1 4.18Å; V469-I500 HydrophobicContact CG2-CG2 4.47Å; N497-I500 PolarHBondContact O-N 2.89Å; F498-I500 PolarHBondContact O-N 3.09Å; I500-G708 CarbonylContact O-C 3.6Å; I500-G708 VanDerWaalsContact O-CA 3.26Å; I500-G708 WeakPolarHBondContact O-CA 3.43Å; I500-I709 HydrophobicContact CG2-CD1 4.38Å; I500-I709 PolarHBondContact O-N 2.94Å; I500-L710 HydrophobicContact CD1-CD1 3.82Å; I500-L710 HydrophobicContact CD1-CD2 4.48Å; I500-L710 HydrophobicContact CD1-CG 3.98Å; I500-L710 HydrophobicContact CG1-CD1 3.94Å; I500-L710 HydrophobicContact CG1-CG 4.16Å
501	G	92.1	Very high	87.7	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.146	C	C	.	.	S	Bend	trans	-162.9	-172.3	-177.3	0	0	0	0	0	112.6	I466 A467 N497	I466-G501 WeakPolarHBondContact CA-O 3.45Å; A467-G501 PolarHBondContact N-O 2.93Å; N497-G501 PolarHBondContact ND2-O 2.95Å
502	P	92.4	Very high	87.9	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.006	13%	0.129	C	C	.	.			trans	-70	173.4	-178.8	32	-37.5	0	0	0	112.4	N497 L507	N497-P502 PolarHBondContact ND2-O 3.14Å; P502-L507 HydrophobicContact CG-CD2 3.91Å; P502-L507 HydrophobicContact CG-CG 4.19Å
503	G	88.4	Confident	88.3	Confident	7 Å²	7	25.4 Å²	25.4	7%	0.072	13%	0.128	C	C	.	.			trans	-69.2	159.3	178.9	0	0	0	0	0	113.4	E505 S506 L507	G503-E505 VanDerWaalsContact C-N 3.25Å; G503-E505 PolarHBondContact O-N 3.19Å; G503-S506 WeakPolarHBondContact O-CB 3.28Å; G503-S506 PolarHBondContact O-N 3.26Å; G503-L507 WeakPolarHBondContact O-CG 3.37Å; G503-L507 PolarHBondContact O-N 3.24Å
504	S	86.3	Confident	88.8	Confident	29 Å²	29	24.7 Å²	24.7	20%	0.203	12%	0.124	C	C	.	.	H	α-helix	trans	-56.8	-38.4	176.2	45.5	0	0	0	0	112.5	L507 I508	S504-L507 WeakPolarHBondContact O-CB 3.38Å; S504-L507 PolarHBondContact O-N 3.37Å; S504-I508 WeakPolarHBondContact O-CG1 3.2Å; S504-I508 PolarHBondContact O-N 2.89Å
505	E	87.4	Confident	89.2	Confident	63 Å²	63	23 Å²	23	29%	0.294	12%	0.116	S	C	.	.	H	α-helix	trans	-63.6	-46.9	176.5	-45.7	-168.9	113	0	0	111.6	G503 L507 I508 H509 G645 T646	G503-E505 VanDerWaalsContact C-N 3.25Å; G503-E505 PolarHBondContact O-N 3.19Å; E505-L507 VanDerWaalsContact C-N 3.26Å; E505-L507 PolarHBondContact O-N 3.13Å; E505-I508 WeakPolarHBondContact O-CB 3.38Å; E505-I508 PolarHBondContact O-N 3.48Å; E505-I508 VanDerWaalsContact O-N 3.11Å; E505-H509 PolarHBondContact O-N 2.94Å; E505-G645 WeakPolarHBondContact OE1-CA 3.49Å; E505-T646 HydrophobicContact CG-CG2 3.81Å
506	S	90.9	Very high	89.9	Confident	30 Å²	30	21 Å²	21	21%	0.21	11%	0.107	C	C	.	.	H	α-helix	trans	-62.1	-32.2	173.8	-44.9	0	0	0	0	112.7	G503 L510	G503-S506 WeakPolarHBondContact O-CB 3.28Å; G503-S506 PolarHBondContact O-N 3.26Å; S506-L510 WeakPolarHBondContact O-CB 3.32Å; S506-L510 WeakPolarHBondContact O-CG 3.19Å; S506-L510 PolarHBondContact O-N 2.95Å
507	L	91.8	Very high	90.3	Very high	11 Å²	11	19.9 Å²	19.9	6%	0.058	10%	0.101	C	C	.	.	H	α-helix	trans	-70.6	-37.6	173.7	-68.4	168.6	0	0	0	111.6	P502 G503 S504 E505 L510 G511 A512 V760	P502-L507 HydrophobicContact CG-CD2 3.91Å; P502-L507 HydrophobicContact CG-CG 4.19Å; G503-L507 WeakPolarHBondContact O-CG 3.37Å; G503-L507 PolarHBondContact O-N 3.24Å; S504-L507 WeakPolarHBondContact O-CB 3.38Å; S504-L507 PolarHBondContact O-N 3.37Å; E505-L507 VanDerWaalsContact C-N 3.26Å; E505-L507 PolarHBondContact O-N 3.13Å; L507-L510 PolarHBondContact O-N 3.48Å; L507-G511 PolarHBondContact O-N 3.25Å; L507-A512 HydrophobicContact CB-CB 4.32Å; L507-A512 WeakPolarHBondContact O-CB 3.47Å; L507-A512 PolarHBondContact O-N 3.27Å; L507-V760 HydrophobicContact CB-CG1 4.47Å; L507-V760 HydrophobicContact CD1-CG2 4.12Å; L507-V760 HydrophobicContact CD2-CG1 4.42Å; L507-V760 HydrophobicContact CD2-CG2 4.32Å
508	I	92.3	Very high	90.6	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-60.2	-50.7	170.9	-62.4	166.4	0	0	0	109.6	S504 E505 L510 G511 Y514 T646 V681 R698 A758	S504-I508 WeakPolarHBondContact O-CG1 3.2Å; S504-I508 PolarHBondContact O-N 2.89Å; E505-I508 WeakPolarHBondContact O-CB 3.38Å; E505-I508 PolarHBondContact O-N 3.48Å; E505-I508 VanDerWaalsContact O-N 3.11Å; I508-L510 PolarHBondContact O-N 2.87Å; I508-G511 PolarHBondContact O-N 3.16Å; I508-Y514 HydrophobicContact CD1-CD1 4.29Å; I508-Y514 HydrophobicContact CD1-CD2 3.74Å; I508-Y514 HydrophobicContact CD1-CE1 4.4Å; I508-Y514 HydrophobicContact CD1-CE2 3.86Å; I508-Y514 HydrophobicContact CD1-CG 3.97Å; I508-Y514 HydrophobicContact CG1-CD2 4.13Å; I508-Y514 HydrophobicContact CG1-CG 4.1Å; I508-Y514 HydrophobicContact CG2-CD1 4.21Å; I508-Y514 HydrophobicContact CG2-CG 4.28Å; I508-T646 HydrophobicContact CD1-CG2 3.61Å; I508-V681 WeakPolarHBondContact CG2-O 3.32Å; I508-R698 PolarHBondContact O-NH1 3.5Å; I508-R698 PolarHBondContact O-NH2 3.38Å; I508-A758 HydrophobicContact CD1-CB 3.93Å; I508-A758 HydrophobicContact CG1-CB 3.56Å
509	H	91.4	Very high	90.8	Very high	45 Å²	45	17.5 Å²	17.5	21%	0.208	9%	0.089	C	C	.	.	H	α-helix	trans	-58.4	-33.3	177.3	-173.1	-88.2	0	0	0	113.1	Y464 E505 G511 Y664 C682	Y464-H509 AromaticContact CZ-ND1 3.85Å; Y464-H509 PolarHBondContact OH-CE1 3.47Å; Y464-H509 PolarHBondContact OH-ND1 3.41Å; E505-H509 PolarHBondContact O-N 2.94Å; H509-G511 VanDerWaalsContact C-N 3.28Å; H509-G511 PolarHBondContact O-N 3.35Å; H509-Y664 PolarHBondContact CD2-OH 3.32Å; H509-C682 VanDerWaalsContact CA-O 3.29Å; H509-C682 WeakPolarHBondContact CA-O 3.26Å
510	L	91.9	Very high	90.8	Very high	34 Å²	34	19.9 Å²	19.9	18%	0.178	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-7.6	174.5	-85.4	167.6	0	0	0	114.9	A460 Y464 S506 L507 I508 L705	A460-L510 HydrophobicContact CB-CD1 3.7Å; Y464-L510 HydrophobicContact CD2-CD1 3.83Å; Y464-L510 HydrophobicContact CD2-CG 4.22Å; Y464-L510 HydrophobicContact CE2-CD1 3.83Å; Y464-L510 HydrophobicContact CE2-CD2 3.78Å; Y464-L510 HydrophobicContact CE2-CG 3.7Å; S506-L510 WeakPolarHBondContact O-CB 3.32Å; S506-L510 WeakPolarHBondContact O-CG 3.19Å; S506-L510 PolarHBondContact O-N 2.95Å; L507-L510 PolarHBondContact O-N 3.48Å; I508-L510 PolarHBondContact O-N 2.87Å; L510-L705 HydrophobicContact CB-CD1 4.39Å; L510-L705 HydrophobicContact CB-CD2 4.03Å
511	G	92.6	Very high	90.5	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	103.9	25.3	178.9	0	0	0	0	0	115.8	L507 I508 H509 L705	L507-G511 PolarHBondContact O-N 3.25Å; I508-G511 PolarHBondContact O-N 3.16Å; H509-G511 VanDerWaalsContact C-N 3.28Å; H509-G511 PolarHBondContact O-N 3.35Å; G511-L705 VanDerWaalsContact C-CD1 3.42Å
512	A	93.5	Very high	90.1	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.116	C	C	.	.			trans	-56.8	159.6	171.4	0	0	0	0	0	113.1	L507 Y514 R698 V760	L507-A512 HydrophobicContact CB-CB 4.32Å; L507-A512 WeakPolarHBondContact O-CB 3.47Å; L507-A512 PolarHBondContact O-N 3.27Å; A512-Y514 PolarHBondContact O-N 2.85Å; A512-R698 WeakPolarHBondContact O-CD 3.31Å; A512-R698 PolarHBondContact O-NH1 3.16Å; A512-V760 HydrophobicContact CB-CG1 3.42Å; A512-V760 VanDerWaalsContact CB-CG1 3.42Å
513	K	92.6	Very high	89.7	Confident	1 Å²	1	27.7 Å²	27.7	0%	0.004	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-64.9	117.4	166.1	162.4	-102.1	161.5	-173.3	0	107.7	M518 S750 A751 L754 R757 A758 E759	K513-M518 HydrophobicContact CG-CE 4.32Å; K513-S750 WeakPolarHBondContact CD-OG 3.04Å; K513-S750 WeakPolarHBondContact CE-OG 3.37Å; K513-S750 PolarHBondContact NZ-OG 3.17Å; K513-A751 HydrophobicContact CG-CB 4.26Å; K513-L754 PolarHBondContact NZ-O 3.16Å; K513-R757 PolarHBondContact NZ-O 3Å; K513-A758 WeakPolarHBondContact O-CA 3.23Å; K513-E759 HydrophobicContact CD-CB 3.78Å; K513-E759 HydrophobicContact CD-CG 4.32Å; K513-E759 PolarHBondContact N-O 2.86Å; K513-E759 VanDerWaalsContact NZ-CD 3.29Å; K513-E759 IonicContact NZ-OE1 2.96Å; K513-E759 PolarHBondContact NZ-OE1 2.81Å; K513-E759 IonicContact NZ-OE2 3.79Å; K513-E759 PolarHBondContact O-N 3.04Å
514	Y	91.7	Very high	89.5	Confident	3 Å²	3	28 Å²	28	1%	0.012	14%	0.138	C	C	.	.			trans	-151.7	118.6	175	-169.7	-108.9	0	0	0	107.6	I508 A512 P516 C517 T646 Y756 A758	I508-Y514 HydrophobicContact CD1-CD1 4.29Å; I508-Y514 HydrophobicContact CD1-CD2 3.74Å; I508-Y514 HydrophobicContact CD1-CE1 4.4Å; I508-Y514 HydrophobicContact CD1-CE2 3.86Å; I508-Y514 HydrophobicContact CD1-CG 3.97Å; I508-Y514 HydrophobicContact CG1-CD2 4.13Å; I508-Y514 HydrophobicContact CG1-CG 4.1Å; I508-Y514 HydrophobicContact CG2-CD1 4.21Å; I508-Y514 HydrophobicContact CG2-CG 4.28Å; A512-Y514 PolarHBondContact O-N 2.85Å; Y514-P516 HydrophobicContact CD1-CB 4.13Å; Y514-P516 HydrophobicContact CD1-CG 4.12Å; Y514-P516 HydrophobicContact CE1-CB 3.76Å; Y514-P516 HydrophobicContact CE1-CG 3.6Å; Y514-C517 PolarHBondContact O-N 3.41Å; Y514-T646 WeakPolarHBondContact CE1-O 3.32Å; Y514-T646 PolarHBondContact OH-O 2.74Å; Y514-T646 VanDerWaalsContact OH-O 3.11Å; Y514-Y756 WeakPolarHBondContact CE2-O 3.34Å; Y514-A758 HydrophobicContact CD2-CB 4.2Å
515	S	90.4	Very high	89.4	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-69.6	-37.2	-165.2	-61.1	0	0	0	0	114.7	C517 M518 R519 A751 P755	S515-C517 PolarHBondContact O-N 3.08Å; S515-M518 PolarHBondContact O-N 3.04Å; S515-R519 PolarHBondContact O-N 2.92Å; S515-A751 VanDerWaalsContact OG-CA 3.31Å; S515-A751 WeakPolarHBondContact OG-CA 3.38Å; S515-A751 WeakPolarHBondContact OG-CB 3.4Å; S515-A751 PolarHBondContact OG-O 2.66Å; S515-P755 WeakPolarHBondContact CB-O 3.36Å; S515-P755 PolarHBondContact N-O 3.23Å; S515-P755 VanDerWaalsContact N-O 3.17Å
516	P	90.2	Very high	89.5	Confident	4 Å²	4	29.8 Å²	29.8	3%	0.026	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-57.7	-25.4	173.1	-28.4	36.1	0	0	0	115.3	Y514 M518 V524 M678 P693 P755 Y756	Y514-P516 HydrophobicContact CD1-CB 4.13Å; Y514-P516 HydrophobicContact CD1-CG 4.12Å; Y514-P516 HydrophobicContact CE1-CB 3.76Å; Y514-P516 HydrophobicContact CE1-CG 3.6Å; P516-M518 VanDerWaalsContact C-N 3.31Å; P516-V524 HydrophobicContact CG-CG2 4.47Å; P516-M678 HydrophobicContact CB-SD 4.32Å; P516-P693 VanDerWaalsContact O-CB 3.26Å; P516-P693 WeakPolarHBondContact O-CB 3.44Å; P516-P693 VanDerWaalsContact O-CG 3.23Å; P516-P693 WeakPolarHBondContact O-CG 3.28Å; P516-P755 WeakPolarHBondContact CD-O 3.37Å; P516-Y756 HydrophobicContact CG-CD1 4.14Å; P516-Y756 HydrophobicContact CG-CE1 4.14Å
517	C	91.4	Very high	89.2	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-79.1	-12.6	173.3	-61.1	0	0	0	0	113.7	Y514 S515 C682 Q695 R698	Y514-C517 PolarHBondContact O-N 3.41Å; S515-C517 PolarHBondContact O-N 3.08Å; C517-C682 WeakPolarHBondContact CA-SG 3.24Å; C517-C682 HydrophobicContact CB-CB 3.89Å; C517-C682 WeakPolarHBondContact CB-SG 3.48Å; C517-C682 VanDerWaalsContact SG-CA 3.6Å; C517-C682 WeakPolarHBondContact SG-CB 3.16Å; C517-C682 CovalentContact SG-SG 2.03Å; C517-C682 PolarHBondContact SG-SG 3.27Å; C517-Q695 VanDerWaalsContact O-CB 3.28Å; C517-Q695 WeakPolarHBondContact O-CB 3.47Å; C517-Q695 PolarHBondContact O-N 2.94Å; C517-Q695 VanDerWaalsContact O-N 3.1Å; C517-R698 VanDerWaalsContact CB-NE 3.28Å
518	M	91.3	Very high	89	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-17.9	-173.6	-62.1	-173.4	-62.9	0	0	113.3	K513 S515 P516 P693 F696 R698 L699 A751 F865	K513-M518 HydrophobicContact CG-CE 4.32Å; S515-M518 PolarHBondContact O-N 3.04Å; P516-M518 VanDerWaalsContact C-N 3.31Å; M518-P693 CarbonylContact C-O 3.46Å; M518-F696 WeakPolarHBondContact O-CE1 3.12Å; M518-F696 WeakPolarHBondContact O-CZ 3.48Å; M518-R698 HydrophobicContact CG-CB 4.11Å; M518-R698 HydrophobicContact SD-CB 3.68Å; M518-L699 HydrophobicContact CE-CD2 3.87Å; M518-L699 HydrophobicContact SD-CD2 3.74Å; M518-L699 HydrophobicContact SD-CG 3.75Å; M518-A751 HydrophobicContact CE-CB 3.68Å; M518-F865 HydrophobicContact CB-CE1 4.48Å; M518-F865 HydrophobicContact CB-CZ 3.86Å; M518-F865 HydrophobicContact CE-CE2 4.37Å; M518-F865 HydrophobicContact CE-CZ 4.3Å
519	R	89.9	Confident	88.8	Confident	38 Å²	38	40.8 Å²	40.8	14%	0.143	19%	0.19	C	C	.	.	S	Bend	trans	-155.4	151.3	175.1	62.4	173.4	-150.4	126.6	24.5	109.6	S515 D521 P693 F865	S515-R519 PolarHBondContact O-N 2.92Å; R519-D521 IonicContact NH2-OD2 3.2Å; R519-D521 PolarHBondContact NH2-OD2 2.85Å; R519-D521 VanDerWaalsContact NH2-OD2 3.14Å; R519-D521 PolarHBondContact O-N 3.33Å; R519-P693 VanDerWaalsContact C-CG 3.48Å; R519-F865 HydrophobicContact CB-CE1 3.77Å; R519-F865 HydrophobicContact CB-CZ 3.93Å; R519-F865 VanDerWaalsContact CD-CZ 3.5Å; R519-F865 WeakPolarHBondContact CD-O 3.49Å; R519-F865 HydrophobicContact CG-CE1 3.87Å; R519-F865 HydrophobicContact CG-CE2 4.21Å; R519-F865 HydrophobicContact CG-CZ 3.56Å; R519-F865 PolarHBondContact NH1-O 2.74Å; R519-F865 VanDerWaalsContact NH1-O 3.09Å
520	Q	86.9	Confident	88.7	Confident	96 Å²	96	44.5 Å²	44.5	45%	0.449	21%	0.208	S	C	.	.			trans	-61.9	125.9	173	-171.8	178.7	7.8	0	0	109.7	H525	Q520-H525 HydrophobicContact CG-CB 4.34Å; Q520-H525 PolarHBondContact NE2-CE1 2.91Å; Q520-H525 VanDerWaalsContact NE2-CG 3.34Å; Q520-H525 PolarHBondContact NE2-ND1 3.48Å; Q520-H525 VanDerWaalsContact NE2-ND1 3.17Å
521	D	85.3	Confident	88.6	Confident	14 Å²	14	48 Å²	48	8%	0.075	22%	0.221	C	C	.	.			trans	-100.5	138.8	175.7	-168.3	-89.1	0	0	0	112	R519 Q523 V524 H525 Y756	R519-D521 IonicContact NH2-OD2 3.2Å; R519-D521 PolarHBondContact NH2-OD2 2.85Å; R519-D521 VanDerWaalsContact NH2-OD2 3.14Å; R519-D521 PolarHBondContact O-N 3.33Å; D521-Q523 PolarHBondContact OD1-N 3.38Å; D521-V524 HydrophobicContact CB-CB 4.32Å; D521-V524 HydrophobicContact CB-CG2 4.17Å; D521-H525 WeakPolarHBondContact O-CB 3.24Å; D521-H525 PolarHBondContact O-N 3.5Å; D521-Y756 PolarHBondContact OD1-OH 2.96Å; D521-Y756 VanDerWaalsContact OD1-OH 3.05Å
522	E	83.6	Confident	88.6	Confident	105 Å²	105	51.1 Å²	51.1	49%	0.491	24%	0.235	S	C	.	.	H	α-helix	trans	-64	-41.9	-177.6	-177.2	-175.5	-146.6	0	0	112.6	N526 K871	E522-N526 VanDerWaalsContact O-CB 3.27Å; E522-N526 WeakPolarHBondContact O-CB 3.47Å; E522-N526 PolarHBondContact O-N 3.19Å; E522-N526 PolarHBondContact O-ND2 3.05Å; E522-K871 IonicContact OE2-NZ 2.78Å; E522-K871 PolarHBondContact OE2-NZ 3.43Å
523	Q	83.7	Confident	88.5	Confident	101 Å²	101	53.8 Å²	53.8	47%	0.472	26%	0.257	S	S	.	.	H	α-helix	trans	-73.3	-42.3	-176.7	-62.6	-172.9	-47	0	0	110.8	D521 L527 Y756	D521-Q523 PolarHBondContact OD1-N 3.38Å; Q523-L527 WeakPolarHBondContact O-CB 3.15Å; Q523-L527 PolarHBondContact O-N 3.28Å; Q523-L527 VanDerWaalsContact O-N 3.07Å; Q523-Y756 PolarHBondContact OE1-OH 3.22Å
524	V	83.8	Confident	88.4	Confident	12 Å²	12	57.7 Å²	57.7	7%	0.073	28%	0.281	C	S	.	.	H	α-helix	trans	-64.9	-45.4	175.9	-177.6	0	0	0	0	110.6	P516 D521 N526 L527 I528 M678	P516-V524 HydrophobicContact CG-CG2 4.47Å; D521-V524 HydrophobicContact CB-CB 4.32Å; D521-V524 HydrophobicContact CB-CG2 4.17Å; V524-N526 PolarHBondContact O-N 2.85Å; V524-L527 PolarHBondContact O-N 2.73Å; V524-I528 HydrophobicContact CG1-CD1 3.95Å; V524-I528 WeakPolarHBondContact O-CG1 3.07Å; V524-I528 PolarHBondContact O-N 2.95Å; V524-M678 HydrophobicContact CG1-SD 4.27Å
525	H	85.8	Confident	88.4	Confident	64 Å²	64	58.4 Å²	58.4	30%	0.296	28%	0.284	S	S	.	.	H	α-helix	trans	-67.9	-36	179.9	-177.9	76.1	0	0	0	113	Q520 D521 I528 R529	Q520-H525 HydrophobicContact CG-CB 4.34Å; Q520-H525 PolarHBondContact NE2-CE1 2.91Å; Q520-H525 VanDerWaalsContact NE2-CG 3.34Å; Q520-H525 PolarHBondContact NE2-ND1 3.48Å; Q520-H525 VanDerWaalsContact NE2-ND1 3.17Å; D521-H525 WeakPolarHBondContact O-CB 3.24Å; D521-H525 PolarHBondContact O-N 3.5Å; H525-I528 PolarHBondContact O-N 2.92Å; H525-R529 PolarHBondContact CD2-NH2 3.19Å; H525-R529 PolarHBondContact NE2-NH2 3.38Å; H525-R529 WeakPolarHBondContact O-CB 3.16Å; H525-R529 PolarHBondContact O-N 2.7Å
526	N	87.7	Confident	88.5	Confident	67 Å²	67	63.2 Å²	63.2	36%	0.358	30%	0.302	S	S	.	.	H	α-helix	trans	-66.1	-41.4	173.9	-74.8	-23.1	0	0	0	111.8	E522 V524 I528 R529 E530	E522-N526 VanDerWaalsContact O-CB 3.27Å; E522-N526 WeakPolarHBondContact O-CB 3.47Å; E522-N526 PolarHBondContact O-N 3.19Å; E522-N526 PolarHBondContact O-ND2 3.05Å; V524-N526 PolarHBondContact O-N 2.85Å; N526-I528 PolarHBondContact O-N 3.44Å; N526-R529 WeakPolarHBondContact O-CB 3.19Å; N526-R529 PolarHBondContact O-N 3.37Å; N526-R529 PolarHBondContact OD1-NH1 3.04Å; N526-E530 WeakPolarHBondContact O-CB 3.46Å; N526-E530 PolarHBondContact O-N 3.42Å
527	L	86.2	Confident	88.5	Confident	62 Å²	62	67.1 Å²	67.1	33%	0.325	32%	0.323	S	S	.	.	H	α-helix	trans	-62	-41	174.2	179.5	64.3	0	0	0	112.3	Q523 V524 R529 E530 K531	Q523-L527 WeakPolarHBondContact O-CB 3.15Å; Q523-L527 PolarHBondContact O-N 3.28Å; Q523-L527 VanDerWaalsContact O-N 3.07Å; V524-L527 PolarHBondContact O-N 2.73Å; L527-R529 VanDerWaalsContact C-N 3.34Å; L527-E530 PolarHBondContact O-N 3.3Å; L527-K531 WeakPolarHBondContact O-CB 3.16Å; L527-K531 PolarHBondContact O-N 3.17Å
528	I	86.4	Confident	88.6	Confident	66 Å²	66	67.6 Å²	67.6	34%	0.338	33%	0.326	S	S	.	.	H	α-helix	trans	-63.2	-41.5	174	-69.2	166.1	0	0	0	110.7	V524 H525 N526 K531 K532	V524-I528 HydrophobicContact CG1-CD1 3.95Å; V524-I528 WeakPolarHBondContact O-CG1 3.07Å; V524-I528 PolarHBondContact O-N 2.95Å; H525-I528 PolarHBondContact O-N 2.92Å; N526-I528 PolarHBondContact O-N 3.44Å; I528-K531 PolarHBondContact O-N 2.82Å; I528-K532 HydrophobicContact CG2-CD 4.45Å; I528-K532 WeakPolarHBondContact O-CB 3.38Å; I528-K532 WeakPolarHBondContact O-CG 3.31Å; I528-K532 PolarHBondContact O-N 2.88Å
529	R	88.9	Confident	88.6	Confident	144 Å²	144	67.6 Å²	67.6	54%	0.543	33%	0.326	S	S	.	.	H	α-helix	trans	-64.8	-42.1	178	-170	-173.8	-62	156.2	-0.7	112	H525 N526 L527 K532 A533	H525-R529 PolarHBondContact CD2-NH2 3.19Å; H525-R529 PolarHBondContact NE2-NH2 3.38Å; H525-R529 WeakPolarHBondContact O-CB 3.16Å; H525-R529 PolarHBondContact O-N 2.7Å; N526-R529 WeakPolarHBondContact O-CB 3.19Å; N526-R529 PolarHBondContact O-N 3.37Å; N526-R529 PolarHBondContact OD1-NH1 3.04Å; L527-R529 VanDerWaalsContact C-N 3.34Å; R529-K532 PolarHBondContact O-N 2.93Å; R529-A533 WeakPolarHBondContact O-CB 3.41Å; R529-A533 PolarHBondContact O-N 3.43Å
530	E	89.8	Confident	88.7	Confident	124 Å²	124	65.8 Å²	65.8	58%	0.579	32%	0.319	S	S	*	.	H	α-helix	trans	-62	-49.3	174.2	-176.6	-177.9	-176.1	0	0	111.3	N526 L527 K532 A533 V534	N526-E530 WeakPolarHBondContact O-CB 3.46Å; N526-E530 PolarHBondContact O-N 3.42Å; L527-E530 PolarHBondContact O-N 3.3Å; E530-K532 PolarHBondContact O-N 3.49Å; E530-A533 WeakPolarHBondContact O-CA 3.5Å; E530-A533 WeakPolarHBondContact O-CB 3.39Å; E530-A533 PolarHBondContact O-N 3.27Å; E530-V534 PolarHBondContact O-N 3.01Å
531	K	89.6	Confident	88.9	Confident	106 Å²	106	61.7 Å²	61.7	46%	0.461	30%	0.301	S	S	.	.	H	α-helix	trans	-62	-40	176.8	-77	-69	-176.9	-178.4	0	112.8	L527 I528 A533 V534 E535	L527-K531 WeakPolarHBondContact O-CB 3.16Å; L527-K531 PolarHBondContact O-N 3.17Å; I528-K531 PolarHBondContact O-N 2.82Å; K531-A533 VanDerWaalsContact C-N 3.31Å; K531-A533 PolarHBondContact O-N 3.44Å; K531-V534 PolarHBondContact O-N 3.32Å; K531-E535 VanDerWaalsContact O-CB 3.31Å; K531-E535 WeakPolarHBondContact O-CB 3.46Å; K531-E535 PolarHBondContact O-N 3.38Å
532	K	91.1	Very high	89.3	Confident	67 Å²	67	62 Å²	62	29%	0.291	30%	0.304	S	S	.	.	H	α-helix	trans	-64	-33.2	171.5	-73.7	-169	178.5	-162.7	0	112.4	I528 R529 E530 R536 T614	I528-K532 HydrophobicContact CG2-CD 4.45Å; I528-K532 WeakPolarHBondContact O-CB 3.38Å; I528-K532 WeakPolarHBondContact O-CG 3.31Å; I528-K532 PolarHBondContact O-N 2.88Å; R529-K532 PolarHBondContact O-N 2.93Å; E530-K532 PolarHBondContact O-N 3.49Å; K532-R536 VanDerWaalsContact O-CB 3.28Å; K532-R536 WeakPolarHBondContact O-CB 3.43Å; K532-R536 PolarHBondContact O-N 3.07Å; K532-T614 HydrophobicContact CB-CG2 4.22Å; K532-T614 VanDerWaalsContact O-CG2 3.3Å; K532-T614 WeakPolarHBondContact O-CG2 3.35Å
533	A	91.5	Very high	89.6	Confident	56 Å²	56	60.1 Å²	60.1	46%	0.463	29%	0.292	S	S	.	.	H	α-helix	trans	-69.9	-36.8	175.6	0	0	0	0	0	113.1	R529 E530 K531 N537	R529-A533 WeakPolarHBondContact O-CB 3.41Å; R529-A533 PolarHBondContact O-N 3.43Å; E530-A533 WeakPolarHBondContact O-CA 3.5Å; E530-A533 WeakPolarHBondContact O-CB 3.39Å; E530-A533 PolarHBondContact O-N 3.27Å; K531-A533 VanDerWaalsContact C-N 3.31Å; K531-A533 PolarHBondContact O-N 3.44Å; A533-N537 PolarHBondContact O-ND2 3.44Å
534	V	90.4	Very high	89.8	Confident	83 Å²	83	60 Å²	60	50%	0.503	30%	0.295	S	S	.	.	H	α-helix	trans	-67.3	-49.1	170.8	178.6	0	0	0	0	110.6	E530 K531 R536 N537 S538	E530-V534 PolarHBondContact O-N 3.01Å; K531-V534 PolarHBondContact O-N 3.32Å; V534-R536 VanDerWaalsContact C-N 3.33Å; V534-R536 PolarHBondContact O-N 2.87Å; V534-N537 PolarHBondContact O-N 3.41Å; V534-S538 PolarHBondContact O-N 2.94Å
535	E	92.5	Very high	90.1	Very high	17 Å²	17	64.3 Å²	64.3	8%	0.079	32%	0.317	C	S	.	.	H	α-helix	trans	-59.2	-40.7	-179.7	177.5	165.2	-123.3	0	0	112.7	K531 N537 S538 I613 T614 L671 C672 S673	K531-E535 VanDerWaalsContact O-CB 3.31Å; K531-E535 WeakPolarHBondContact O-CB 3.46Å; K531-E535 PolarHBondContact O-N 3.38Å; E535-N537 PolarHBondContact O-N 2.93Å; E535-S538 VanDerWaalsContact O-CB 3.26Å; E535-S538 WeakPolarHBondContact O-CB 3.33Å; E535-S538 PolarHBondContact O-N 3.17Å; E535-S538 PolarHBondContact O-OG 3.02Å; E535-I613 WeakPolarHBondContact O-CD1 3.41Å; E535-T614 HydrophobicContact CG-CG2 4.5Å; E535-L671 HydrophobicContact CG-CD2 4.09Å; E535-L671 WeakPolarHBondContact OE1-CA 3.46Å; E535-L671 WeakPolarHBondContact OE1-CB 3.43Å; E535-C672 WeakPolarHBondContact OE1-CA 3.28Å; E535-C672 WeakPolarHBondContact OE1-CB 3.35Å; E535-C672 PolarHBondContact OE1-N 3.45Å; E535-S673 VanDerWaalsContact OE2-CB 3.25Å; E535-S673 WeakPolarHBondContact OE2-CB 3.42Å; E535-S673 PolarHBondContact OE2-N 3.14Å
536	R	92.7	Very high	90	Very high	101 Å²	101	72.1 Å²	72.1	38%	0.381	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-26.2	174.8	178	171	160.2	-173	-10.9	113.6	K532 V534 H587 T614	K532-R536 VanDerWaalsContact O-CB 3.28Å; K532-R536 WeakPolarHBondContact O-CB 3.43Å; K532-R536 PolarHBondContact O-N 3.07Å; V534-R536 VanDerWaalsContact C-N 3.33Å; V534-R536 PolarHBondContact O-N 2.87Å; R536-H587 PolarHBondContact NE-CD2 3.32Å; R536-H587 VanDerWaalsContact NE-CD2 3.35Å; R536-H587 PolarHBondContact NE-NE2 3.27Å; R536-H587 PolarHBondContact NH2-CE1 2.86Å; R536-H587 PolarHBondContact NH2-NE2 3.5Å; R536-T614 HydrophobicContact CB-CG2 3.75Å
537	N	90.4	Very high	89.9	Confident	87 Å²	87	71.4 Å²	71.4	47%	0.465	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-3.6	179.1	-68.4	-39.3	0	0	0	113.8	A533 V534 E535 K566	A533-N537 PolarHBondContact O-ND2 3.44Å; V534-N537 PolarHBondContact O-N 3.41Å; E535-N537 PolarHBondContact O-N 2.93Å; N537-K566 PolarHBondContact O-NZ 2.99Å
538	S	92.3	Very high	90.1	Very high	9 Å²	9	68.6 Å²	68.6	6%	0.063	33%	0.33	C	S	.	.			trans	-65.6	163.2	173.5	72.9	0	0	0	0	112.3	V534 E535 Q551 T552	V534-S538 PolarHBondContact O-N 2.94Å; E535-S538 VanDerWaalsContact O-CB 3.26Å; E535-S538 WeakPolarHBondContact O-CB 3.33Å; E535-S538 PolarHBondContact O-N 3.17Å; E535-S538 PolarHBondContact O-OG 3.02Å; S538-Q551 WeakPolarHBondContact OG-CG 3.25Å; S538-Q551 PolarHBondContact OG-NE2 2.91Å; S538-T552 WeakPolarHBondContact CA-O 3.32Å; S538-T552 WeakPolarHBondContact CB-O 3.37Å
539	A	92.1	Very high	90.3	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	174.4	171.5	0	0	0	0	0	110.6	C541 T552 W564 V565 K566	A539-C541 PolarHBondContact O-N 3.28Å; A539-T552 PolarHBondContact N-O 3.5Å; A539-T552 PolarHBondContact O-N 3.49Å; A539-W564 HydrophobicContact CB-CD2 4.29Å; A539-W564 HydrophobicContact CB-CZ2 3.96Å; A539-V565 VanDerWaalsContact CB-O 3.31Å; A539-V565 WeakPolarHBondContact CB-O 3.45Å; A539-K566 HydrophobicContact CB-CB 3.73Å; A539-K566 HydrophobicContact CB-CD 4.02Å; A539-K566 HydrophobicContact CB-CG 3.91Å
540	C	92.3	Very high	90.5	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	112.9	-176.9	-167.9	0	0	0	0	112.1	V565 S589 C591 H632	C540-V565 PolarHBondContact O-N 2.68Å; C540-S589 WeakPolarHBondContact CB-O 3.35Å; C540-S589 PolarHBondContact N-O 2.61Å; C540-C591 WeakPolarHBondContact CA-SG 3.27Å; C540-C591 HydrophobicContact CB-CB 4.06Å; C540-C591 WeakPolarHBondContact CB-SG 3.45Å; C540-C591 WeakPolarHBondContact SG-CA 3.37Å; C540-C591 WeakPolarHBondContact SG-CB 3.47Å; C540-C591 CovalentContact SG-SG 2.04Å; C540-C591 PolarHBondContact SG-SG 2.84Å; C540-H632 HydrophobicContact CB-CB 3.76Å
541	C	91.8	Very high	90.6	Very high	10 Å²	10	53.7 Å²	53.7	7%	0.068	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	109.6	171.1	-173.1	0	0	0	0	108.9	A539 C549 V550 T552 C557 A562	A539-C541 PolarHBondContact O-N 3.28Å; C541-C549 CarbonylContact O-C 3.19Å; C541-C549 WeakPolarHBondContact O-CA 3.31Å; C541-C549 WeakPolarHBondContact O-CB 3.04Å; C541-V550 WeakPolarHBondContact CB-O 3.38Å; C541-V550 PolarHBondContact N-O 3.2Å; C541-V550 PolarHBondContact O-N 3.44Å; C541-T552 HydrophobicContact CB-CG2 4.5Å; C541-T552 WeakPolarHBondContact CB-OG1 3.17Å; C541-C557 HydrophobicContact CB-CB 3.82Å; C541-C557 WeakPolarHBondContact CB-SG 3.46Å; C541-C557 VanDerWaalsContact SG-CA 3.52Å; C541-C557 WeakPolarHBondContact SG-CB 3.23Å; C541-C557 CovalentContact SG-SG 2.04Å; C541-C557 PolarHBondContact SG-SG 3.24Å; C541-A562 VanDerWaalsContact SG-CB 3.58Å
542	V	91.8	Very high	90.8	Very high	22 Å²	22	49 Å²	49	13%	0.133	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	122.2	-175.7	-175.9	0	0	0	0	109.7	C549 A562 V563 V565 C635	V542-C549 HydrophobicContact CB-CB 4.32Å; V542-C549 HydrophobicContact CG1-CB 4.44Å; V542-C549 HydrophobicContact CG2-CB 3.96Å; V542-A562 CarbonylContact O-C 3.29Å; V542-A562 WeakPolarHBondContact O-CA 3.45Å; V542-A562 VanDerWaalsContact O-CB 3.3Å; V542-A562 WeakPolarHBondContact O-CB 3.24Å; V542-V563 PolarHBondContact N-O 3.49Å; V542-V563 PolarHBondContact O-N 3.32Å; V542-V565 HydrophobicContact CB-CG2 4.45Å; V542-V565 HydrophobicContact CG2-CG2 3.89Å; V542-C635 HydrophobicContact CG1-CB 4.09Å
543	R	90.9	Very high	90.7	Very high	64 Å²	64	47.1 Å²	47.1	24%	0.242	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	140.4	-177.2	-70.6	178.3	147.4	-147.7	-9.3	113.2	K484 D545 R546 S547 G548 A562	K484-R543 PolarHBondContact O-NH2 2.98Å; R543-D545 VanDerWaalsContact C-N 3.26Å; R543-D545 VanDerWaalsContact CB-OD1 3.22Å; R543-D545 WeakPolarHBondContact CB-OD1 3.36Å; R543-D545 IonicContact NH1-OD2 3.9Å; R543-D545 PolarHBondContact O-N 3.01Å; R543-R546 PolarHBondContact O-N 3.23Å; R543-R546 VanDerWaalsContact O-N 3.16Å; R543-S547 WeakPolarHBondContact CD-OG 3.12Å; R543-S547 PolarHBondContact NH1-OG 2.86Å; R543-G548 WeakPolarHBondContact CB-O 3.17Å; R543-G548 PolarHBondContact N-O 2.95Å; R543-A562 HydrophobicContact CG-CB 4.43Å
544	N	88.8	Confident	90.6	Very high	99 Å²	99	50.7 Å²	50.7	53%	0.529	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-25.6	-177.7	-65.6	-22.1	0	0	0	113.4	R546 T560 L561	N544-R546 VanDerWaalsContact C-N 3.27Å; N544-R546 PolarHBondContact O-N 3.1Å; N544-T560 PolarHBondContact ND2-O 2.84Å; N544-L561 WeakPolarHBondContact CB-O 3.35Å; N544-L561 PolarHBondContact N-O 3.5Å
545	D	88.7	Confident	90.5	Very high	102 Å²	102	55.9 Å²	55.9	55%	0.545	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-2.2	178	68.8	-4.8	0	0	0	114.1	R543 S547	R543-D545 VanDerWaalsContact C-N 3.26Å; R543-D545 VanDerWaalsContact CB-OD1 3.22Å; R543-D545 WeakPolarHBondContact CB-OD1 3.36Å; R543-D545 IonicContact NH1-OD2 3.9Å; R543-D545 PolarHBondContact O-N 3.01Å; D545-S547 PolarHBondContact O-N 2.87Å; D545-S547 VanDerWaalsContact OD1-CB 3.27Å; D545-S547 WeakPolarHBondContact OD1-CB 3.4Å; D545-S547 PolarHBondContact OD1-N 2.89Å; D545-S547 PolarHBondContact OD1-OG 3.12Å; D545-S547 WeakPolarHBondContact OD2-CB 3.18Å; D545-S547 PolarHBondContact OD2-OG 2.95Å
546	R	83.9	Confident	90.2	Very high	229 Å²	229	60.3 Å²	60.3	86%	0.864	29%	0.288	S	S	*	.	S	Bend	trans	60.3	16.1	-172.3	-50.3	-178.2	-179.6	-170.6	-1.4	115.1	R543 N544 G548	R543-R546 PolarHBondContact O-N 3.23Å; R543-R546 VanDerWaalsContact O-N 3.16Å; N544-R546 VanDerWaalsContact C-N 3.27Å; N544-R546 PolarHBondContact O-N 3.1Å; R546-G548 PolarHBondContact O-N 2.78Å
547	S	86.1	Confident	90.1	Very high	52 Å²	52	56.3 Å²	56.3	36%	0.364	28%	0.276	S	S	.	.	S	Bend	trans	-68.6	-16.6	173.5	63.1	0	0	0	0	113.1	R543 D545	R543-S547 WeakPolarHBondContact CD-OG 3.12Å; R543-S547 PolarHBondContact NH1-OG 2.86Å; D545-S547 PolarHBondContact O-N 2.87Å; D545-S547 VanDerWaalsContact OD1-CB 3.27Å; D545-S547 WeakPolarHBondContact OD1-CB 3.4Å; D545-S547 PolarHBondContact OD1-N 2.89Å; D545-S547 PolarHBondContact OD1-OG 3.12Å; D545-S547 WeakPolarHBondContact OD2-CB 3.18Å; D545-S547 PolarHBondContact OD2-OG 2.95Å
548	G	89.9	Confident	90	Very high	2 Å²	2	54.4 Å²	54.4	2%	0.021	27%	0.269	C	S	.	.			trans	149.5	-160.1	164.1	0	0	0	0	0	114.8	R543 R546 T636	R543-G548 WeakPolarHBondContact CB-O 3.17Å; R543-G548 PolarHBondContact N-O 2.95Å; R546-G548 PolarHBondContact O-N 2.78Å; G548-T636 CarbonylContact C-O 3.54Å; G548-T636 WeakPolarHBondContact CA-O 3.01Å; G548-T636 WeakPolarHBondContact CA-OG1 3.48Å
549	C	91.6	Very high	89.7	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.007	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	155.8	-178.8	58.8	0	0	0	0	112.6	C541 V542 C635 T636 I637 T638	C541-C549 CarbonylContact O-C 3.19Å; C541-C549 WeakPolarHBondContact O-CA 3.31Å; C541-C549 WeakPolarHBondContact O-CB 3.04Å; V542-C549 HydrophobicContact CB-CB 4.32Å; V542-C549 HydrophobicContact CG1-CB 4.44Å; V542-C549 HydrophobicContact CG2-CB 3.96Å; C549-C635 HydrophobicContact CB-CB 3.62Å; C549-C635 WeakPolarHBondContact CB-SG 3.06Å; C549-C635 WeakPolarHBondContact SG-CB 3.26Å; C549-C635 CovalentContact SG-SG 2.03Å; C549-C635 PolarHBondContact SG-SG 2.85Å; C549-T636 PolarHBondContact N-O 3.01Å; C549-I637 WeakPolarHBondContact O-CA 3.47Å; C549-T638 PolarHBondContact O-N 3.4Å; C549-T638 PolarHBondContact O-OG1 3.16Å
550	V	92.3	Very high	89.4	Confident	12 Å²	12	64.7 Å²	64.7	7%	0.073	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	146.3	179	55.6	0	0	0	0	110.5	N483 C541 T552 I652	N483-V550 HydrophobicContact CB-CG2 4.22Å; C541-V550 WeakPolarHBondContact CB-O 3.38Å; C541-V550 PolarHBondContact N-O 3.2Å; C541-V550 PolarHBondContact O-N 3.44Å; V550-T552 HydrophobicContact CG1-CG2 3.92Å; V550-T552 HydrophobicContact CG2-CG2 4.23Å; V550-I652 HydrophobicContact CG2-CG2 3.79Å
551	Q	93.1	Very high	89.2	Confident	8 Å²	8	70 Å²	70	4%	0.037	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	119.2	177.4	-166.9	74.6	11.8	0	0	109.9	S538 I652 L671	S538-Q551 WeakPolarHBondContact OG-CG 3.25Å; S538-Q551 PolarHBondContact OG-NE2 2.91Å; Q551-I652 HydrophobicContact CB-CD1 3.93Å; Q551-I652 HydrophobicContact CG-CD1 4.32Å; Q551-L671 HydrophobicContact CG-CD2 4.03Å
552	T	91.8	Very high	89.1	Confident	8 Å²	8	70 Å²	70	5%	0.049	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	170.2	-177.5	68.1	0	0	0	0	112.8	S538 A539 C541 V550 E556 W564	S538-T552 WeakPolarHBondContact CA-O 3.32Å; S538-T552 WeakPolarHBondContact CB-O 3.37Å; A539-T552 PolarHBondContact N-O 3.5Å; A539-T552 PolarHBondContact O-N 3.49Å; C541-T552 HydrophobicContact CB-CG2 4.5Å; C541-T552 WeakPolarHBondContact CB-OG1 3.17Å; V550-T552 HydrophobicContact CG1-CG2 3.92Å; V550-T552 HydrophobicContact CG2-CG2 4.23Å; T552-E556 HydrophobicContact CG2-CB 4.41Å; T552-W564 PolarHBondContact O-NE1 2.96Å
553	S	90.8	Very high	89	Confident	28 Å²	28	72.3 Å²	72.3	20%	0.196	38%	0.379	C	S	.	.			trans	-66.9	169.3	159.6	67.6	0	0	0	0	111.3	E556 C557 W564	S553-E556 WeakPolarHBondContact OG-CB 3.2Å; S553-E556 WeakPolarHBondContact OG-CG 3.38Å; S553-E556 PolarHBondContact OG-N 3.3Å; S553-C557 PolarHBondContact O-N 3.17Å; S553-W564 PolarHBondContact O-NE1 2.93Å
554	E	88.8	Confident	88.9	Confident	131 Å²	131	71.7 Å²	71.7	61%	0.612	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-44.9	172.4	-162	167.8	172.3	0	0	111	E556 C557 W564	E554-E556 VanDerWaalsContact C-N 3.3Å; E554-E556 PolarHBondContact O-N 3Å; E554-C557 PolarHBondContact O-N 2.92Å; E554-C557 VanDerWaalsContact O-N 3.13Å; E554-W564 HydrophobicContact CB-CD2 4.07Å; E554-W564 HydrophobicContact CB-CE3 4.09Å; E554-W564 HydrophobicContact CB-CH2 3.61Å; E554-W564 HydrophobicContact CB-CZ2 3.67Å; E554-W564 HydrophobicContact CB-CZ3 3.86Å; E554-W564 HydrophobicContact CG-CD2 3.99Å; E554-W564 HydrophobicContact CG-CE3 3.67Å; E554-W564 HydrophobicContact CG-CH2 3.94Å; E554-W564 HydrophobicContact CG-CZ2 4.33Å; E554-W564 HydrophobicContact CG-CZ3 3.63Å; E554-W564 WeakPolarHBondContact OE2-CH2 3.22Å; E554-W564 WeakPolarHBondContact OE2-CZ3 3.35Å
555	E	88	Confident	88.9	Confident	191 Å²	191	67 Å²	67	89%	0.893	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-29.2	-179.2	-60.6	173.8	-172	0	0	113.9
556	E	87.2	Confident	88.9	Confident	110 Å²	110	63.8 Å²	63.8	51%	0.514	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-18	177.1	-75.4	175.5	178.1	0	0	113.1	T552 S553 E554	T552-E556 HydrophobicContact CG2-CB 4.41Å; S553-E556 WeakPolarHBondContact OG-CB 3.2Å; S553-E556 WeakPolarHBondContact OG-CG 3.38Å; S553-E556 PolarHBondContact OG-N 3.3Å; E554-E556 VanDerWaalsContact C-N 3.3Å; E554-E556 PolarHBondContact O-N 3Å
557	C	89.3	Confident	88.8	Confident	17 Å²	17	53 Å²	53	12%	0.115	29%	0.292	C	S	.	.	S	Bend	trans	-84.9	136.8	-178.2	-169	0	0	0	0	111.3	C541 S553 E554 S559 W564	C541-C557 HydrophobicContact CB-CB 3.82Å; C541-C557 WeakPolarHBondContact CB-SG 3.46Å; C541-C557 VanDerWaalsContact SG-CA 3.52Å; C541-C557 WeakPolarHBondContact SG-CB 3.23Å; C541-C557 CovalentContact SG-SG 2.04Å; C541-C557 PolarHBondContact SG-SG 3.24Å; S553-C557 PolarHBondContact O-N 3.17Å; E554-C557 PolarHBondContact O-N 2.92Å; E554-C557 VanDerWaalsContact O-N 3.13Å; C557-S559 PolarHBondContact O-N 2.78Å; C557-W564 HydrophobicContact CB-CB 4.24Å; C557-W564 HydrophobicContact CB-CG 4.32Å
558	S	88.8	Confident	88.1	Confident	47 Å²	47	52.5 Å²	52.5	33%	0.329	29%	0.288	S	S	.	.			trans	-78.4	109.9	-179.3	178.9	0	0	0	0	111.4	T560 L561 A562	S558-T560 PolarHBondContact O-N 2.98Å; S558-T560 PolarHBondContact OG-OG1 3.37Å; S558-L561 PolarHBondContact O-N 2.59Å; S558-L561 PolarHBondContact OG-N 3.34Å; S558-A562 PolarHBondContact O-N 3.14Å
559	S	85.1	Confident	86.9	Confident	118 Å²	118	58.8 Å²	58.8	83%	0.825	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-8.5	178.7	57.1	0	0	0	0	115.7	C557	C557-S559 PolarHBondContact O-N 2.78Å
560	T	86.6	Confident	85.7	Confident	107 Å²	107	60.1 Å²	60.1	66%	0.656	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	-28.7	178	54.2	0	0	0	0	113.7	N544 S558	N544-T560 PolarHBondContact ND2-O 2.84Å; S558-T560 PolarHBondContact O-N 2.98Å; S558-T560 PolarHBondContact OG-OG1 3.37Å
561	L	88.1	Confident	84.1	Confident	111 Å²	111	65.2 Å²	65.2	58%	0.581	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-9.1	-176.1	-58.4	178.7	0	0	0	113.8	N544 S558	N544-L561 WeakPolarHBondContact CB-O 3.35Å; N544-L561 PolarHBondContact N-O 3.5Å; S558-L561 PolarHBondContact O-N 2.59Å; S558-L561 PolarHBondContact OG-N 3.34Å
562	A	89.8	Confident	82.3	Confident	10 Å²	10	68.9 Å²	68.9	8%	0.083	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	164.5	-179.1	0	0	0	0	0	112.3	C541 V542 R543 S558	C541-A562 VanDerWaalsContact SG-CB 3.58Å; V542-A562 CarbonylContact O-C 3.29Å; V542-A562 WeakPolarHBondContact O-CA 3.45Å; V542-A562 VanDerWaalsContact O-CB 3.3Å; V542-A562 WeakPolarHBondContact O-CB 3.24Å; R543-A562 HydrophobicContact CG-CB 4.43Å; S558-A562 PolarHBondContact O-N 3.14Å
563	V	89.1	Confident	80.8	Confident	71 Å²	71	68.8 Å²	68.8	43%	0.43	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.6	167.3	178	0	0	0	0	108.1	V542 V565	V542-V563 PolarHBondContact N-O 3.49Å; V542-V563 PolarHBondContact O-N 3.32Å; V563-V565 HydrophobicContact CG1-CG2 4.03Å; V563-V565 PolarHBondContact O-N 3.17Å
564	W	90.4	Very high	79.1	Confident	51 Å²	51	72.3 Å²	72.3	19%	0.193	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	97.1	174.1	-171.9	69.9	0	0	0	109.6	A539 T552 S553 E554 C557 K566	A539-W564 HydrophobicContact CB-CD2 4.29Å; A539-W564 HydrophobicContact CB-CZ2 3.96Å; T552-W564 PolarHBondContact O-NE1 2.96Å; S553-W564 PolarHBondContact O-NE1 2.93Å; E554-W564 HydrophobicContact CB-CD2 4.07Å; E554-W564 HydrophobicContact CB-CE3 4.09Å; E554-W564 HydrophobicContact CB-CH2 3.61Å; E554-W564 HydrophobicContact CB-CZ2 3.67Å; E554-W564 HydrophobicContact CB-CZ3 3.86Å; E554-W564 HydrophobicContact CG-CD2 3.99Å; E554-W564 HydrophobicContact CG-CE3 3.67Å; E554-W564 HydrophobicContact CG-CH2 3.94Å; E554-W564 HydrophobicContact CG-CZ2 4.33Å; E554-W564 HydrophobicContact CG-CZ3 3.63Å; E554-W564 WeakPolarHBondContact OE2-CH2 3.22Å; E554-W564 WeakPolarHBondContact OE2-CZ3 3.35Å; C557-W564 HydrophobicContact CB-CB 4.24Å; C557-W564 HydrophobicContact CB-CG 4.32Å; W564-K566 HydrophobicContact CD2-CB 4.47Å; W564-K566 HydrophobicContact CE3-CB 4.04Å; W564-K566 HydrophobicContact CE3-CD 4.33Å; W564-K566 HydrophobicContact CH2-CB 4.39Å; W564-K566 HydrophobicContact CH2-CD 3.19Å; W564-K566 HydrophobicContact CH2-CG 4.39Å; W564-K566 HydrophobicContact CZ2-CD 3.68Å; W564-K566 HydrophobicContact CZ3-CB 4.02Å; W564-K566 HydrophobicContact CZ3-CD 3.54Å; W564-K566 HydrophobicContact CZ3-CG 4.41Å; W564-K566 PolarHBondContact O-N 2.91Å
565	V	88.1	Confident	77.7	Confident	1 Å²	1	74.2 Å²	74.2	1%	0.006	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	106.7	-171.2	-178.8	0	0	0	0	109.4	A539 C540 V542 V563 I573 S589 P631 H632	A539-V565 VanDerWaalsContact CB-O 3.31Å; A539-V565 WeakPolarHBondContact CB-O 3.45Å; C540-V565 PolarHBondContact O-N 2.68Å; V542-V565 HydrophobicContact CB-CG2 4.45Å; V542-V565 HydrophobicContact CG2-CG2 3.89Å; V563-V565 HydrophobicContact CG1-CG2 4.03Å; V563-V565 PolarHBondContact O-N 3.17Å; V565-I573 HydrophobicContact CG1-CD1 3.42Å; V565-I573 VanDerWaalsContact CG1-CD1 3.42Å; V565-S589 WeakPolarHBondContact O-CB 3.37Å; V565-S589 PolarHBondContact O-OG 3.13Å; V565-P631 HydrophobicContact CG1-CG 4.21Å; V565-P631 HydrophobicContact CG2-CB 4.41Å; V565-P631 HydrophobicContact CG2-CG 4.05Å; V565-H632 HydrophobicContact CG1-CB 4.41Å
566	K	87.4	Confident	76.6	Confident	35 Å²	35	67 Å²	67	15%	0.152	39%	0.394	C	S	.	.			trans	-132.6	128.6	-178	-170	165.4	-177.8	174.8	0	114.8	N537 A539 W564 N569 D570 S589	N537-K566 PolarHBondContact O-NZ 2.99Å; A539-K566 HydrophobicContact CB-CB 3.73Å; A539-K566 HydrophobicContact CB-CD 4.02Å; A539-K566 HydrophobicContact CB-CG 3.91Å; W564-K566 HydrophobicContact CD2-CB 4.47Å; W564-K566 HydrophobicContact CE3-CB 4.04Å; W564-K566 HydrophobicContact CE3-CD 4.33Å; W564-K566 HydrophobicContact CH2-CB 4.39Å; W564-K566 HydrophobicContact CH2-CD 3.19Å; W564-K566 HydrophobicContact CH2-CG 4.39Å; W564-K566 HydrophobicContact CZ2-CD 3.68Å; W564-K566 HydrophobicContact CZ3-CB 4.02Å; W564-K566 HydrophobicContact CZ3-CD 3.54Å; W564-K566 HydrophobicContact CZ3-CG 4.41Å; W564-K566 PolarHBondContact O-N 2.91Å; K566-N569 PolarHBondContact O-N 2.88Å; K566-D570 WeakPolarHBondContact O-CB 3.13Å; K566-D570 PolarHBondContact O-N 3.07Å; K566-D570 VanDerWaalsContact O-N 3.15Å; K566-S589 VanDerWaalsContact CA-OG 3.27Å; K566-S589 WeakPolarHBondContact CA-OG 3.39Å
567	W	83.7	Confident	75.9	Confident	1 Å²	1	62.7 Å²	62.7	0%	0.004	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	145.1	168.7	-50.1	-25.6	0	0	0	111.9	T577 P578 R585 S589 D594 W616 H632	W567-T577 HydrophobicContact CB-CG2 4.16Å; W567-T577 HydrophobicContact CG-CG2 4.29Å; W567-P578 HydrophobicContact CD2-CG 4.24Å; W567-P578 HydrophobicContact CE3-CG 3.75Å; W567-P578 HydrophobicContact CH2-CG 3.36Å; W567-P578 HydrophobicContact CZ2-CG 3.82Å; W567-P578 HydrophobicContact CZ3-CG 3.31Å; W567-R585 HydrophobicContact CE3-CB 4.3Å; W567-S589 PolarHBondContact N-OG 3.13Å; W567-D594 WeakPolarHBondContact CZ2-OD2 3.09Å; W567-W616 HydrophobicContact CH2-CH2 4.07Å; W567-W616 AromaticContact CZ3-CH2 3.85Å; W567-W616 HydrophobicContact CZ3-CH2 3.85Å; W567-W616 HydrophobicContact CZ3-CZ2 4.37Å; W567-H632 AromaticContact CZ2-CE1 3.95Å; W567-H632 AromaticContact CZ2-NE2 3.62Å
568	P	71.1	Confident	75.4	Confident	42 Å²	42	62.3 Å²	62.3	27%	0.273	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	cis	-90.6	1.4	-8.3	37.4	-35.2	0	0	0	113.4	D570 L574 T577	P568-D570 VanDerWaalsContact C-N 3.35Å; P568-D570 PolarHBondContact O-N 3.35Å; P568-L574 WeakPolarHBondContact O-CD1 3.37Å; P568-T577 HydrophobicContact CB-CG2 4.06Å
569	N	64.6	Low	74.9	Confident	135 Å²	135	65.2 Å²	65.2	72%	0.722	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-15.2	-162.7	-63.6	-4.7	0	0	0	115.1	K566 P571	K566-N569 PolarHBondContact O-N 2.88Å; N569-P571 WeakPolarHBondContact O-CD 3.37Å
570	D	65.6	Low	74.7	Confident	28 Å²	28	61.9 Å²	61.9	15%	0.15	35%	0.351	C	S	.	.			trans	-74.3	114.1	179.1	-172	-24.5	0	0	0	111.5	K566 P568 A572 I573 L574	K566-D570 WeakPolarHBondContact O-CB 3.13Å; K566-D570 PolarHBondContact O-N 3.07Å; K566-D570 VanDerWaalsContact O-N 3.15Å; P568-D570 VanDerWaalsContact C-N 3.35Å; P568-D570 PolarHBondContact O-N 3.35Å; D570-A572 PolarHBondContact O-N 3.49Å; D570-A572 VanDerWaalsContact O-N 3.16Å; D570-A572 WeakPolarHBondContact OD1-CB 3.38Å; D570-A572 PolarHBondContact OD1-N 3.09Å; D570-I573 HydrophobicContact CB-CB 4.36Å; D570-I573 PolarHBondContact O-N 3.32Å; D570-L574 PolarHBondContact O-N 2.95Å; D570-L574 VanDerWaalsContact O-N 3.12Å
571	P	58	Low	74.3	Confident	119 Å²	119	64.6 Å²	64.6	77%	0.773	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.1	-176.6	28.7	-35.9	0	0	0	113.7	N569 I573	N569-P571 WeakPolarHBondContact O-CD 3.37Å; P571-I573 VanDerWaalsContact C-N 3.3Å
572	A	55.3	Low	73.8	Confident	86 Å²	86	62.2 Å²	62.2	71%	0.711	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-17.7	173.6	0	0	0	0	0	112.9	D570	D570-A572 PolarHBondContact O-N 3.49Å; D570-A572 VanDerWaalsContact O-N 3.16Å; D570-A572 WeakPolarHBondContact OD1-CB 3.38Å; D570-A572 PolarHBondContact OD1-N 3.09Å
573	I	62.1	Low	73.5	Confident	6 Å²	6	69.4 Å²	69.4	3%	0.031	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.9	-3	-169.7	-55.9	-174.1	0	0	0	112.2	V565 D570 P571 N575 S576 T577 P631	V565-I573 HydrophobicContact CG1-CD1 3.42Å; V565-I573 VanDerWaalsContact CG1-CD1 3.42Å; D570-I573 HydrophobicContact CB-CB 4.36Å; D570-I573 PolarHBondContact O-N 3.32Å; P571-I573 VanDerWaalsContact C-N 3.3Å; I573-N575 VanDerWaalsContact C-N 3.31Å; I573-N575 PolarHBondContact O-N 3.2Å; I573-N575 VanDerWaalsContact O-N 3.17Å; I573-S576 CarbonylContact O-C 3.54Å; I573-S576 VanDerWaalsContact O-C 3.25Å; I573-S576 WeakPolarHBondContact O-CA 3.17Å; I573-S576 PolarHBondContact O-N 2.86Å; I573-S576 PolarHBondContact O-OG 3.01Å; I573-T577 PolarHBondContact O-N 3.42Å; I573-T577 VanDerWaalsContact O-N 3.07Å; I573-P631 HydrophobicContact CD1-CG 4.08Å
574	L	54.8	Low	73.2	Confident	102 Å²	102	70.2 Å²	70.2	53%	0.534	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-48.4	-47.8	-178.6	-167.9	70.1	0	0	0	113.5	P568 D570 S576 T577	P568-L574 WeakPolarHBondContact O-CD1 3.37Å; D570-L574 PolarHBondContact O-N 2.95Å; D570-L574 VanDerWaalsContact O-N 3.12Å; L574-S576 PolarHBondContact O-N 3.05Å; L574-T577 PolarHBondContact O-OG1 2.64Å
575	N	59.7	Low	73	Confident	170 Å²	170	68 Å²	68	91%	0.909	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-74.5	-3.9	178.6	-68.5	-10.2	0	0	0	114.5	I573	I573-N575 VanDerWaalsContact C-N 3.31Å; I573-N575 PolarHBondContact O-N 3.2Å; I573-N575 VanDerWaalsContact O-N 3.17Å
576	S	63.8	Low	72.7	Confident	40 Å²	40	74.4 Å²	74.4	28%	0.28	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-133.7	26.2	-176.3	63.8	0	0	0	0	112.4	I573 L574 R596	I573-S576 CarbonylContact O-C 3.54Å; I573-S576 VanDerWaalsContact O-C 3.25Å; I573-S576 WeakPolarHBondContact O-CA 3.17Å; I573-S576 PolarHBondContact O-N 2.86Å; I573-S576 PolarHBondContact O-OG 3.01Å; L574-S576 PolarHBondContact O-N 3.05Å; S576-R596 PolarHBondContact O-NH1 3.31Å; S576-R596 PolarHBondContact O-NH2 2.84Å
577	T	73.4	Confident	72.5	Confident	19 Å²	19	73.5 Å²	73.5	12%	0.117	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-68.1	128.7	164.6	53	0	0	0	0	109.8	W567 P568 I573 L574	W567-T577 HydrophobicContact CB-CG2 4.16Å; W567-T577 HydrophobicContact CG-CG2 4.29Å; P568-T577 HydrophobicContact CB-CG2 4.06Å; I573-T577 PolarHBondContact O-N 3.42Å; I573-T577 VanDerWaalsContact O-N 3.07Å; L574-T577 PolarHBondContact O-OG1 2.64Å
578	P	77.9	Confident	72	Confident	9 Å²	9	73.5 Å²	73.5	6%	0.058	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-76.7	133.5	177.4	23.7	-23.8	0	0	0	110.6	W567 R585 P595 R596	W567-P578 HydrophobicContact CD2-CG 4.24Å; W567-P578 HydrophobicContact CE3-CG 3.75Å; W567-P578 HydrophobicContact CH2-CG 3.36Å; W567-P578 HydrophobicContact CZ2-CG 3.82Å; W567-P578 HydrophobicContact CZ3-CG 3.31Å; P578-R585 WeakPolarHBondContact O-CD 3.4Å; P578-R585 WeakPolarHBondContact O-CG 3.46Å; P578-R585 PolarHBondContact O-NE 3.29Å; P578-P595 HydrophobicContact CB-CG 4.29Å; P578-P595 HydrophobicContact CG-CG 4.31Å; P578-R596 HydrophobicContact CB-CG 4.2Å
579	Q	78.9	Confident	72.7	Confident	108 Å²	108	71.5 Å²	71.5	51%	0.505	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	165.6	179.6	-67.6	-170.9	-17.4	0	0	113.1	K583 D584 R585	Q579-K583 CarbonylContact C-O 3.59Å; Q579-K583 VanDerWaalsContact CA-O 3.23Å; Q579-K583 WeakPolarHBondContact CA-O 3.48Å; Q579-K583 WeakPolarHBondContact CB-O 3.22Å; Q579-D584 VanDerWaalsContact CG-OD1 3.28Å; Q579-D584 WeakPolarHBondContact CG-OD1 3.32Å; Q579-D584 PolarHBondContact NE2-OD1 3.3Å; Q579-R585 PolarHBondContact O-NE 2.77Å; Q579-R585 PolarHBondContact O-NH2 3.47Å
580	F	79.4	Confident	74	Confident	48 Å²	48	65 Å²	65	21%	0.211	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	120.5	168.8	177.3	-114.6	0	0	0	107.8	G582 K583 R585 E608 W609 D611	F580-G582 PolarHBondContact O-N 2.87Å; F580-G582 VanDerWaalsContact O-N 3.15Å; F580-K583 PolarHBondContact N-O 2.87Å; F580-K583 PolarHBondContact O-N 2.7Å; F580-R585 HydrophobicContact CB-CG 4.21Å; F580-E608 HydrophobicContact CD2-CB 4.02Å; F580-E608 HydrophobicContact CE2-CB 3.91Å; F580-W609 WeakPolarHBondContact CD2-O 3.27Å; F580-W609 WeakPolarHBondContact CE2-O 3.31Å; F580-D611 HydrophobicContact CD1-CB 4.29Å
581	K	80.1	Confident	75.3	Confident	165 Å²	165	63.9 Å²	63.9	72%	0.717	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	37.8	-176.8	-55.7	-175.4	178.2	-176.2	0	114.8	E608	K581-E608 PolarHBondContact N-OE2 2.84Å
582	G	76.9	Confident	76.7	Confident	60 Å²	60	61.8 Å²	61.8	62%	0.619	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	21.2	179.3	0	0	0	0	0	115.4	F580	F580-G582 PolarHBondContact O-N 2.87Å; F580-G582 VanDerWaalsContact O-N 3.15Å
583	K	82.9	Confident	78.4	Confident	162 Å²	162	57.9 Å²	57.9	70%	0.704	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.3	147.8	168.1	-64.3	-174.1	177.6	-173.4	0	110	Q579 F580	Q579-K583 CarbonylContact C-O 3.59Å; Q579-K583 VanDerWaalsContact CA-O 3.23Å; Q579-K583 WeakPolarHBondContact CA-O 3.48Å; Q579-K583 WeakPolarHBondContact CB-O 3.22Å; F580-K583 PolarHBondContact N-O 2.87Å; F580-K583 PolarHBondContact O-N 2.7Å
584	D	82.8	Confident	79.6	Confident	87 Å²	87	57.8 Å²	57.8	47%	0.465	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	145.4	175.6	-44	-50.8	0	0	0	110.5	Q579	Q579-D584 VanDerWaalsContact CG-OD1 3.28Å; Q579-D584 WeakPolarHBondContact CG-OD1 3.32Å; Q579-D584 PolarHBondContact NE2-OD1 3.3Å
585	R	85.5	Confident	81.2	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.015	28%	0.276	C	S	.	.			trans	-74.3	141.2	-177.7	-75	168.6	-170.3	-96.9	-4.2	112.2	W567 P578 Q579 F580 W609 P610 D611	W567-R585 HydrophobicContact CE3-CB 4.3Å; P578-R585 WeakPolarHBondContact O-CD 3.4Å; P578-R585 WeakPolarHBondContact O-CG 3.46Å; P578-R585 PolarHBondContact O-NE 3.29Å; Q579-R585 PolarHBondContact O-NE 2.77Å; Q579-R585 PolarHBondContact O-NH2 3.47Å; F580-R585 HydrophobicContact CB-CG 4.21Å; R585-W609 PolarHBondContact NH1-O 2.86Å; R585-W609 VanDerWaalsContact NH1-O 3.08Å; R585-W609 PolarHBondContact NH2-O 2.83Å; R585-P610 PolarHBondContact NH1-O 2.95Å; R585-D611 WeakPolarHBondContact CA-OD1 3.49Å; R585-D611 VanDerWaalsContact CB-OD1 3.32Å; R585-D611 WeakPolarHBondContact CB-OD1 3.41Å
586	Q	81.8	Confident	82.4	Confident	136 Å²	136	50.7 Å²	50.7	64%	0.636	25%	0.253	S	S	*	.	S	Bend	trans	-99.8	-20.6	179.3	-65.3	-174.2	-13	0	0	112.9	D611	Q586-D611 PolarHBondContact N-OD1 3.42Å
587	H	84.1	Confident	83.5	Confident	17 Å²	17	50 Å²	50	8%	0.079	25%	0.246	C	C	.	.	S	Bend	trans	-123.7	132.4	176.1	-42	78.4	0	0	0	106.8	R536 D611 I613	R536-H587 PolarHBondContact NE-CD2 3.32Å; R536-H587 VanDerWaalsContact NE-CD2 3.35Å; R536-H587 PolarHBondContact NE-NE2 3.27Å; R536-H587 PolarHBondContact NH2-CE1 2.86Å; R536-H587 PolarHBondContact NH2-NE2 3.5Å; H587-D611 IonicContact CE1-OD2 3.42Å; H587-D611 PolarHBondContact CE1-OD2 2.99Å; H587-D611 IonicContact CG-OD2 2.72Å; H587-D611 PolarHBondContact N-OD1 3.47Å; H587-D611 IonicContact ND1-OD1 3.1Å; H587-D611 IonicContact ND1-OD2 3.78Å; H587-D611 PolarHBondContact ND1-OD2 3.45Å; H587-I613 HydrophobicContact CB-CG2 4.29Å
588	G	74	Confident	84.2	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.242	C	C	.	.			trans	-174.5	177.6	-157.5	0	0	0	0	0	117.3
589	S	86	Confident	84.8	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.258	C	S	.	.			trans	44.6	71.4	-178.5	38	0	0	0	0	114.1	C540 V565 K566 W567	C540-S589 WeakPolarHBondContact CB-O 3.35Å; C540-S589 PolarHBondContact N-O 2.61Å; V565-S589 WeakPolarHBondContact O-CB 3.37Å; V565-S589 PolarHBondContact O-OG 3.13Å; K566-S589 VanDerWaalsContact CA-OG 3.27Å; K566-S589 WeakPolarHBondContact CA-OG 3.39Å; W567-S589 PolarHBondContact N-OG 3.13Å
590	V	91.8	Very high	85.4	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-75.6	133.3	165.2	-179.4	0	0	0	0	108.9	H592 Q593 I613 W616 T670 L671	V590-H592 PolarHBondContact O-N 3.09Å; V590-Q593 HydrophobicContact CB-CB 4.18Å; V590-Q593 HydrophobicContact CG1-CB 4.01Å; V590-Q593 HydrophobicContact CG1-CG 4.44Å; V590-Q593 PolarHBondContact O-N 3.27Å; V590-Q593 VanDerWaalsContact O-O 3.13Å; V590-I613 HydrophobicContact CG2-CB 4.16Å; V590-I613 HydrophobicContact CG2-CD1 4.37Å; V590-I613 HydrophobicContact CG2-CG2 4.13Å; V590-W616 HydrophobicContact CB-CE3 4.37Å; V590-W616 HydrophobicContact CB-CZ3 4.05Å; V590-W616 HydrophobicContact CG2-CE3 3.79Å; V590-W616 HydrophobicContact CG2-CH2 4.37Å; V590-W616 HydrophobicContact CG2-CZ3 3.65Å; V590-T670 WeakPolarHBondContact CG1-OG1 3.44Å; V590-L671 HydrophobicContact CG1-CD1 4.2Å; V590-L671 HydrophobicContact CG1-CD2 4.04Å; V590-L671 HydrophobicContact CG1-CG 3.91Å; V590-L671 HydrophobicContact CG2-CD1 4Å; V590-L671 HydrophobicContact CG2-CD2 4.3Å; V590-L671 HydrophobicContact CG2-CG 4.44Å
591	C	91.1	Very high	86	Confident	3 Å²	3	52 Å²	52	2%	0.02	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	130.1	174.8	-64.2	0	0	0	0	111.2	C540 Q593 H632	C540-C591 WeakPolarHBondContact CA-SG 3.27Å; C540-C591 HydrophobicContact CB-CB 4.06Å; C540-C591 WeakPolarHBondContact CB-SG 3.45Å; C540-C591 WeakPolarHBondContact SG-CA 3.37Å; C540-C591 WeakPolarHBondContact SG-CB 3.47Å; C540-C591 CovalentContact SG-SG 2.04Å; C540-C591 PolarHBondContact SG-SG 2.84Å; C591-Q593 PolarHBondContact O-N 3.47Å; C591-Q593 VanDerWaalsContact O-N 3.13Å; C591-H632 CarbonylContact C-O 3.4Å; C591-H632 WeakPolarHBondContact CA-O 3.43Å
592	H	89.3	Confident	86.5	Confident	75 Å²	75	46 Å²	46	35%	0.347	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	14.6	177.1	-123.2	77.1	0	0	0	115.4	V590 H632 I633 C635 I637	V590-H592 PolarHBondContact O-N 3.09Å; H592-H632 PolarHBondContact N-O 3.19Å; H592-I633 PolarHBondContact CE1-O 3.48Å; H592-I633 PolarHBondContact ND1-O 3.43Å; H592-C635 PolarHBondContact CE1-O 2.95Å; H592-C635 PolarHBondContact ND1-O 2.94Å; H592-I637 HydrophobicContact CB-CD1 3.4Å; H592-I637 VanDerWaalsContact CB-CD1 3.4Å; H592-I637 HydrophobicContact CB-CG1 3.8Å
593	Q	89.7	Confident	87.1	Confident	5 Å²	5	44.1 Å²	44.1	2%	0.023	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-134.6	121	173	-65.9	-174.9	0.7	0	0	111.5	V590 C591 C619 T670	V590-Q593 HydrophobicContact CB-CB 4.18Å; V590-Q593 HydrophobicContact CG1-CB 4.01Å; V590-Q593 HydrophobicContact CG1-CG 4.44Å; V590-Q593 PolarHBondContact O-N 3.27Å; V590-Q593 VanDerWaalsContact O-O 3.13Å; C591-Q593 PolarHBondContact O-N 3.47Å; C591-Q593 VanDerWaalsContact O-N 3.13Å; Q593-C619 HydrophobicContact CG-CB 4.28Å; Q593-T670 HydrophobicContact CG-CG2 4.19Å; Q593-T670 PolarHBondContact NE2-OG1 3.08Å; Q593-T670 VanDerWaalsContact NE2-OG1 3.08Å; Q593-T670 PolarHBondContact OE1-OG1 2.82Å
594	D	88.1	Confident	87.3	Confident	3 Å²	3	41 Å²	41	2%	0.016	21%	0.214	C	C	.	.			trans	-137.4	131.7	173	-169.3	-62.7	0	0	0	109.7	W567 R596 I597 C598 H632 I633	W567-D594 WeakPolarHBondContact CZ2-OD2 3.09Å; D594-R596 PolarHBondContact O-N 3.49Å; D594-R596 VanDerWaalsContact OD1-CB 3.29Å; D594-R596 WeakPolarHBondContact OD1-CB 3.19Å; D594-R596 WeakPolarHBondContact OD1-CG 3.2Å; D594-R596 IonicContact OD1-CZ 3.14Å; D594-R596 PolarHBondContact OD1-N 2.6Å; D594-R596 IonicContact OD1-NE 3.23Å; D594-R596 PolarHBondContact OD1-NE 2.89Å; D594-R596 IonicContact OD1-NH2 3.31Å; D594-R596 IonicContact OD2-CZ 2.68Å; D594-R596 IonicContact OD2-NE 2.81Å; D594-R596 PolarHBondContact OD2-NE 2.9Å; D594-R596 IonicContact OD2-NH2 3Å; D594-R596 PolarHBondContact OD2-NH2 3.34Å; D594-I597 HydrophobicContact CB-CB 4.48Å; D594-I597 HydrophobicContact CB-CD1 3.83Å; D594-I597 HydrophobicContact CB-CG1 4.29Å; D594-I597 PolarHBondContact O-N 3.25Å; D594-C598 PolarHBondContact O-N 3.37Å; D594-C598 VanDerWaalsContact O-N 3.17Å; D594-H632 IonicContact OD2-CE1 4Å; D594-H632 IonicContact OD2-NE2 3.52Å; D594-H632 PolarHBondContact OD2-NE2 3.23Å; D594-H632 VanDerWaalsContact OD2-NE2 3.15Å; D594-I633 HydrophobicContact CB-CD1 3.82Å; D594-I633 HydrophobicContact CB-CG1 4.16Å
595	P	88.7	Confident	87.4	Confident	12 Å²	12	41 Å²	41	8%	0.078	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-18.8	-177.7	22.8	-33.9	0	0	0	114.1	P578 S603 W609 W616	P578-P595 HydrophobicContact CB-CG 4.29Å; P578-P595 HydrophobicContact CG-CG 4.31Å; P595-S603 VanDerWaalsContact CB-CB 3.46Å; P595-S603 WeakPolarHBondContact O-CB 3.04Å; P595-W609 HydrophobicContact CB-CD2 4.19Å; P595-W609 HydrophobicContact CB-CE3 3.88Å; P595-W609 HydrophobicContact CB-CZ3 4.39Å; P595-W616 HydrophobicContact CG-CH2 4.37Å
596	R	84.8	Confident	87.4	Confident	112 Å²	112	46.2 Å²	46.2	42%	0.423	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-21	177.9	-60.9	170.1	-73.4	-168.7	-7.1	114.1	S576 P578 D594	S576-R596 PolarHBondContact O-NH1 3.31Å; S576-R596 PolarHBondContact O-NH2 2.84Å; P578-R596 HydrophobicContact CB-CG 4.2Å; D594-R596 PolarHBondContact O-N 3.49Å; D594-R596 VanDerWaalsContact OD1-CB 3.29Å; D594-R596 WeakPolarHBondContact OD1-CB 3.19Å; D594-R596 WeakPolarHBondContact OD1-CG 3.2Å; D594-R596 IonicContact OD1-CZ 3.14Å; D594-R596 PolarHBondContact OD1-N 2.6Å; D594-R596 IonicContact OD1-NE 3.23Å; D594-R596 PolarHBondContact OD1-NE 2.89Å; D594-R596 IonicContact OD1-NH2 3.31Å; D594-R596 IonicContact OD2-CZ 2.68Å; D594-R596 IonicContact OD2-NE 2.81Å; D594-R596 PolarHBondContact OD2-NE 2.9Å; D594-R596 IonicContact OD2-NH2 3Å; D594-R596 PolarHBondContact OD2-NH2 3.34Å
597	I	85.9	Confident	87.6	Confident	25 Å²	25	46.8 Å²	46.8	13%	0.128	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-24.7	-169	-58.2	163.6	0	0	0	111.2	D594 L599 N623 T628 L630 I633	D594-I597 HydrophobicContact CB-CB 4.48Å; D594-I597 HydrophobicContact CB-CD1 3.83Å; D594-I597 HydrophobicContact CB-CG1 4.29Å; D594-I597 PolarHBondContact O-N 3.25Å; I597-L599 PolarHBondContact O-N 2.98Å; I597-N623 PolarHBondContact O-N 3Å; I597-T628 HydrophobicContact CD1-CG2 3.96Å; I597-T628 HydrophobicContact CG2-CG2 4.44Å; I597-L630 HydrophobicContact CD1-CD1 3.65Å; I597-I633 HydrophobicContact CD1-CB 4.39Å; I597-I633 HydrophobicContact CD1-CD1 4.47Å; I597-I633 HydrophobicContact CD1-CG1 3.84Å; I597-I633 HydrophobicContact CD1-CG2 4.08Å
598	C	89.4	Confident	87.8	Confident	7 Å²	7	48.7 Å²	48.7	5%	0.047	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	122.7	175.8	-163	0	0	0	0	111.5	D594 E600 A602 W609 C619	D594-C598 PolarHBondContact O-N 3.37Å; D594-C598 VanDerWaalsContact O-N 3.17Å; C598-E600 VanDerWaalsContact SG-C 3.57Å; C598-E600 PolarHBondContact SG-O 2.94Å; C598-A602 WeakPolarHBondContact O-CA 3.3Å; C598-W609 HydrophobicContact CB-CH2 3.7Å; C598-W609 HydrophobicContact CB-CZ2 3.77Å; C598-C619 WeakPolarHBondContact CA-SG 3.3Å; C598-C619 HydrophobicContact CB-CB 4.03Å; C598-C619 WeakPolarHBondContact CB-SG 3.48Å; C598-C619 WeakPolarHBondContact SG-CA 3.29Å; C598-C619 WeakPolarHBondContact SG-CB 3.46Å; C598-C619 CovalentContact SG-SG 2.03Å; C598-C619 PolarHBondContact SG-SG 3.44Å
599	L	89.9	Confident	88.7	Confident	74 Å²	74	49.2 Å²	49.2	39%	0.387	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-35.4	175.9	-59.9	178.3	0	0	0	111.5	I597 A602 R621 N623	I597-L599 PolarHBondContact O-N 2.98Å; L599-A602 WeakPolarHBondContact O-CB 3.3Å; L599-A602 PolarHBondContact O-N 3.46Å; L599-R621 WeakPolarHBondContact CA-O 3.18Å; L599-R621 WeakPolarHBondContact CB-O 3.26Å; L599-R621 HydrophobicContact CD1-CG 4.34Å; L599-R621 PolarHBondContact N-O 3.04Å; L599-N623 HydrophobicContact CD1-CB 4.19Å; L599-N623 HydrophobicContact CD2-CB 4.3Å; L599-N623 HydrophobicContact CG-CB 4.25Å
600	E	90.4	Very high	88.9	Confident	87 Å²	87	51.1 Å²	51.1	41%	0.407	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	115.3	179.3	-78	171.4	-174	0	0	110.5	C598 T620 R621	C598-E600 VanDerWaalsContact SG-C 3.57Å; C598-E600 PolarHBondContact SG-O 2.94Å; E600-T620 PolarHBondContact O-N 3.15Å; E600-T620 PolarHBondContact O-OG1 2.81Å; E600-R621 HydrophobicContact CB-CB 4.19Å; E600-R621 PolarHBondContact N-O 3.48Å; E600-R621 PolarHBondContact O-N 3.47Å; E600-R621 IonicContact OE1-CZ 3.75Å; E600-R621 IonicContact OE1-NH1 3.15Å; E600-R621 PolarHBondContact OE1-NH1 3.41Å; E600-R621 IonicContact OE1-NH2 2.85Å; E600-R621 PolarHBondContact OE1-NH2 3.23Å; E600-R621 IonicContact OE2-CZ 3.46Å; E600-R621 IonicContact OE2-NH1 3.68Å; E600-R621 PolarHBondContact OE2-NH1 3.34Å; E600-R621 IonicContact OE2-NH2 2.85Å
601	P	93	Very high	88.8	Confident	58 Å²	58	52.7 Å²	52.7	38%	0.377	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	cis	-81.3	117.3	-9.6	32.7	-31.8	0	0	0	112.2	S603 W609 P617 I618	P601-S603 PolarHBondContact O-N 2.61Å; P601-W609 HydrophobicContact CG-CZ2 4.42Å; P601-W609 VanDerWaalsContact O-CZ2 3.26Å; P601-W609 WeakPolarHBondContact O-CZ2 3.2Å; P601-W609 PolarHBondContact O-NE1 3.21Å; P601-P617 HydrophobicContact CG-CB 3.73Å; P601-P617 HydrophobicContact CG-CG 3.46Å; P601-P617 VanDerWaalsContact CG-CG 3.46Å; P601-I618 WeakPolarHBondContact CD-O 3.35Å
602	A	89.6	Confident	88.8	Confident	39 Å²	39	53.6 Å²	53.6	32%	0.322	29%	0.294	S	S	.	.			trans	-59.3	134.6	178.8	0	0	0	0	0	113.4	C598 L599 V604	C598-A602 WeakPolarHBondContact O-CA 3.3Å; L599-A602 WeakPolarHBondContact O-CB 3.3Å; L599-A602 PolarHBondContact O-N 3.46Å; A602-V604 VanDerWaalsContact C-N 3.28Å; A602-V604 HydrophobicContact CB-CG1 4.27Å; A602-V604 HydrophobicContact CB-CG2 4.39Å; A602-V604 PolarHBondContact O-N 2.92Å
603	S	89.8	Confident	88.9	Confident	21 Å²	21	50 Å²	50	15%	0.147	28%	0.278	C	S	.	.			trans	-80.4	67.6	177.3	176.6	0	0	0	0	111.8	P595 P601 W609	P595-S603 VanDerWaalsContact CB-CB 3.46Å; P595-S603 WeakPolarHBondContact O-CB 3.04Å; P601-S603 PolarHBondContact O-N 2.61Å; S603-W609 VanDerWaalsContact CB-CD1 3.5Å; S603-W609 PolarHBondContact OG-N 3.02Å
604	V	88.1	Confident	89.1	Confident	96 Å²	96	50.6 Å²	50.6	58%	0.582	28%	0.281	S	S	*	.			trans	-114.6	142.6	-178.8	-65.4	0	0	0	0	112	A602 H607 E608	A602-V604 VanDerWaalsContact C-N 3.28Å; A602-V604 HydrophobicContact CB-CG1 4.27Å; A602-V604 HydrophobicContact CB-CG2 4.39Å; A602-V604 PolarHBondContact O-N 2.92Å; V604-H607 CarbonylContact O-C 3.57Å; V604-H607 VanDerWaalsContact O-CA 3.31Å; V604-H607 WeakPolarHBondContact O-CA 3.34Å; V604-H607 PolarHBondContact O-N 3.1Å; V604-E608 PolarHBondContact O-N 3.49Å
605	S	84.8	Confident	89.3	Confident	88 Å²	88	56.8 Å²	56.8	62%	0.615	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	134.9	-179.7	-136	0	0	0	0	111.3	E608	S605-E608 VanDerWaalsContact CB-OE1 3.23Å; S605-E608 WeakPolarHBondContact CB-OE1 3.39Å; S605-E608 PolarHBondContact OG-OE1 2.82Å
606	P	84.8	Confident	89.4	Confident	112 Å²	112	56.5 Å²	56.5	73%	0.727	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87.2	0.2	9.9	36	-37.3	0	0	0	115.3	E608	P606-E608 PolarHBondContact O-N 2.92Å
607	H	86.9	Confident	89.8	Confident	148 Å²	148	53.5 Å²	53.5	69%	0.685	30%	0.301	S	S	*	.	S	Bend	trans	-98.8	40.9	-176.5	-60.4	-69.3	0	0	0	112.8	V604 W609	V604-H607 CarbonylContact O-C 3.57Å; V604-H607 VanDerWaalsContact O-CA 3.31Å; V604-H607 WeakPolarHBondContact O-CA 3.34Å; V604-H607 PolarHBondContact O-N 3.1Å; H607-W609 PolarHBondContact O-N 3.25Å
608	E	88.8	Confident	90.1	Very high	58 Å²	58	54.7 Å²	54.7	27%	0.271	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-59.5	133.2	170.8	-75.3	164	-126.1	0	0	110.9	F580 K581 V604 S605 P606	F580-E608 HydrophobicContact CD2-CB 4.02Å; F580-E608 HydrophobicContact CE2-CB 3.91Å; K581-E608 PolarHBondContact N-OE2 2.84Å; V604-E608 PolarHBondContact O-N 3.49Å; S605-E608 VanDerWaalsContact CB-OE1 3.23Å; S605-E608 WeakPolarHBondContact CB-OE1 3.39Å; S605-E608 PolarHBondContact OG-OE1 2.82Å; P606-E608 PolarHBondContact O-N 2.92Å
609	W	91.3	Very high	90.2	Very high	10 Å²	10	55.5 Å²	55.5	4%	0.038	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-62.9	135.4	174.4	-62.6	5	0	0	0	109.6	F580 R585 P595 C598 P601 S603 H607 W616 P617 C619	F580-W609 WeakPolarHBondContact CD2-O 3.27Å; F580-W609 WeakPolarHBondContact CE2-O 3.31Å; R585-W609 PolarHBondContact NH1-O 2.86Å; R585-W609 VanDerWaalsContact NH1-O 3.08Å; R585-W609 PolarHBondContact NH2-O 2.83Å; P595-W609 HydrophobicContact CB-CD2 4.19Å; P595-W609 HydrophobicContact CB-CE3 3.88Å; P595-W609 HydrophobicContact CB-CZ3 4.39Å; C598-W609 HydrophobicContact CB-CH2 3.7Å; C598-W609 HydrophobicContact CB-CZ2 3.77Å; P601-W609 HydrophobicContact CG-CZ2 4.42Å; P601-W609 VanDerWaalsContact O-CZ2 3.26Å; P601-W609 WeakPolarHBondContact O-CZ2 3.2Å; P601-W609 PolarHBondContact O-NE1 3.21Å; S603-W609 VanDerWaalsContact CB-CD1 3.5Å; S603-W609 PolarHBondContact OG-N 3.02Å; H607-W609 PolarHBondContact O-N 3.25Å; W609-W616 HydrophobicContact CE3-CB 4.28Å; W609-W616 AromaticContact CE3-CD2 3.6Å; W609-W616 HydrophobicContact CE3-CD2 3.6Å; W609-W616 AromaticContact CE3-CE3 3.67Å; W609-W616 HydrophobicContact CE3-CE3 3.67Å; W609-W616 AromaticContact CE3-CG 3.89Å; W609-W616 HydrophobicContact CE3-CG 3.89Å; W609-W616 HydrophobicContact CE3-CZ3 4.25Å; W609-W616 HydrophobicContact CZ3-CD2 4.06Å; W609-W616 AromaticContact CZ3-CE3 3.65Å; W609-W616 HydrophobicContact CZ3-CE3 3.65Å; W609-W616 HydrophobicContact CZ3-CZ3 4.15Å; W609-P617 HydrophobicContact CD2-CG 4.23Å; W609-P617 HydrophobicContact CG-CG 4.48Å; W609-P617 HydrophobicContact CZ2-CG 3.98Å; W609-C619 HydrophobicContact CH2-CB 4.33Å
610	P	91.3	Very high	90.2	Very high	40 Å²	40	56.9 Å²	56.9	26%	0.26	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-63.5	161.2	-177.6	28.3	-35.8	0	0	0	112.1	R585 D612 K615 W616	R585-P610 PolarHBondContact NH1-O 2.95Å; P610-D612 VanDerWaalsContact C-N 3.27Å; P610-D612 PolarHBondContact O-N 3.4Å; P610-K615 HydrophobicContact CG-CB 3.64Å; P610-W616 PolarHBondContact O-NE1 3.29Å
611	D	89.6	Confident	90	Very high	34 Å²	34	58.2 Å²	58.2	18%	0.182	33%	0.325	C	S	.	.	S	Bend	trans	-59.4	-38.2	172.4	175.4	68.1	0	0	0	112.2	F580 R585 Q586 H587 I613	F580-D611 HydrophobicContact CD1-CB 4.29Å; R585-D611 WeakPolarHBondContact CA-OD1 3.49Å; R585-D611 VanDerWaalsContact CB-OD1 3.32Å; R585-D611 WeakPolarHBondContact CB-OD1 3.41Å; Q586-D611 PolarHBondContact N-OD1 3.42Å; H587-D611 IonicContact CE1-OD2 3.42Å; H587-D611 PolarHBondContact CE1-OD2 2.99Å; H587-D611 IonicContact CG-OD2 2.72Å; H587-D611 PolarHBondContact N-OD1 3.47Å; H587-D611 IonicContact ND1-OD1 3.1Å; H587-D611 IonicContact ND1-OD2 3.78Å; H587-D611 PolarHBondContact ND1-OD2 3.45Å; D611-I613 PolarHBondContact O-N 3.3Å; D611-I613 VanDerWaalsContact O-N 3.1Å
612	D	91.3	Very high	89.7	Confident	21 Å²	21	61.8 Å²	61.8	11%	0.112	33%	0.332	C	S	.	.			trans	-67.6	103.9	176.8	-177.3	-2.5	0	0	0	112.3	P610 T614 K615	P610-D612 VanDerWaalsContact C-N 3.27Å; P610-D612 PolarHBondContact O-N 3.4Å; D612-T614 VanDerWaalsContact CG-OG1 3.27Å; D612-T614 PolarHBondContact O-N 3.14Å; D612-T614 VanDerWaalsContact O-N 3.12Å; D612-T614 WeakPolarHBondContact OD1-CB 3.15Å; D612-T614 PolarHBondContact OD1-N 3.05Å; D612-T614 VanDerWaalsContact OD1-N 3.11Å; D612-T614 PolarHBondContact OD1-OG1 3.35Å; D612-T614 PolarHBondContact OD2-OG1 2.03Å; D612-K615 PolarHBondContact O-N 3.04Å; D612-K615 IonicContact OD2-NZ 2.88Å; D612-K615 PolarHBondContact OD2-NZ 3.19Å
613	I	92.1	Very high	89.1	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-57.9	-24.5	-178.9	62.9	175.2	0	0	0	113.6	E535 H587 V590 D611 K615 W616 L671	E535-I613 WeakPolarHBondContact O-CD1 3.41Å; H587-I613 HydrophobicContact CB-CG2 4.29Å; V590-I613 HydrophobicContact CG2-CB 4.16Å; V590-I613 HydrophobicContact CG2-CD1 4.37Å; V590-I613 HydrophobicContact CG2-CG2 4.13Å; D611-I613 PolarHBondContact O-N 3.3Å; D611-I613 VanDerWaalsContact O-N 3.1Å; I613-K615 PolarHBondContact O-N 3.02Å; I613-W616 HydrophobicContact CB-CD2 4.41Å; I613-W616 HydrophobicContact CG2-CD2 4.22Å; I613-W616 HydrophobicContact CG2-CH2 4.2Å; I613-W616 HydrophobicContact CG2-CZ2 3.76Å; I613-W616 WeakPolarHBondContact O-CB 3.48Å; I613-W616 PolarHBondContact O-N 3.44Å; I613-W616 VanDerWaalsContact O-N 3.1Å; I613-L671 HydrophobicContact CB-CD1 4.49Å; I613-L671 WeakPolarHBondContact O-CD1 3.47Å
614	T	92.7	Very high	88	Confident	17 Å²	17	69.1 Å²	69.1	10%	0.104	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-68.4	-8	177.7	68.4	0	0	0	0	113.8	K532 E535 R536 D612 S673	K532-T614 HydrophobicContact CB-CG2 4.22Å; K532-T614 VanDerWaalsContact O-CG2 3.3Å; K532-T614 WeakPolarHBondContact O-CG2 3.35Å; E535-T614 HydrophobicContact CG-CG2 4.5Å; R536-T614 HydrophobicContact CB-CG2 3.75Å; D612-T614 VanDerWaalsContact CG-OG1 3.27Å; D612-T614 PolarHBondContact O-N 3.14Å; D612-T614 VanDerWaalsContact O-N 3.12Å; D612-T614 WeakPolarHBondContact OD1-CB 3.15Å; D612-T614 PolarHBondContact OD1-N 3.05Å; D612-T614 VanDerWaalsContact OD1-N 3.11Å; D612-T614 PolarHBondContact OD1-OG1 3.35Å; D612-T614 PolarHBondContact OD2-OG1 2.03Å; T614-S673 WeakPolarHBondContact CA-OG 3.26Å; T614-S673 VanDerWaalsContact O-CB 3.23Å; T614-S673 WeakPolarHBondContact O-CB 3.2Å; T614-S673 PolarHBondContact O-OG 2.62Å
615	K	91.6	Very high	86.8	Confident	134 Å²	134	66.9 Å²	66.9	58%	0.583	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-112.6	13.3	177.4	-58.4	-170.4	179.4	78.2	0	112.9	P610 D612 I613	P610-K615 HydrophobicContact CG-CB 3.64Å; D612-K615 PolarHBondContact O-N 3.04Å; D612-K615 IonicContact OD2-NZ 2.88Å; D612-K615 PolarHBondContact OD2-NZ 3.19Å; I613-K615 PolarHBondContact O-N 3.02Å
616	W	92.1	Very high	86	Confident	6 Å²	6	70.5 Å²	70.5	2%	0.023	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-79.1	131.1	177.6	-75	17.7	0	0	0	111.5	W567 V590 P595 W609 P610 I613 Q674	W567-W616 HydrophobicContact CH2-CH2 4.07Å; W567-W616 AromaticContact CZ3-CH2 3.85Å; W567-W616 HydrophobicContact CZ3-CH2 3.85Å; W567-W616 HydrophobicContact CZ3-CZ2 4.37Å; V590-W616 HydrophobicContact CB-CE3 4.37Å; V590-W616 HydrophobicContact CB-CZ3 4.05Å; V590-W616 HydrophobicContact CG2-CE3 3.79Å; V590-W616 HydrophobicContact CG2-CH2 4.37Å; V590-W616 HydrophobicContact CG2-CZ3 3.65Å; P595-W616 HydrophobicContact CG-CH2 4.37Å; W609-W616 HydrophobicContact CE3-CB 4.28Å; W609-W616 AromaticContact CE3-CD2 3.6Å; W609-W616 HydrophobicContact CE3-CD2 3.6Å; W609-W616 AromaticContact CE3-CE3 3.67Å; W609-W616 HydrophobicContact CE3-CE3 3.67Å; W609-W616 AromaticContact CE3-CG 3.89Å; W609-W616 HydrophobicContact CE3-CG 3.89Å; W609-W616 HydrophobicContact CE3-CZ3 4.25Å; W609-W616 HydrophobicContact CZ3-CD2 4.06Å; W609-W616 AromaticContact CZ3-CE3 3.65Å; W609-W616 HydrophobicContact CZ3-CE3 3.65Å; W609-W616 HydrophobicContact CZ3-CZ3 4.15Å; P610-W616 PolarHBondContact O-NE1 3.29Å; I613-W616 HydrophobicContact CB-CD2 4.41Å; I613-W616 HydrophobicContact CG2-CD2 4.22Å; I613-W616 HydrophobicContact CG2-CH2 4.2Å; I613-W616 HydrophobicContact CG2-CZ2 3.76Å; I613-W616 WeakPolarHBondContact O-CB 3.48Å; I613-W616 PolarHBondContact O-N 3.44Å; I613-W616 VanDerWaalsContact O-N 3.1Å; W616-Q674 WeakPolarHBondContact O-CG 3.5Å; W616-Q674 PolarHBondContact O-NE2 3.05Å
617	P	92.6	Very high	85.3	Confident	49 Å²	49	71.5 Å²	71.5	32%	0.318	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-69.9	157.3	174.4	32.4	-36.2	0	0	0	111.4	P601 W609 C619 Q674	P601-P617 HydrophobicContact CG-CB 3.73Å; P601-P617 HydrophobicContact CG-CG 3.46Å; P601-P617 VanDerWaalsContact CG-CG 3.46Å; W609-P617 HydrophobicContact CD2-CG 4.23Å; W609-P617 HydrophobicContact CG-CG 4.48Å; W609-P617 HydrophobicContact CZ2-CG 3.98Å; P617-C619 PolarHBondContact O-N 3.1Å; P617-Q674 PolarHBondContact O-NE2 3.23Å
618	I	92.8	Very high	84.8	Confident	49 Å²	49	66.6 Å²	66.6	25%	0.251	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-64	127.9	172	-60.8	171.8	0	0	0	109.2	P601 T620 E668 A669 Q674	P601-I618 WeakPolarHBondContact CD-O 3.35Å; I618-T620 PolarHBondContact O-N 3.47Å; I618-E668 HydrophobicContact CD1-CG 4.25Å; I618-E668 WeakPolarHBondContact CG2-O 3.28Å; I618-A669 HydrophobicContact CD1-CB 4.3Å; I618-Q674 HydrophobicContact CD1-CB 4.21Å; I618-Q674 HydrophobicContact CG1-CB 3.75Å; I618-Q674 HydrophobicContact CG1-CG 3.99Å
619	C	90.9	Very high	84.4	Confident	24 Å²	24	70.7 Å²	70.7	16%	0.162	38%	0.376	C	S	.	.			trans	-79	112.5	171.6	-170.2	0	0	0	0	110.6	Q593 C598 W609 P617 R621	Q593-C619 HydrophobicContact CG-CB 4.28Å; C598-C619 WeakPolarHBondContact CA-SG 3.3Å; C598-C619 HydrophobicContact CB-CB 4.03Å; C598-C619 WeakPolarHBondContact CB-SG 3.48Å; C598-C619 WeakPolarHBondContact SG-CA 3.29Å; C598-C619 WeakPolarHBondContact SG-CB 3.46Å; C598-C619 CovalentContact SG-SG 2.03Å; C598-C619 PolarHBondContact SG-SG 3.44Å; W609-C619 HydrophobicContact CH2-CB 4.33Å; P617-C619 PolarHBondContact O-N 3.1Å; C619-R621 PolarHBondContact SG-O 3.5Å
620	T	90.3	Very high	83.9	Confident	104 Å²	104	71.3 Å²	71.3	64%	0.638	38%	0.38	S	S	*	.			trans	-91.7	-26.8	-177.9	61.1	0	0	0	0	113.1	E600 I618	E600-T620 PolarHBondContact O-N 3.15Å; E600-T620 PolarHBondContact O-OG1 2.81Å; I618-T620 PolarHBondContact O-N 3.47Å
621	R	87	Confident	83.6	Confident	114 Å²	114	72 Å²	72	43%	0.43	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	123.8	172.8	-168.5	178.2	69.2	-129	-5.5	111.5	L599 E600 C619	L599-R621 WeakPolarHBondContact CA-O 3.18Å; L599-R621 WeakPolarHBondContact CB-O 3.26Å; L599-R621 HydrophobicContact CD1-CG 4.34Å; L599-R621 PolarHBondContact N-O 3.04Å; E600-R621 HydrophobicContact CB-CB 4.19Å; E600-R621 PolarHBondContact N-O 3.48Å; E600-R621 PolarHBondContact O-N 3.47Å; E600-R621 IonicContact OE1-CZ 3.75Å; E600-R621 IonicContact OE1-NH1 3.15Å; E600-R621 PolarHBondContact OE1-NH1 3.41Å; E600-R621 IonicContact OE1-NH2 2.85Å; E600-R621 PolarHBondContact OE1-NH2 3.23Å; E600-R621 IonicContact OE2-CZ 3.46Å; E600-R621 IonicContact OE2-NH1 3.68Å; E600-R621 PolarHBondContact OE2-NH1 3.34Å; E600-R621 IonicContact OE2-NH2 2.85Å; C619-R621 PolarHBondContact SG-O 3.5Å
622	Y	85.6	Confident	83.5	Confident	134 Å²	134	70.3 Å²	70.3	53%	0.525	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	162.1	170.2	55.4	-86.2	0	0	0	111	T624	Y622-T624 HydrophobicContact CD2-CG2 4.08Å; Y622-T624 HydrophobicContact CE2-CG2 3.73Å; Y622-T624 PolarHBondContact O-N 3.37Å
623	N	77.9	Confident	83.3	Confident	100 Å²	100	70.2 Å²	70.2	54%	0.535	38%	0.375	S	S	.	.			trans	-76	116.3	170.9	-171.2	10.4	0	0	0	110.4	I597 L599 G625	I597-N623 PolarHBondContact O-N 3Å; L599-N623 HydrophobicContact CD1-CB 4.19Å; L599-N623 HydrophobicContact CD2-CB 4.3Å; L599-N623 HydrophobicContact CG-CB 4.25Å; N623-G625 PolarHBondContact O-N 3.37Å
624	T	64.8	Low	83.1	Confident	113 Å²	113	73 Å²	73	69%	0.693	39%	0.39	S	S	*	.			trans	-81.5	46.8	-173.5	61.9	0	0	0	0	113.1	Y622	Y622-T624 HydrophobicContact CD2-CG2 4.08Å; Y622-T624 HydrophobicContact CE2-CG2 3.73Å; Y622-T624 PolarHBondContact O-N 3.37Å
625	G	64.4	Low	82.9	Confident	49 Å²	49	72.9 Å²	72.9	51%	0.505	39%	0.39	S	S	.	.			trans	-75.3	153.7	173.4	0	0	0	0	0	112.1	N623 H627	N623-G625 PolarHBondContact O-N 3.37Å; G625-H627 PolarHBondContact O-N 3.38Å
626	N	67	Low	82.8	Confident	164 Å²	164	70.7 Å²	70.7	88%	0.877	39%	0.388	S	S	*	.	S	Bend	trans	-67.5	115.8	169.3	-87.6	-5.4	0	0	0	109.8
627	H	71.2	Confident	82.7	Confident	133 Å²	133	72.1 Å²	72.1	62%	0.616	40%	0.395	S	S	*	.			trans	48.5	105.1	170.5	-68.1	-67.9	0	0	0	116.1	G625 N629 D634	G625-H627 PolarHBondContact O-N 3.38Å; H627-N629 PolarHBondContact O-N 2.67Å; H627-N629 PolarHBondContact O-ND2 3.5Å; H627-D634 VanDerWaalsContact CA-OD2 3.26Å; H627-D634 WeakPolarHBondContact CA-OD2 3.46Å; H627-D634 WeakPolarHBondContact CB-OD2 3.46Å; H627-D634 IonicContact CG-OD2 3.71Å; H627-D634 IonicContact ND1-OD2 3.57Å; H627-D634 PolarHBondContact ND1-OD2 3.22Å
628	T	75.1	Confident	82.7	Confident	46 Å²	46	72.4 Å²	72.4	28%	0.282	40%	0.396	S	S	.	.			trans	-71.1	-11	177.4	65.2	0	0	0	0	113.1	I597 L630 I633 D634	I597-T628 HydrophobicContact CD1-CG2 3.96Å; I597-T628 HydrophobicContact CG2-CG2 4.44Å; T628-L630 PolarHBondContact O-N 3.31Å; T628-L630 PolarHBondContact OG1-N 3.18Å; T628-I633 HydrophobicContact CG2-CG2 4.02Å; T628-D634 WeakPolarHBondContact CB-OD1 2.97Å; T628-D634 PolarHBondContact N-OD1 2.98Å; T628-D634 PolarHBondContact N-OD2 3.47Å; T628-D634 PolarHBondContact OG1-OD1 3.33Å
629	N	80.1	Confident	82.6	Confident	143 Å²	143	70.3 Å²	70.3	77%	0.765	39%	0.386	S	S	*	.	S	Bend	trans	61.1	15	-171.5	-56.8	-76.7	0	0	0	113.5	H627 D634	H627-N629 PolarHBondContact O-N 2.67Å; H627-N629 PolarHBondContact O-ND2 3.5Å; N629-D634 PolarHBondContact N-OD2 2.98Å
630	L	82.1	Confident	82.8	Confident	23 Å²	23	71.8 Å²	71.8	12%	0.12	39%	0.389	C	S	.	.			trans	-101.6	116.3	174.7	-66.6	173.4	0	0	0	108.7	I597 T628 H632 I633 D634	I597-L630 HydrophobicContact CD1-CD1 3.65Å; T628-L630 PolarHBondContact O-N 3.31Å; T628-L630 PolarHBondContact OG1-N 3.18Å; L630-H632 PolarHBondContact O-N 3.45Å; L630-I633 HydrophobicContact CB-CB 4.18Å; L630-I633 HydrophobicContact CB-CG1 4.1Å; L630-I633 PolarHBondContact O-N 3.44Å; L630-D634 PolarHBondContact O-N 2.9Å
631	P	85.2	Confident	83	Confident	54 Å²	54	66.9 Å²	66.9	35%	0.351	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-27.3	-170	25.4	-34.3	0	0	0	113.1	V565 I573 I633 C635	V565-P631 HydrophobicContact CG1-CG 4.21Å; V565-P631 HydrophobicContact CG2-CB 4.41Å; V565-P631 HydrophobicContact CG2-CG 4.05Å; I573-P631 HydrophobicContact CD1-CG 4.08Å; P631-I633 VanDerWaalsContact C-N 3.28Å; P631-I633 PolarHBondContact O-N 2.9Å; P631-C635 WeakPolarHBondContact O-CB 3.26Å; P631-C635 PolarHBondContact O-SG 2.95Å
632	H	86.7	Confident	83.4	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-7.9	174.5	64.3	-73.9	0	0	0	114	C540 V565 W567 C591 H592 D594 L630	C540-H632 HydrophobicContact CB-CB 3.76Å; V565-H632 HydrophobicContact CG1-CB 4.41Å; W567-H632 AromaticContact CZ2-CE1 3.95Å; W567-H632 AromaticContact CZ2-NE2 3.62Å; C591-H632 CarbonylContact C-O 3.4Å; C591-H632 WeakPolarHBondContact CA-O 3.43Å; H592-H632 PolarHBondContact N-O 3.19Å; D594-H632 IonicContact OD2-CE1 4Å; D594-H632 IonicContact OD2-NE2 3.52Å; D594-H632 PolarHBondContact OD2-NE2 3.23Å; D594-H632 VanDerWaalsContact OD2-NE2 3.15Å; L630-H632 PolarHBondContact O-N 3.45Å
633	I	87.1	Confident	83.7	Confident	18 Å²	18	55.1 Å²	55.1	9%	0.092	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-46.3	-179.1	-61	-60.9	0	0	0	111.9	H592 D594 I597 T628 L630 P631 C635	H592-I633 PolarHBondContact CE1-O 3.48Å; H592-I633 PolarHBondContact ND1-O 3.43Å; D594-I633 HydrophobicContact CB-CD1 3.82Å; D594-I633 HydrophobicContact CB-CG1 4.16Å; I597-I633 HydrophobicContact CD1-CB 4.39Å; I597-I633 HydrophobicContact CD1-CD1 4.47Å; I597-I633 HydrophobicContact CD1-CG1 3.84Å; I597-I633 HydrophobicContact CD1-CG2 4.08Å; T628-I633 HydrophobicContact CG2-CG2 4.02Å; L630-I633 HydrophobicContact CB-CB 4.18Å; L630-I633 HydrophobicContact CB-CG1 4.1Å; L630-I633 PolarHBondContact O-N 3.44Å; P631-I633 VanDerWaalsContact C-N 3.28Å; P631-I633 PolarHBondContact O-N 2.9Å; I633-C635 PolarHBondContact O-N 3.06Å
634	D	87.6	Confident	84.3	Confident	60 Å²	60	51 Å²	51	32%	0.321	29%	0.291	S	S	.	.	S	Bend	trans	-73.9	1.8	-177.5	-67.6	-1.8	0	0	0	112.9	H627 T628 N629 L630	H627-D634 VanDerWaalsContact CA-OD2 3.26Å; H627-D634 WeakPolarHBondContact CA-OD2 3.46Å; H627-D634 WeakPolarHBondContact CB-OD2 3.46Å; H627-D634 IonicContact CG-OD2 3.71Å; H627-D634 IonicContact ND1-OD2 3.57Å; H627-D634 PolarHBondContact ND1-OD2 3.22Å; T628-D634 WeakPolarHBondContact CB-OD1 2.97Å; T628-D634 PolarHBondContact N-OD1 2.98Å; T628-D634 PolarHBondContact N-OD2 3.47Å; T628-D634 PolarHBondContact OG1-OD1 3.33Å; N629-D634 PolarHBondContact N-OD2 2.98Å; L630-D634 PolarHBondContact O-N 2.9Å
635	C	88.4	Confident	85.2	Confident	14 Å²	14	46.8 Å²	46.8	10%	0.095	27%	0.27	C	S	.	.	S	Bend	trans	-92.5	142.5	-179.9	67.7	0	0	0	0	113.2	V542 C549 H592 P631 I633	V542-C635 HydrophobicContact CG1-CB 4.09Å; C549-C635 HydrophobicContact CB-CB 3.62Å; C549-C635 WeakPolarHBondContact CB-SG 3.06Å; C549-C635 WeakPolarHBondContact SG-CB 3.26Å; C549-C635 CovalentContact SG-SG 2.03Å; C549-C635 PolarHBondContact SG-SG 2.85Å; H592-C635 PolarHBondContact CE1-O 2.95Å; H592-C635 PolarHBondContact ND1-O 2.94Å; P631-C635 WeakPolarHBondContact O-CB 3.26Å; P631-C635 PolarHBondContact O-SG 2.95Å; I633-C635 PolarHBondContact O-N 3.06Å
636	T	90	Very high	86	Confident	88 Å²	88	46.4 Å²	46.4	54%	0.54	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-77.4	123.3	175.7	46.3	0	0	0	0	111.5	G548 C549 T638	G548-T636 CarbonylContact C-O 3.54Å; G548-T636 WeakPolarHBondContact CA-O 3.01Å; G548-T636 WeakPolarHBondContact CA-OG1 3.48Å; C549-T636 PolarHBondContact N-O 3.01Å; T636-T638 PolarHBondContact O-N 2.95Å
637	I	91	Very high	86.6	Confident	36 Å²	36	40.7 Å²	40.7	19%	0.185	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-64.6	124.3	177.1	-62.4	163.1	0	0	0	110.7	C549 H592 G639 R640 T670	C549-I637 WeakPolarHBondContact O-CA 3.47Å; H592-I637 HydrophobicContact CB-CD1 3.4Å; H592-I637 VanDerWaalsContact CB-CD1 3.4Å; H592-I637 HydrophobicContact CB-CG1 3.8Å; I637-G639 WeakPolarHBondContact CG2-O 3.3Å; I637-R640 HydrophobicContact CG2-CG 3.7Å; I637-T670 HydrophobicContact CD1-CG2 3.74Å
638	T	90.9	Very high	87.3	Confident	55 Å²	55	34.8 Å²	34.8	34%	0.337	20%	0.2	S	C	.	.			trans	-98.7	-24.8	174.8	54.6	0	0	0	0	113.4	C549 T636	C549-T638 PolarHBondContact O-N 3.4Å; C549-T638 PolarHBondContact O-OG1 3.16Å; T636-T638 PolarHBondContact O-N 2.95Å
639	G	92.1	Very high	87.8	Confident	4 Å²	4	36.2 Å²	36.2	4%	0.041	20%	0.2	C	C	.	.			trans	-129.6	136.1	179.3	0	0	0	0	0	112.8	I637 I652 T653	I637-G639 WeakPolarHBondContact CG2-O 3.3Å; G639-I652 WeakPolarHBondContact O-CG2 3.38Å; G639-T653 CarbonylContact C-O 3.5Å; G639-T653 WeakPolarHBondContact CA-O 3.47Å
640	R	93.8	Very high	88.4	Confident	56 Å²	56	30.5 Å²	30.5	21%	0.211	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	162.8	-179	-71.1	-170.6	178	-91.6	9.4	111.8	I637 C642 I652 T653 F665 H666 E667 A669	I637-R640 HydrophobicContact CG2-CG 3.7Å; R640-C642 PolarHBondContact O-N 2.91Å; R640-I652 WeakPolarHBondContact O-CA 3.34Å; R640-T653 PolarHBondContact N-O 3.32Å; R640-T653 PolarHBondContact O-N 2.98Å; R640-F665 HydrophobicContact CB-CE1 4.46Å; R640-F665 HydrophobicContact CB-CE2 3.95Å; R640-F665 HydrophobicContact CB-CZ 3.77Å; R640-F665 HydrophobicContact CG-CZ 4.29Å; R640-H666 WeakPolarHBondContact CB-O 3.23Å; R640-H666 VanDerWaalsContact CD-O 3.26Å; R640-H666 WeakPolarHBondContact CD-O 3.42Å; R640-E667 PolarHBondContact NE-O 3.33Å; R640-E667 PolarHBondContact NH1-O 3.5Å; R640-E667 PolarHBondContact NH2-O 3.36Å; R640-A669 PolarHBondContact NH1-O 2.81Å
641	P	95.3	Very high	88.8	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	121.2	175.5	-27.5	37.5	0	0	0	112.7	H666 A669 L671 V675	P641-H666 PolarHBondContact O-N 2.82Å; P641-A669 WeakPolarHBondContact CD-O 3.46Å; P641-A669 HydrophobicContact CG-CB 3.98Å; P641-L671 VanDerWaalsContact CG-C 3.45Å; P641-L671 WeakPolarHBondContact CG-O 3.43Å; P641-V675 HydrophobicContact CB-CG1 4.16Å; P641-V675 HydrophobicContact CB-CG2 3.87Å
642	C	94.4	Very high	89.2	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.3	170.8	177.2	0	0	0	0	109.4	R640 I644 C650 E651 C658 Y664 F665	R640-C642 PolarHBondContact O-N 2.91Å; C642-I644 HydrophobicContact CB-CD1 4.48Å; C642-I644 HydrophobicContact CB-CG1 4.41Å; C642-I644 WeakPolarHBondContact SG-CG1 3.37Å; C642-C650 WeakPolarHBondContact O-CA 3.46Å; C642-E651 PolarHBondContact N-O 3.47Å; C642-E651 PolarHBondContact O-N 3.28Å; C642-C658 HydrophobicContact CB-CB 3.76Å; C642-C658 WeakPolarHBondContact CB-SG 3.49Å; C642-C658 WeakPolarHBondContact SG-CA 3.4Å; C642-C658 WeakPolarHBondContact SG-CB 3.31Å; C642-C658 CovalentContact SG-SG 2.02Å; C642-C658 PolarHBondContact SG-SG 2.86Å; C642-Y664 CarbonylContact C-O 3.59Å; C642-Y664 WeakPolarHBondContact CA-O 3.32Å; C642-F665 HydrophobicContact CB-CD2 4.48Å
643	C	92.9	Very high	89.5	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.007	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	112.4	177.7	-64.8	0	0	0	0	110.2	G663 Y664 H666 C677	C643-G663 CarbonylContact O-C 3.51Å; C643-G663 WeakPolarHBondContact O-CA 3.32Å; C643-Y664 PolarHBondContact N-O 2.96Å; C643-Y664 PolarHBondContact O-N 3.48Å; C643-H666 PolarHBondContact SG-NE2 3.29Å; C643-C677 VanDerWaalsContact CA-SG 3.55Å; C643-C677 HydrophobicContact CB-CB 3.49Å; C643-C677 VanDerWaalsContact CB-CB 3.49Å; C643-C677 WeakPolarHBondContact CB-SG 3.36Å; C643-C677 WeakPolarHBondContact SG-CA 3.35Å; C643-C677 WeakPolarHBondContact SG-CB 3.23Å; C643-C677 CovalentContact SG-SG 2.03Å; C643-C677 PolarHBondContact SG-SG 3.05Å
644	I	89.6	Confident	89.7	Confident	14 Å²	14	29 Å²	29	7%	0.072	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	134	-169.4	-55.1	174.4	0	0	0	111.3	C642 R649 Y657 M661	C642-I644 HydrophobicContact CB-CD1 4.48Å; C642-I644 HydrophobicContact CB-CG1 4.41Å; C642-I644 WeakPolarHBondContact SG-CG1 3.37Å; I644-R649 PolarHBondContact N-O 3.26Å; I644-R649 WeakPolarHBondContact O-CB 3.42Å; I644-R649 PolarHBondContact O-N 3.45Å; I644-R649 VanDerWaalsContact O-N 3.08Å; I644-Y657 HydrophobicContact CD1-CD1 4.24Å; I644-Y657 HydrophobicContact CD1-CE1 3.63Å; I644-M661 HydrophobicContact CD1-CB 4.06Å; I644-M661 HydrophobicContact CD1-CG 4.32Å; I644-M661 HydrophobicContact CG1-CB 4.4Å; I644-M661 HydrophobicContact CG2-CB 4.04Å; I644-M661 HydrophobicContact CG2-CE 4.01Å
645	G	84.4	Confident	90	Very high	24 Å²	24	31.2 Å²	31.2	25%	0.247	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	164.4	166.1	0	0	0	0	0	115.8	E505 K647 G648 V681	E505-G645 WeakPolarHBondContact OE1-CA 3.49Å; G645-K647 PolarHBondContact O-N 3.43Å; G645-G648 PolarHBondContact O-N 2.79Å; G645-V681 WeakPolarHBondContact O-CG2 3.41Å
646	T	82	Confident	90.1	Very high	41 Å²	41	34.8 Å²	34.8	25%	0.252	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-15	-171.5	61.5	0	0	0	0	118.1	E505 I508 Y514 V681	E505-T646 HydrophobicContact CG-CG2 3.81Å; I508-T646 HydrophobicContact CD1-CG2 3.61Å; Y514-T646 WeakPolarHBondContact CE1-O 3.32Å; Y514-T646 PolarHBondContact OH-O 2.74Å; Y514-T646 VanDerWaalsContact OH-O 3.11Å; T646-V681 WeakPolarHBondContact O-CG1 3.23Å
647	K	79.9	Confident	90.2	Very high	45 Å²	45	31.2 Å²	31.2	20%	0.196	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-4.4	176.3	-50.8	-174.2	-145.9	159.7	0	114.4	G645 L893	G645-K647 PolarHBondContact O-N 3.43Å; K647-L893 HydrophobicContact CD-CD2 4.46Å; K647-L893 PolarHBondContact NZ-O 3.29Å
648	G	84.4	Confident	90.3	Very high	9 Å²	9	29.5 Å²	29.5	9%	0.093	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	49.2	-170.2	0	0	0	0	0	112.8	G645 C650 C677	G645-G648 PolarHBondContact O-N 2.79Å; G648-C650 PolarHBondContact O-N 3.07Å; G648-C677 WeakPolarHBondContact CA-O 3.4Å; G648-C677 WeakPolarHBondContact O-CB 3.31Å
649	R	86.9	Confident	90.5	Very high	75 Å²	75	31.5 Å²	31.5	28%	0.283	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	121.1	172	169.1	-177.3	174.5	154.3	-3.1	108	I644 E651	I644-R649 PolarHBondContact N-O 3.26Å; I644-R649 WeakPolarHBondContact O-CB 3.42Å; I644-R649 PolarHBondContact O-N 3.45Å; I644-R649 VanDerWaalsContact O-N 3.08Å; R649-E651 IonicContact CZ-OE2 2.77Å; R649-E651 IonicContact NE-OE2 3.52Å; R649-E651 PolarHBondContact NE-OE2 2.9Å; R649-E651 IonicContact NH2-OE2 3.81Å; R649-E651 PolarHBondContact NH2-OE2 2.69Å
650	C	91.8	Very high	90.5	Very high	23 Å²	23	33.1 Å²	33.1	16%	0.155	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	140.6	166.4	-169.8	0	0	0	0	111.4	C642 G648 C672	C642-C650 WeakPolarHBondContact O-CA 3.46Å; G648-C650 PolarHBondContact O-N 3.07Å; C650-C672 HydrophobicContact CB-CB 3.55Å; C650-C672 WeakPolarHBondContact CB-SG 3.41Å; C650-C672 WeakPolarHBondContact SG-CA 3.3Å; C650-C672 WeakPolarHBondContact SG-CB 3.36Å; C650-C672 CovalentContact SG-SG 2.03Å; C650-C672 PolarHBondContact SG-SG 3.4Å
651	E	91.1	Very high	90.2	Very high	33 Å²	33	30.8 Å²	30.8	15%	0.154	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	143.2	170.9	-163.3	166.7	123.1	0	0	109.4	R482 C642 R649 T653	R482-E651 IonicContact CZ-OE1 3.69Å; R482-E651 IonicContact NH1-OE1 3.96Å; R482-E651 PolarHBondContact NH1-OE1 2.94Å; R482-E651 IonicContact NH2-OE1 3.61Å; C642-E651 PolarHBondContact N-O 3.47Å; C642-E651 PolarHBondContact O-N 3.28Å; R649-E651 IonicContact CZ-OE2 2.77Å; R649-E651 IonicContact NE-OE2 3.52Å; R649-E651 PolarHBondContact NE-OE2 2.9Å; R649-E651 IonicContact NH2-OE2 3.81Å; R649-E651 PolarHBondContact NH2-OE2 2.69Å; E651-T653 HydrophobicContact CB-CG2 3.83Å; E651-T653 HydrophobicContact CG-CG2 3.57Å; E651-T653 PolarHBondContact O-N 3.17Å
652	I	92.2	Very high	89.9	Confident	21 Å²	21	36.3 Å²	36.3	11%	0.108	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	101	-179.1	-59.2	-178.6	0	0	0	108.9	N483 V550 Q551 G639 R640	N483-I652 PolarHBondContact ND2-O 3.02Å; V550-I652 HydrophobicContact CG2-CG2 3.79Å; Q551-I652 HydrophobicContact CB-CD1 3.93Å; Q551-I652 HydrophobicContact CG-CD1 4.32Å; G639-I652 WeakPolarHBondContact O-CG2 3.38Å; R640-I652 WeakPolarHBondContact O-CA 3.34Å
653	T	92.8	Very high	89.7	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	169.7	-166.2	70.9	0	0	0	0	112.9	G639 R640 E651 Y657	G639-T653 CarbonylContact C-O 3.5Å; G639-T653 WeakPolarHBondContact CA-O 3.47Å; R640-T653 PolarHBondContact N-O 3.32Å; R640-T653 PolarHBondContact O-N 2.98Å; E651-T653 HydrophobicContact CB-CG2 3.83Å; E651-T653 HydrophobicContact CG-CG2 3.57Å; E651-T653 PolarHBondContact O-N 3.17Å; T653-Y657 HydrophobicContact CG2-CD1 3.52Å; T653-Y657 HydrophobicContact CG2-CE1 3.85Å; T653-Y657 HydrophobicContact CG2-CG 4.42Å
654	S	93	Very high	89.7	Confident	11 Å²	11	41.6 Å²	41.6	8%	0.077	20%	0.204	C	C	.	.			trans	-61.4	163.8	163.7	64.9	0	0	0	0	111.3	L481 Y657 C658	L481-S654 VanDerWaalsContact O-CB 3.29Å; L481-S654 WeakPolarHBondContact O-CB 3.39Å; L481-S654 PolarHBondContact O-OG 3.37Å; S654-Y657 WeakPolarHBondContact OG-CB 3.37Å; S654-Y657 PolarHBondContact OG-N 2.03Å; S654-C658 PolarHBondContact O-N 3.35Å
655	R	92.6	Very high	90	Very high	106 Å²	106	43.1 Å²	43.1	40%	0.4	21%	0.21	S	C	.	.	H	α-helix	trans	-65.4	-45.5	171	-167	-165.3	-63.8	-92.3	3.4	111.6	Y657 C658 D659 F665 E667	R655-Y657 VanDerWaalsContact C-N 3.25Å; R655-Y657 PolarHBondContact O-N 3.34Å; R655-C658 WeakPolarHBondContact O-CA 3.17Å; R655-C658 WeakPolarHBondContact O-CB 3.29Å; R655-C658 PolarHBondContact O-N 3.24Å; R655-D659 WeakPolarHBondContact CG-OD2 3.29Å; R655-D659 PolarHBondContact O-N 3.45Å; R655-F665 HydrophobicContact CB-CD1 4.42Å; R655-F665 HydrophobicContact CB-CD2 4.43Å; R655-F665 HydrophobicContact CB-CE1 4.09Å; R655-F665 HydrophobicContact CB-CE2 4.12Å; R655-F665 HydrophobicContact CB-CZ 3.93Å; R655-F665 HydrophobicContact CG-CD1 4.05Å; R655-F665 HydrophobicContact CG-CD2 4.48Å; R655-F665 HydrophobicContact CG-CE1 4.18Å; R655-F665 HydrophobicContact CG-CG 4.19Å; R655-F665 HydrophobicContact CG-CZ 4.45Å; R655-E667 IonicContact CZ-OE1 2.79Å; R655-E667 IonicContact NH1-OE1 3.54Å; R655-E667 PolarHBondContact NH1-OE1 3.07Å; R655-E667 IonicContact NH2-OE1 2.71Å; R655-E667 PolarHBondContact NH2-OE1 2.78Å; R655-E667 IonicContact NH2-OE2 2.72Å; R655-E667 PolarHBondContact NH2-OE2 3.43Å; R655-E667 VanDerWaalsContact NH2-OE2 3.13Å
656	E	92.2	Very high	90.5	Very high	88 Å²	88	42.9 Å²	42.9	41%	0.411	20%	0.202	S	C	.	.	H	α-helix	trans	-53.9	-42	-179.2	-60.3	179.6	-171.5	0	0	112.2	V480 L481 F660	V480-E656 VanDerWaalsContact CG1-C 3.45Å; V480-E656 HydrophobicContact CG1-CB 3.67Å; L481-E656 WeakPolarHBondContact CB-OE2 3.37Å; L481-E656 PolarHBondContact N-OE2 2.87Å; E656-F660 WeakPolarHBondContact O-CB 3.39Å; E656-F660 PolarHBondContact O-N 3.46Å
657	Y	92.1	Very high	91	Very high	13 Å²	13	46 Å²	46	5%	0.051	21%	0.214	C	C	.	.	H	α-helix	trans	-66.5	-40.2	175.4	-178.3	-94.4	0	0	0	112.6	R482 V490 I644 T653 S654 R655 M661	R482-Y657 VanDerWaalsContact CZ-CZ 3.47Å; R482-Y657 VanDerWaalsContact NH1-CE2 3.32Å; R482-Y657 PolarHBondContact NH2-OH 3.14Å; V490-Y657 HydrophobicContact CB-CE2 4.34Å; V490-Y657 HydrophobicContact CG1-CD2 4.39Å; V490-Y657 HydrophobicContact CG1-CE2 3.64Å; V490-Y657 HydrophobicContact CG2-CD2 4Å; V490-Y657 HydrophobicContact CG2-CE2 3.8Å; I644-Y657 HydrophobicContact CD1-CD1 4.24Å; I644-Y657 HydrophobicContact CD1-CE1 3.63Å; T653-Y657 HydrophobicContact CG2-CD1 3.52Å; T653-Y657 HydrophobicContact CG2-CE1 3.85Å; T653-Y657 HydrophobicContact CG2-CG 4.42Å; S654-Y657 WeakPolarHBondContact OG-CB 3.37Å; S654-Y657 PolarHBondContact OG-N 2.03Å; R655-Y657 VanDerWaalsContact C-N 3.25Å; R655-Y657 PolarHBondContact O-N 3.34Å; Y657-M661 HydrophobicContact CD1-CG 4.14Å; Y657-M661 HydrophobicContact CD2-CG 4.33Å; Y657-M661 HydrophobicContact CE1-CG 3.72Å; Y657-M661 HydrophobicContact CE2-CG 3.9Å; Y657-M661 HydrophobicContact CE2-SD 4.36Å; Y657-M661 HydrophobicContact CG-CG 4.44Å; Y657-M661 VanDerWaalsContact O-CB 3.32Å; Y657-M661 WeakPolarHBondContact O-CB 3.08Å; Y657-M661 VanDerWaalsContact O-CG 3.23Å; Y657-M661 WeakPolarHBondContact O-CG 3.38Å; Y657-M661 PolarHBondContact O-N 2.64Å
658	C	93.1	Very high	91.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-65.1	-45.3	177.9	-160.1	0	0	0	0	111.6	C642 S654 R655 M661 K662 G663 F665	C642-C658 HydrophobicContact CB-CB 3.76Å; C642-C658 WeakPolarHBondContact CB-SG 3.49Å; C642-C658 WeakPolarHBondContact SG-CA 3.4Å; C642-C658 WeakPolarHBondContact SG-CB 3.31Å; C642-C658 CovalentContact SG-SG 2.02Å; C642-C658 PolarHBondContact SG-SG 2.86Å; S654-C658 PolarHBondContact O-N 3.35Å; R655-C658 WeakPolarHBondContact O-CA 3.17Å; R655-C658 WeakPolarHBondContact O-CB 3.29Å; R655-C658 PolarHBondContact O-N 3.24Å; C658-M661 CarbonylContact O-C 3.59Å; C658-M661 PolarHBondContact O-N 3.47Å; C658-K662 PolarHBondContact O-N 3.11Å; C658-G663 PolarHBondContact O-N 3.15Å; C658-F665 HydrophobicContact CB-CB 4.18Å; C658-F665 HydrophobicContact CB-CD2 3.74Å; C658-F665 HydrophobicContact CB-CG 4.38Å
659	D	93.2	Very high	91.9	Very high	98 Å²	98	48.3 Å²	48.3	52%	0.524	22%	0.223	S	C	.	.	H	α-helix	trans	-63.2	-44	178	-66.1	-21.4	0	0	0	111.2	R655 K662	R655-D659 WeakPolarHBondContact CG-OD2 3.29Å; R655-D659 PolarHBondContact O-N 3.45Å; D659-K662 PolarHBondContact O-N 2.79Å; D659-K662 VanDerWaalsContact O-N 3.16Å
660	F	92	Very high	92.2	Very high	37 Å²	37	45.1 Å²	45.1	16%	0.162	21%	0.212	C	C	.	.	H	α-helix	trans	-62.2	-44.5	175.3	176.3	-101.7	0	0	0	112.5	D478 V480 V490 F492 E656 K662	D478-F660 HydrophobicContact CB-CD2 3.88Å; D478-F660 HydrophobicContact CB-CE2 3.36Å; D478-F660 HydrophobicContact CB-CZ 3.97Å; V480-F660 HydrophobicContact CG2-CB 4.13Å; V480-F660 HydrophobicContact CG2-CD1 4.14Å; V480-F660 HydrophobicContact CG2-CD2 4.24Å; V480-F660 HydrophobicContact CG2-CG 3.9Å; V490-F660 HydrophobicContact CB-CD1 4.24Å; V490-F660 HydrophobicContact CB-CE1 3.82Å; V490-F660 HydrophobicContact CG1-CD1 4.07Å; V490-F660 HydrophobicContact CG1-CE1 3.7Å; V490-F660 WeakPolarHBondContact O-CE1 3.42Å; V490-F660 WeakPolarHBondContact O-CZ 3.35Å; F492-F660 HydrophobicContact CB-CD1 4.27Å; F492-F660 HydrophobicContact CB-CE1 3.58Å; F492-F660 HydrophobicContact CB-CZ 3.78Å; E656-F660 WeakPolarHBondContact O-CB 3.39Å; E656-F660 PolarHBondContact O-N 3.46Å; F660-K662 PolarHBondContact O-N 3.4Å
661	M	88.6	Confident	92.2	Very high	7 Å²	7	44 Å²	44	3%	0.034	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	2.6	176.7	-65.3	-63.9	-65	0	0	113.6	V490 F492 I644 Y657 C658 G663	V490-M661 HydrophobicContact CG1-SD 3.95Å; F492-M661 HydrophobicContact CB-SD 4.15Å; F492-M661 HydrophobicContact CD2-CE 3.96Å; F492-M661 HydrophobicContact CD2-SD 3.87Å; F492-M661 WeakPolarHBondContact CE2-O 3.12Å; I644-M661 HydrophobicContact CD1-CB 4.06Å; I644-M661 HydrophobicContact CD1-CG 4.32Å; I644-M661 HydrophobicContact CG1-CB 4.4Å; I644-M661 HydrophobicContact CG2-CB 4.04Å; I644-M661 HydrophobicContact CG2-CE 4.01Å; Y657-M661 HydrophobicContact CD1-CG 4.14Å; Y657-M661 HydrophobicContact CD2-CG 4.33Å; Y657-M661 HydrophobicContact CE1-CG 3.72Å; Y657-M661 HydrophobicContact CE2-CG 3.9Å; Y657-M661 HydrophobicContact CE2-SD 4.36Å; Y657-M661 HydrophobicContact CG-CG 4.44Å; Y657-M661 VanDerWaalsContact O-CB 3.32Å; Y657-M661 WeakPolarHBondContact O-CB 3.08Å; Y657-M661 VanDerWaalsContact O-CG 3.23Å; Y657-M661 WeakPolarHBondContact O-CG 3.38Å; Y657-M661 PolarHBondContact O-N 2.64Å; C658-M661 CarbonylContact O-C 3.59Å; C658-M661 PolarHBondContact O-N 3.47Å; M661-G663 PolarHBondContact O-N 3.29Å
662	K	88.9	Confident	92.4	Very high	116 Å²	116	43.7 Å²	43.7	50%	0.504	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	30	-179.8	-50.1	-179.4	-168.7	-178.8	0	113.5	F492 C658 D659 F660	F492-K662 HydrophobicContact CE1-CD 3.8Å; F492-K662 VanDerWaalsContact CE1-CE 3.48Å; F492-K662 HydrophobicContact CE1-CG 4.4Å; F492-K662 HydrophobicContact CZ-CD 3.84Å; F492-K662 HydrophobicContact CZ-CG 4.21Å; C658-K662 PolarHBondContact O-N 3.11Å; D659-K662 PolarHBondContact O-N 2.79Å; D659-K662 VanDerWaalsContact O-N 3.16Å; F660-K662 PolarHBondContact O-N 3.4Å
663	G	90.7	Very high	92.4	Very high	17 Å²	17	43.1 Å²	43.1	18%	0.175	20%	0.203	C	C	.	.			trans	-83.8	175.5	178.9	0	0	0	0	0	113.6	C643 C658 M661	C643-G663 CarbonylContact O-C 3.51Å; C643-G663 WeakPolarHBondContact O-CA 3.32Å; C658-G663 PolarHBondContact O-N 3.15Å; M661-G663 PolarHBondContact O-N 3.29Å
664	Y	92.5	Very high	92.3	Very high	96 Å²	96	44.2 Å²	44.2	38%	0.376	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	122	173	-60.9	-94.8	0	0	0	109.5	H509 C642 C643 D680	H509-Y664 PolarHBondContact CD2-OH 3.32Å; C642-Y664 CarbonylContact C-O 3.59Å; C642-Y664 WeakPolarHBondContact CA-O 3.32Å; C643-Y664 PolarHBondContact N-O 2.96Å; C643-Y664 PolarHBondContact O-N 3.48Å; Y664-D680 HydrophobicContact CD1-CB 4.4Å; Y664-D680 HydrophobicContact CD2-CB 3.87Å; Y664-D680 HydrophobicContact CE2-CB 4.23Å; Y664-D680 HydrophobicContact CG-CB 3.96Å
665	F	94.7	Very high	92.3	Very high	45 Å²	45	44.5 Å²	44.5	20%	0.197	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	121.7	-176.3	-171.1	-104	0	0	0	111.3	R640 C642 R655 C658 E667	R640-F665 HydrophobicContact CB-CE1 4.46Å; R640-F665 HydrophobicContact CB-CE2 3.95Å; R640-F665 HydrophobicContact CB-CZ 3.77Å; R640-F665 HydrophobicContact CG-CZ 4.29Å; C642-F665 HydrophobicContact CB-CD2 4.48Å; R655-F665 HydrophobicContact CB-CD1 4.42Å; R655-F665 HydrophobicContact CB-CD2 4.43Å; R655-F665 HydrophobicContact CB-CE1 4.09Å; R655-F665 HydrophobicContact CB-CE2 4.12Å; R655-F665 HydrophobicContact CB-CZ 3.93Å; R655-F665 HydrophobicContact CG-CD1 4.05Å; R655-F665 HydrophobicContact CG-CD2 4.48Å; R655-F665 HydrophobicContact CG-CE1 4.18Å; R655-F665 HydrophobicContact CG-CG 4.19Å; R655-F665 HydrophobicContact CG-CZ 4.45Å; C658-F665 HydrophobicContact CB-CB 4.18Å; C658-F665 HydrophobicContact CB-CD2 3.74Å; C658-F665 HydrophobicContact CB-CG 4.38Å; F665-E667 HydrophobicContact CD1-CG 3.84Å; F665-E667 HydrophobicContact CE1-CG 3.94Å
666	H	94.9	Very high	92.2	Very high	20 Å²	20	43.1 Å²	43.1	9%	0.093	21%	0.207	C	C	.	.			trans	-97.1	114.5	-177.9	-66.2	-87.6	0	0	0	111	R640 P641 C643 E668 A669 V675 D680	R640-H666 WeakPolarHBondContact CB-O 3.23Å; R640-H666 VanDerWaalsContact CD-O 3.26Å; R640-H666 WeakPolarHBondContact CD-O 3.42Å; P641-H666 PolarHBondContact O-N 2.82Å; C643-H666 PolarHBondContact SG-NE2 3.29Å; H666-E668 WeakPolarHBondContact CB-OE1 3.48Å; H666-E668 IonicContact CG-OE1 2.64Å; H666-E668 IonicContact ND1-OE1 3.19Å; H666-E668 PolarHBondContact ND1-OE1 2.82Å; H666-A669 HydrophobicContact CB-CB 4.1Å; H666-V675 HydrophobicContact CB-CG1 3.86Å; H666-D680 IonicContact CE1-OD1 2.76Å; H666-D680 IonicContact CE1-OD2 2.66Å; H666-D680 IonicContact NE2-OD2 3.5Å
667	E	92.4	Very high	92.1	Very high	105 Å²	105	39.3 Å²	39.3	49%	0.491	19%	0.19	S	C	.	.	S	Bend	trans	-86.3	-20.6	-178.6	-63.6	-166	-145.7	0	0	112.7	R640 R655 F665	R640-E667 PolarHBondContact NE-O 3.33Å; R640-E667 PolarHBondContact NH1-O 3.5Å; R640-E667 PolarHBondContact NH2-O 3.36Å; R655-E667 IonicContact CZ-OE1 2.79Å; R655-E667 IonicContact NH1-OE1 3.54Å; R655-E667 PolarHBondContact NH1-OE1 3.07Å; R655-E667 IonicContact NH2-OE1 2.71Å; R655-E667 PolarHBondContact NH2-OE1 2.78Å; R655-E667 IonicContact NH2-OE2 2.72Å; R655-E667 PolarHBondContact NH2-OE2 3.43Å; R655-E667 VanDerWaalsContact NH2-OE2 3.13Å; F665-E667 HydrophobicContact CD1-CG 3.84Å; F665-E667 HydrophobicContact CE1-CG 3.94Å
668	E	91.1	Very high	92	Very high	104 Å²	104	39.9 Å²	39.9	49%	0.486	19%	0.194	S	C	.	.	S	Bend	trans	-83.7	-34.3	179.9	65.1	-71.9	169.5	0	0	113.2	I618 H666	I618-E668 HydrophobicContact CD1-CG 4.25Å; I618-E668 WeakPolarHBondContact CG2-O 3.28Å; H666-E668 WeakPolarHBondContact CB-OE1 3.48Å; H666-E668 IonicContact CG-OE1 2.64Å; H666-E668 IonicContact ND1-OE1 3.19Å; H666-E668 PolarHBondContact ND1-OE1 2.82Å
669	A	93.3	Very high	91.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.2	C	C	.	.			trans	-89.2	157.8	-174.7	0	0	0	0	0	113.2	I618 R640 P641 H666 Q674 V675	I618-A669 HydrophobicContact CD1-CB 4.3Å; R640-A669 PolarHBondContact NH1-O 2.81Å; P641-A669 WeakPolarHBondContact CD-O 3.46Å; P641-A669 HydrophobicContact CG-CB 3.98Å; H666-A669 HydrophobicContact CB-CB 4.1Å; A669-Q674 HydrophobicContact CB-CB 4.24Å; A669-V675 HydrophobicContact CB-CG1 3.49Å; A669-V675 VanDerWaalsContact CB-CG1 3.49Å
670	T	92.1	Very high	91.6	Very high	8 Å²	8	38.6 Å²	38.6	5%	0.049	19%	0.187	C	C	.	.	S	Bend	trans	-123.3	-21.3	171	64.4	0	0	0	0	113.2	V590 Q593 I637	V590-T670 WeakPolarHBondContact CG1-OG1 3.44Å; Q593-T670 HydrophobicContact CG-CG2 4.19Å; Q593-T670 PolarHBondContact NE2-OG1 3.08Å; Q593-T670 VanDerWaalsContact NE2-OG1 3.08Å; Q593-T670 PolarHBondContact OE1-OG1 2.82Å; I637-T670 HydrophobicContact CD1-CG2 3.74Å
671	L	93.8	Very high	91.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.183	C	C	.	.	S	Bend	trans	-112.8	144.7	176.4	-65.7	172.1	0	0	0	111.4	E535 Q551 V590 I613 P641 S673 Q674	E535-L671 HydrophobicContact CG-CD2 4.09Å; E535-L671 WeakPolarHBondContact OE1-CA 3.46Å; E535-L671 WeakPolarHBondContact OE1-CB 3.43Å; Q551-L671 HydrophobicContact CG-CD2 4.03Å; V590-L671 HydrophobicContact CG1-CD1 4.2Å; V590-L671 HydrophobicContact CG1-CD2 4.04Å; V590-L671 HydrophobicContact CG1-CG 3.91Å; V590-L671 HydrophobicContact CG2-CD1 4Å; V590-L671 HydrophobicContact CG2-CD2 4.3Å; V590-L671 HydrophobicContact CG2-CG 4.44Å; I613-L671 HydrophobicContact CB-CD1 4.49Å; I613-L671 WeakPolarHBondContact O-CD1 3.47Å; P641-L671 VanDerWaalsContact CG-C 3.45Å; P641-L671 WeakPolarHBondContact CG-O 3.43Å; L671-S673 PolarHBondContact O-N 2.72Å; L671-Q674 HydrophobicContact CB-CG 4.04Å; L671-Q674 WeakPolarHBondContact O-CB 3.27Å; L671-Q674 PolarHBondContact O-N 3.47Å; L671-Q674 VanDerWaalsContact O-N 3.14Å
672	C	93.3	Very high	91.5	Very high	25 Å²	25	37.1 Å²	37.1	17%	0.169	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-62.6	-27.1	168.8	-81.9	0	0	0	0	112.9	E535 C650 Q674 V675	E535-C672 WeakPolarHBondContact OE1-CA 3.28Å; E535-C672 WeakPolarHBondContact OE1-CB 3.35Å; E535-C672 PolarHBondContact OE1-N 3.45Å; C650-C672 HydrophobicContact CB-CB 3.55Å; C650-C672 WeakPolarHBondContact CB-SG 3.41Å; C650-C672 WeakPolarHBondContact SG-CA 3.3Å; C650-C672 WeakPolarHBondContact SG-CB 3.36Å; C650-C672 CovalentContact SG-SG 2.03Å; C650-C672 PolarHBondContact SG-SG 3.4Å; C672-Q674 PolarHBondContact O-N 3.1Å; C672-V675 WeakPolarHBondContact O-CG2 3.42Å; C672-V675 PolarHBondContact O-N 3.12Å
673	S	92.4	Very high	91.2	Very high	10 Å²	10	32 Å²	32	7%	0.07	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-69.2	-16.1	173.5	71.1	0	0	0	0	114.6	E535 T614 L671	E535-S673 VanDerWaalsContact OE2-CB 3.25Å; E535-S673 WeakPolarHBondContact OE2-CB 3.42Å; E535-S673 PolarHBondContact OE2-N 3.14Å; T614-S673 WeakPolarHBondContact CA-OG 3.26Å; T614-S673 VanDerWaalsContact O-CB 3.23Å; T614-S673 WeakPolarHBondContact O-CB 3.2Å; T614-S673 PolarHBondContact O-OG 2.62Å; L671-S673 PolarHBondContact O-N 2.72Å
674	Q	92.3	Very high	90.8	Very high	23 Å²	23	35.7 Å²	35.7	11%	0.107	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-88	-14.2	-179.7	-72.5	171.9	-13.6	0	0	113.2	W616 P617 I618 A669 L671 C672	W616-Q674 WeakPolarHBondContact O-CG 3.5Å; W616-Q674 PolarHBondContact O-NE2 3.05Å; P617-Q674 PolarHBondContact O-NE2 3.23Å; I618-Q674 HydrophobicContact CD1-CB 4.21Å; I618-Q674 HydrophobicContact CG1-CB 3.75Å; I618-Q674 HydrophobicContact CG1-CG 3.99Å; A669-Q674 HydrophobicContact CB-CB 4.24Å; L671-Q674 HydrophobicContact CB-CG 4.04Å; L671-Q674 WeakPolarHBondContact O-CB 3.27Å; L671-Q674 PolarHBondContact O-N 3.47Å; L671-Q674 VanDerWaalsContact O-N 3.14Å; C672-Q674 PolarHBondContact O-N 3.1Å
675	V	92.4	Very high	90.4	Very high	16 Å²	16	35.6 Å²	35.6	10%	0.097	18%	0.183	C	C	.	.			trans	-112	145	-178	-63.1	0	0	0	0	110.9	P641 H666 A669 C672	P641-V675 HydrophobicContact CB-CG1 4.16Å; P641-V675 HydrophobicContact CB-CG2 3.87Å; H666-V675 HydrophobicContact CB-CG1 3.86Å; A669-V675 HydrophobicContact CB-CG1 3.49Å; A669-V675 VanDerWaalsContact CB-CG1 3.49Å; C672-V675 WeakPolarHBondContact O-CG2 3.42Å; C672-V675 PolarHBondContact O-N 3.12Å
676	H	90.8	Very high	90.1	Very high	77 Å²	77	38.6 Å²	38.6	36%	0.356	21%	0.206	S	C	.	.			trans	-107	64.5	-177.3	-73.7	-96.6	0	0	0	110.4	M678 D679 P690	H676-M678 PolarHBondContact O-N 3.17Å; H676-D679 HydrophobicContact CB-CB 4.46Å; H676-D679 WeakPolarHBondContact O-CB 3.44Å; H676-D679 PolarHBondContact O-N 3.11Å; H676-P690 HydrophobicContact CB-CB 4.38Å; H676-P690 VanDerWaalsContact CE1-CB 3.43Å; H676-P690 WeakPolarHBondContact CE1-CB 3.39Å; H676-P690 PolarHBondContact CE1-O 2.77Å; H676-P690 VanDerWaalsContact ND1-CB 3.26Å; H676-P690 WeakPolarHBondContact ND1-CB 3.05Å; H676-P690 PolarHBondContact ND1-O 2.65Å
677	C	90.4	Very high	89.8	Confident	8 Å²	8	38.3 Å²	38.3	5%	0.054	21%	0.205	C	C	.	.	H	α-helix	trans	-51.3	-12.7	-173.3	-64.1	0	0	0	0	117.1	C643 G648 D680 V681	C643-C677 VanDerWaalsContact CA-SG 3.55Å; C643-C677 HydrophobicContact CB-CB 3.49Å; C643-C677 VanDerWaalsContact CB-CB 3.49Å; C643-C677 WeakPolarHBondContact CB-SG 3.36Å; C643-C677 WeakPolarHBondContact SG-CA 3.35Å; C643-C677 WeakPolarHBondContact SG-CB 3.23Å; C643-C677 CovalentContact SG-SG 2.03Å; C643-C677 PolarHBondContact SG-SG 3.05Å; G648-C677 WeakPolarHBondContact CA-O 3.4Å; G648-C677 WeakPolarHBondContact O-CB 3.31Å; C677-D680 WeakPolarHBondContact CA-OD2 3.2Å; C677-V681 WeakPolarHBondContact O-CB 3.23Å; C677-V681 VanDerWaalsContact O-CG2 3.23Å; C677-V681 WeakPolarHBondContact O-CG2 3.5Å; C677-V681 PolarHBondContact O-N 3.1Å
678	M	89	Confident	89.6	Confident	26 Å²	26	40.1 Å²	40.1	13%	0.128	22%	0.217	C	C	.	.	H	α-helix	trans	-82.5	-29.3	171	-77.9	-94.7	63.2	0	0	113.3	P516 V524 H676 V681 C682 F687	P516-M678 HydrophobicContact CB-SD 4.32Å; V524-M678 HydrophobicContact CG1-SD 4.27Å; H676-M678 PolarHBondContact O-N 3.17Å; M678-V681 HydrophobicContact CE-CB 3.92Å; M678-V681 HydrophobicContact CE-CG1 3.77Å; M678-C682 WeakPolarHBondContact O-CB 3.43Å; M678-C682 PolarHBondContact O-N 2.87Å; M678-C682 PolarHBondContact O-SG 2.84Å; M678-F687 HydrophobicContact CB-CE2 3.95Å; M678-F687 HydrophobicContact CB-CZ 4.31Å
679	D	89.2	Confident	89.3	Confident	25 Å²	25	39.7 Å²	39.7	13%	0.134	22%	0.218	C	C	.	.	H	α-helix	trans	-61.4	-46.5	169.7	-85.9	-74.3	0	0	0	110.3	H676 C682 G683 P686 F687	H676-D679 HydrophobicContact CB-CB 4.46Å; H676-D679 WeakPolarHBondContact O-CB 3.44Å; H676-D679 PolarHBondContact O-N 3.11Å; D679-C682 PolarHBondContact O-N 2.82Å; D679-G683 WeakPolarHBondContact O-CA 3.42Å; D679-G683 PolarHBondContact O-N 2.94Å; D679-P686 WeakPolarHBondContact OD1-CA 3.46Å; D679-F687 HydrophobicContact CB-CD2 4.39Å; D679-F687 HydrophobicContact CB-CE2 4.42Å; D679-F687 WeakPolarHBondContact OD1-CD2 3.49Å; D679-F687 WeakPolarHBondContact OD1-CG 3.39Å; D679-F687 PolarHBondContact OD1-N 3.18Å; D679-F687 VanDerWaalsContact OD2-CD2 3.26Å; D679-F687 WeakPolarHBondContact OD2-CD2 3.36Å
680	D	89.1	Confident	88.7	Confident	45 Å²	45	43 Å²	43	24%	0.241	24%	0.239	C	C	.	.	H	α-helix	trans	-65.3	-43.8	-178.6	-51.4	-76.8	0	0	0	112.3	Y664 H666 C677	Y664-D680 HydrophobicContact CD1-CB 4.4Å; Y664-D680 HydrophobicContact CD2-CB 3.87Å; Y664-D680 HydrophobicContact CE2-CB 4.23Å; Y664-D680 HydrophobicContact CG-CB 3.96Å; H666-D680 IonicContact CE1-OD1 2.76Å; H666-D680 IonicContact CE1-OD2 2.66Å; H666-D680 IonicContact NE2-OD2 3.5Å; C677-D680 WeakPolarHBondContact CA-OD2 3.2Å
681	V	88.3	Confident	88.1	Confident	14 Å²	14	50 Å²	50	9%	0.085	27%	0.271	C	S	.	.	H	α-helix	trans	-70.7	-38	178.6	168.6	0	0	0	0	112.3	I508 G645 T646 C677 M678	I508-V681 WeakPolarHBondContact CG2-O 3.32Å; G645-V681 WeakPolarHBondContact O-CG2 3.41Å; T646-V681 WeakPolarHBondContact O-CG1 3.23Å; C677-V681 WeakPolarHBondContact O-CB 3.23Å; C677-V681 VanDerWaalsContact O-CG2 3.23Å; C677-V681 WeakPolarHBondContact O-CG2 3.5Å; C677-V681 PolarHBondContact O-N 3.1Å; M678-V681 HydrophobicContact CE-CB 3.92Å; M678-V681 HydrophobicContact CE-CG1 3.77Å
682	C	89.8	Confident	87.8	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-74.5	-51.8	177.5	-68.5	0	0	0	0	110.9	H509 C517 M678 D679 F687 R698	H509-C682 VanDerWaalsContact CA-O 3.29Å; H509-C682 WeakPolarHBondContact CA-O 3.26Å; C517-C682 WeakPolarHBondContact CA-SG 3.24Å; C517-C682 HydrophobicContact CB-CB 3.89Å; C517-C682 WeakPolarHBondContact CB-SG 3.48Å; C517-C682 VanDerWaalsContact SG-CA 3.6Å; C517-C682 WeakPolarHBondContact SG-CB 3.16Å; C517-C682 CovalentContact SG-SG 2.03Å; C517-C682 PolarHBondContact SG-SG 3.27Å; M678-C682 WeakPolarHBondContact O-CB 3.43Å; M678-C682 PolarHBondContact O-N 2.87Å; M678-C682 PolarHBondContact O-SG 2.84Å; D679-C682 PolarHBondContact O-N 2.82Å; C682-F687 HydrophobicContact CB-CE1 4.33Å; C682-F687 HydrophobicContact CB-CZ 4.03Å; C682-R698 VanDerWaalsContact C-NH2 3.26Å; C682-R698 PolarHBondContact O-NH2 2.95Å
683	G	82.2	Confident	87.5	Confident	9 Å²	9	54.1 Å²	54.1	9%	0.093	29%	0.292	C	S	.	.			trans	60.8	-164.7	173.8	0	0	0	0	0	115.8	D679 L685	D679-G683 WeakPolarHBondContact O-CA 3.42Å; D679-G683 PolarHBondContact O-N 2.94Å; G683-L685 PolarHBondContact O-N 3.41Å
684	L	82.2	Confident	87.3	Confident	94 Å²	94	56.3 Å²	56.3	49%	0.492	30%	0.303	S	S	.	.	S	Bend	trans	62.1	-47.2	-170.5	-170.7	68.5	0	0	0	115.8	Y697 L701	L684-Y697 HydrophobicContact CD2-CE2 4.16Å; L684-L701 HydrophobicContact CD2-CD2 3.3Å
685	L	85.7	Confident	87.3	Confident	94 Å²	94	55.3 Å²	55.3	49%	0.492	30%	0.298	S	S	.	.	S	Bend	trans	-140.9	141	171.2	-62.8	171.9	0	0	0	108	G683 Q695 Y697	G683-L685 PolarHBondContact O-N 3.41Å; L685-Q695 PolarHBondContact O-NE2 3.34Å; L685-Y697 HydrophobicContact CB-CE1 4.37Å; L685-Y697 HydrophobicContact CD1-CD1 4.32Å; L685-Y697 HydrophobicContact CD1-CE1 3.8Å
686	P	86.6	Confident	87.2	Confident	107 Å²	107	57.8 Å²	57.8	70%	0.695	31%	0.308	S	S	*	.			trans	-68.1	156.4	173.1	30.7	-35.5	0	0	0	110.9	D679	D679-P686 WeakPolarHBondContact OD1-CA 3.46Å
687	F	89.1	Confident	87.3	Confident	15 Å²	15	57.3 Å²	57.3	7%	0.066	30%	0.303	C	S	.	.			trans	-62.8	148.4	170.3	-58.6	-50	0	0	0	111.3	M678 D679 C682 N689 P693 D694 Q695	M678-F687 HydrophobicContact CB-CE2 3.95Å; M678-F687 HydrophobicContact CB-CZ 4.31Å; D679-F687 HydrophobicContact CB-CD2 4.39Å; D679-F687 HydrophobicContact CB-CE2 4.42Å; D679-F687 WeakPolarHBondContact OD1-CD2 3.49Å; D679-F687 WeakPolarHBondContact OD1-CG 3.39Å; D679-F687 PolarHBondContact OD1-N 3.18Å; D679-F687 VanDerWaalsContact OD2-CD2 3.26Å; D679-F687 WeakPolarHBondContact OD2-CD2 3.36Å; C682-F687 HydrophobicContact CB-CE1 4.33Å; C682-F687 HydrophobicContact CB-CZ 4.03Å; F687-N689 PolarHBondContact O-N 3.34Å; F687-P693 HydrophobicContact CD1-CB 4.06Å; F687-P693 HydrophobicContact CE1-CB 3.49Å; F687-P693 VanDerWaalsContact CE1-CB 3.49Å; F687-P693 HydrophobicContact CE2-CB 4.24Å; F687-P693 HydrophobicContact CZ-CB 3.61Å; F687-D694 WeakPolarHBondContact CA-OD1 3.3Å; F687-Q695 HydrophobicContact CD1-CG 3.71Å; F687-Q695 HydrophobicContact CE1-CG 3.68Å; F687-Q695 VanDerWaalsContact CE1-NE2 3.28Å
688	L	87.6	Confident	87.5	Confident	142 Å²	142	56.9 Å²	56.9	74%	0.743	30%	0.301	S	S	*	.	S	Bend	trans	-70	-24.6	174.3	-162.9	73.1	0	0	0	112.2	D694	L688-D694 WeakPolarHBondContact CB-OD2 3.34Å; L688-D694 PolarHBondContact N-OD1 3.23Å; L688-D694 PolarHBondContact N-OD2 3.47Å
689	N	84.9	Confident	87.7	Confident	96 Å²	96	56.5 Å²	56.5	51%	0.513	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-134.6	117.3	167.5	-64.6	-80.3	0	0	0	108.6	F687 E691 I692	F687-N689 PolarHBondContact O-N 3.34Å; N689-E691 PolarHBondContact O-N 2.75Å; N689-I692 HydrophobicContact CB-CB 4.48Å; N689-I692 PolarHBondContact O-N 2.78Å; N689-I692 VanDerWaalsContact O-O 3.11Å
690	P	82.6	Confident	87.9	Confident	68 Å²	68	62 Å²	62	44%	0.442	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-7	-176.8	-28.2	37.2	0	0	0	116.7	H676	H676-P690 HydrophobicContact CB-CB 4.38Å; H676-P690 VanDerWaalsContact CE1-CB 3.43Å; H676-P690 WeakPolarHBondContact CE1-CB 3.39Å; H676-P690 PolarHBondContact CE1-O 2.77Å; H676-P690 VanDerWaalsContact ND1-CB 3.26Å; H676-P690 WeakPolarHBondContact ND1-CB 3.05Å; H676-P690 PolarHBondContact ND1-O 2.65Å
691	E	79.3	Confident	88.2	Confident	155 Å²	155	62 Å²	62	72%	0.724	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-13.8	172	-61.8	-159.9	136	0	0	114.2	N689	N689-E691 PolarHBondContact O-N 2.75Å
692	I	86	Confident	88.5	Confident	94 Å²	94	61.4 Å²	61.4	48%	0.482	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-134.3	107.9	-171.5	-52.3	178.2	0	0	0	110.1	N689 D694	N689-I692 HydrophobicContact CB-CB 4.48Å; N689-I692 PolarHBondContact O-N 2.78Å; N689-I692 VanDerWaalsContact O-O 3.11Å; I692-D694 PolarHBondContact O-N 3.15Å
693	P	87.8	Confident	88.8	Confident	19 Å²	19	61.5 Å²	61.5	12%	0.123	32%	0.315	C	S	.	.			trans	-73.8	127.9	-177.4	30.1	-36	0	0	0	112.3	P516 M518 R519 F687	P516-P693 VanDerWaalsContact O-CB 3.26Å; P516-P693 WeakPolarHBondContact O-CB 3.44Å; P516-P693 VanDerWaalsContact O-CG 3.23Å; P516-P693 WeakPolarHBondContact O-CG 3.28Å; M518-P693 CarbonylContact C-O 3.46Å; R519-P693 VanDerWaalsContact C-CG 3.48Å; F687-P693 HydrophobicContact CD1-CB 4.06Å; F687-P693 HydrophobicContact CE1-CB 3.49Å; F687-P693 VanDerWaalsContact CE1-CB 3.49Å; F687-P693 HydrophobicContact CE2-CB 4.24Å; F687-P693 HydrophobicContact CZ-CB 3.61Å
694	D	89.1	Confident	89.4	Confident	55 Å²	55	62.2 Å²	62.2	29%	0.294	32%	0.316	S	S	.	.			trans	-131.8	18.5	-166.6	70.2	-35.1	0	0	0	115.1	F687 L688 I692 F696	F687-D694 WeakPolarHBondContact CA-OD1 3.3Å; L688-D694 WeakPolarHBondContact CB-OD2 3.34Å; L688-D694 PolarHBondContact N-OD1 3.23Å; L688-D694 PolarHBondContact N-OD2 3.47Å; I692-D694 PolarHBondContact O-N 3.15Å; D694-F696 VanDerWaalsContact C-N 3.25Å; D694-F696 WeakPolarHBondContact O-CD2 3.44Å; D694-F696 PolarHBondContact O-N 2.78Å
695	Q	91.4	Very high	90	Very high	2 Å²	2	58.1 Å²	58.1	1%	0.009	29%	0.294	C	S	.	.			trans	-81.3	52.3	-168.2	-58.5	-177.8	1	0	0	115	C517 L685 F687 Y697 R698	C517-Q695 VanDerWaalsContact O-CB 3.28Å; C517-Q695 WeakPolarHBondContact O-CB 3.47Å; C517-Q695 PolarHBondContact O-N 2.94Å; C517-Q695 VanDerWaalsContact O-N 3.1Å; L685-Q695 PolarHBondContact O-NE2 3.34Å; F687-Q695 HydrophobicContact CD1-CG 3.71Å; F687-Q695 HydrophobicContact CE1-CG 3.68Å; F687-Q695 VanDerWaalsContact CE1-NE2 3.28Å; Q695-Y697 HydrophobicContact CB-CD1 4.24Å; Q695-Y697 HydrophobicContact CB-CE1 3.55Å; Q695-Y697 HydrophobicContact CB-CE2 4.45Å; Q695-Y697 HydrophobicContact CG-CE1 3.81Å; Q695-Y697 WeakPolarHBondContact CG-OH 3.41Å; Q695-Y697 PolarHBondContact O-N 2.92Å; Q695-Y697 PolarHBondContact OE1-OH 3.34Å; Q695-Y697 VanDerWaalsContact OE1-OH 3.1Å; Q695-R698 HydrophobicContact CB-CG 4.31Å; Q695-R698 WeakPolarHBondContact O-CB 3.25Å; Q695-R698 VanDerWaalsContact O-CG 3.3Å; Q695-R698 WeakPolarHBondContact O-CG 3.46Å; Q695-R698 PolarHBondContact O-N 2.64Å
696	F	91	Very high	90.5	Very high	69 Å²	69	53.9 Å²	53.9	30%	0.303	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-22.2	-177.7	-71.5	-76.7	0	0	0	115.4	M518 D694 R698 L699 F865 Y866	M518-F696 WeakPolarHBondContact O-CE1 3.12Å; M518-F696 WeakPolarHBondContact O-CZ 3.48Å; D694-F696 VanDerWaalsContact C-N 3.25Å; D694-F696 WeakPolarHBondContact O-CD2 3.44Å; D694-F696 PolarHBondContact O-N 2.78Å; F696-R698 PolarHBondContact O-N 2.89Å; F696-R698 VanDerWaalsContact O-N 3.12Å; F696-L699 PolarHBondContact O-N 3.25Å; F696-F865 HydrophobicContact CE1-CD1 4.33Å; F696-F865 AromaticContact CE1-CE1 3.7Å; F696-F865 HydrophobicContact CE1-CE1 3.7Å; F696-F865 HydrophobicContact CZ-CE1 4.33Å; F696-Y866 AromaticContact CE1-CE1 3.98Å; F696-Y866 HydrophobicContact CE1-CE1 3.98Å; F696-Y866 HydrophobicContact CE1-CE2 4.22Å; F696-Y866 AromaticContact CE1-CZ 3.53Å; F696-Y866 WeakPolarHBondContact CE1-OH 3.47Å; F696-Y866 HydrophobicContact CE2-CE1 4.29Å; F696-Y866 WeakPolarHBondContact CE2-OH 3.16Å; F696-Y866 AromaticContact CZ-CE1 3.43Å; F696-Y866 HydrophobicContact CZ-CE1 3.43Å; F696-Y866 VanDerWaalsContact CZ-CE1 3.43Å; F696-Y866 HydrophobicContact CZ-CE2 4.43Å; F696-Y866 AromaticContact CZ-CZ 3.36Å; F696-Y866 WeakPolarHBondContact CZ-OH 3.29Å
697	Y	92.1	Very high	90.7	Very high	66 Å²	66	49.4 Å²	49.4	26%	0.259	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.2	174.9	60.6	-99.3	0	0	0	113	L684 L685 Q695 L699 W700 L701	L684-Y697 HydrophobicContact CD2-CE2 4.16Å; L685-Y697 HydrophobicContact CB-CE1 4.37Å; L685-Y697 HydrophobicContact CD1-CD1 4.32Å; L685-Y697 HydrophobicContact CD1-CE1 3.8Å; Q695-Y697 HydrophobicContact CB-CD1 4.24Å; Q695-Y697 HydrophobicContact CB-CE1 3.55Å; Q695-Y697 HydrophobicContact CB-CE2 4.45Å; Q695-Y697 HydrophobicContact CG-CE1 3.81Å; Q695-Y697 WeakPolarHBondContact CG-OH 3.41Å; Q695-Y697 PolarHBondContact O-N 2.92Å; Q695-Y697 PolarHBondContact OE1-OH 3.34Å; Q695-Y697 VanDerWaalsContact OE1-OH 3.1Å; Y697-L699 PolarHBondContact O-N 2.94Å; Y697-W700 PolarHBondContact O-N 3.3Å; Y697-L701 HydrophobicContact CD2-CD2 4.14Å; Y697-L701 HydrophobicContact CE2-CD2 4.28Å; Y697-L701 WeakPolarHBondContact O-CB 3.38Å; Y697-L701 PolarHBondContact O-N 3.41Å
698	R	94.8	Very high	90.9	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-54.2	-36.6	175.6	-73.9	174	176.3	-79.6	-13.2	113.4	I508 A512 C517 M518 C682 Q695 F696 W700 L701 S702	I508-R698 PolarHBondContact O-NH1 3.5Å; I508-R698 PolarHBondContact O-NH2 3.38Å; A512-R698 WeakPolarHBondContact O-CD 3.31Å; A512-R698 PolarHBondContact O-NH1 3.16Å; C517-R698 VanDerWaalsContact CB-NE 3.28Å; M518-R698 HydrophobicContact CG-CB 4.11Å; M518-R698 HydrophobicContact SD-CB 3.68Å; C682-R698 VanDerWaalsContact C-NH2 3.26Å; C682-R698 PolarHBondContact O-NH2 2.95Å; Q695-R698 HydrophobicContact CB-CG 4.31Å; Q695-R698 WeakPolarHBondContact O-CB 3.25Å; Q695-R698 VanDerWaalsContact O-CG 3.3Å; Q695-R698 WeakPolarHBondContact O-CG 3.46Å; Q695-R698 PolarHBondContact O-N 2.64Å; F696-R698 PolarHBondContact O-N 2.89Å; F696-R698 VanDerWaalsContact O-N 3.12Å; R698-W700 PolarHBondContact O-N 3.32Å; R698-L701 PolarHBondContact O-N 3.16Å; R698-S702 VanDerWaalsContact O-CB 3.23Å; R698-S702 WeakPolarHBondContact O-CB 3.26Å; R698-S702 PolarHBondContact O-N 2.91Å; R698-S702 PolarHBondContact O-OG 3.36Å
699	L	93.8	Very high	91.2	Very high	17 Å²	17	45.3 Å²	45.3	9%	0.089	22%	0.223	C	C	.	.	H	α-helix	trans	-60.8	-30.4	177.7	-64.5	177.8	0	0	0	112.7	M518 F696 Y697 I744 N747 L748 A751	M518-L699 HydrophobicContact CE-CD2 3.87Å; M518-L699 HydrophobicContact SD-CD2 3.74Å; M518-L699 HydrophobicContact SD-CG 3.75Å; F696-L699 PolarHBondContact O-N 3.25Å; Y697-L699 PolarHBondContact O-N 2.94Å; L699-I744 HydrophobicContact CB-CG2 4.34Å; L699-N747 HydrophobicContact CD2-CB 4.14Å; L699-N747 PolarHBondContact O-ND2 3.32Å; L699-L748 HydrophobicContact CD1-CB 4.43Å; L699-L748 HydrophobicContact CD1-CD1 4.07Å; L699-A751 HydrophobicContact CD2-CB 4.32Å
700	W	93.6	Very high	91.6	Very high	140 Å²	140	43.7 Å²	43.7	53%	0.53	21%	0.213	S	C	.	.	H	α-helix	trans	-92.3	-44.2	176.7	178.7	26.1	0	0	0	112.1	Y697 R698 S702 L703 F704 I744	Y697-W700 PolarHBondContact O-N 3.3Å; R698-W700 PolarHBondContact O-N 3.32Å; W700-S702 PolarHBondContact O-N 3.04Å; W700-L703 WeakPolarHBondContact O-CB 3.5Å; W700-L703 PolarHBondContact O-N 3.01Å; W700-F704 AromaticContact CD1-CE2 3.75Å; W700-F704 AromaticContact NE1-CE2 3.47Å; W700-F704 AromaticContact NE1-CZ 3.66Å; W700-I744 HydrophobicContact CB-CD1 4.19Å; W700-I744 HydrophobicContact CB-CG1 4.37Å; W700-I744 HydrophobicContact CG-CD1 4.41Å
701	L	94.6	Very high	92.1	Very high	46 Å²	46	41.8 Å²	41.8	24%	0.241	20%	0.198	C	C	.	.	H	α-helix	trans	-65.5	-38.4	-175.5	-178.5	58.7	0	0	0	112.9	L684 Y697 R698 L703 F704 L705	L684-L701 HydrophobicContact CD2-CD2 3.3Å; Y697-L701 HydrophobicContact CD2-CD2 4.14Å; Y697-L701 HydrophobicContact CE2-CD2 4.28Å; Y697-L701 WeakPolarHBondContact O-CB 3.38Å; Y697-L701 PolarHBondContact O-N 3.41Å; R698-L701 PolarHBondContact O-N 3.16Å; L701-L703 PolarHBondContact O-N 3.36Å; L701-L703 VanDerWaalsContact O-N 3.1Å; L701-F704 PolarHBondContact O-N 3.5Å; L701-L705 PolarHBondContact O-N 3.32Å
702	S	94.9	Very high	92.9	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.007	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-21	176	53.2	0	0	0	0	114.2	R698 W700 F704 N747 G761	R698-S702 VanDerWaalsContact O-CB 3.23Å; R698-S702 WeakPolarHBondContact O-CB 3.26Å; R698-S702 PolarHBondContact O-N 2.91Å; R698-S702 PolarHBondContact O-OG 3.36Å; W700-S702 PolarHBondContact O-N 3.04Å; S702-F704 PolarHBondContact O-N 2.92Å; S702-N747 PolarHBondContact OG-ND2 3.38Å; S702-G761 PolarHBondContact O-N 3.15Å
703	L	95.7	Very high	93.3	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.016	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-22.2	174.2	-61	176.5	0	0	0	113.4	H453 W700 L701 I744 N747 P762	H453-L703 PolarHBondContact NE2-O 3.03Å; W700-L703 WeakPolarHBondContact O-CB 3.5Å; W700-L703 PolarHBondContact O-N 3.01Å; L701-L703 PolarHBondContact O-N 3.36Å; L701-L703 VanDerWaalsContact O-N 3.1Å; L703-I744 HydrophobicContact CD1-CG1 4.11Å; L703-N747 WeakPolarHBondContact CD2-ND2 3.35Å; L703-P762 WeakPolarHBondContact O-CB 3.36Å; L703-P762 VanDerWaalsContact O-CD 3.29Å; L703-P762 WeakPolarHBondContact O-CD 3.5Å
704	F	95.5	Very high	93.6	Very high	24 Å²	24	39 Å²	39	11%	0.105	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-31.4	179.9	-55.3	-83.8	0	0	0	112.9	W448 I449 V452 H453 I456 W700 L701 S702 H706	W448-F704 AromaticContact CH2-CE1 3.8Å; W448-F704 HydrophobicContact CH2-CE1 3.8Å; W448-F704 HydrophobicContact CH2-CZ 4.23Å; W448-F704 HydrophobicContact CZ3-CE1 4.05Å; I449-F704 HydrophobicContact CD1-CD1 3.56Å; I449-F704 HydrophobicContact CD1-CE1 3.39Å; V452-F704 HydrophobicContact CG1-CB 4.37Å; V452-F704 HydrophobicContact CG1-CD1 3.68Å; V452-F704 HydrophobicContact CG1-CE1 4.37Å; V452-F704 HydrophobicContact CG1-CG 4.35Å; H453-F704 PolarHBondContact CD2-O 2.88Å; I456-F704 HydrophobicContact CD1-CB 3.82Å; W700-F704 AromaticContact CD1-CE2 3.75Å; W700-F704 AromaticContact NE1-CE2 3.47Å; W700-F704 AromaticContact NE1-CZ 3.66Å; L701-F704 PolarHBondContact O-N 3.5Å; S702-F704 PolarHBondContact O-N 2.92Å; F704-H706 PolarHBondContact O-ND1 3.34Å; F704-H706 VanDerWaalsContact O-ND1 3.16Å
705	L	94.9	Very high	93.9	Very high	7 Å²	7	36.5 Å²	36.5	4%	0.037	18%	0.176	C	C	.	.			trans	-63.7	154.3	172.8	-65.8	170.8	0	0	0	110.8	I456 L510 G511 L701 V760 G761	I456-L705 HydrophobicContact CG2-CD2 3.82Å; L510-L705 HydrophobicContact CB-CD1 4.39Å; L510-L705 HydrophobicContact CB-CD2 4.03Å; G511-L705 VanDerWaalsContact C-CD1 3.42Å; L701-L705 PolarHBondContact O-N 3.32Å; L705-V760 HydrophobicContact CB-CB 3.78Å; L705-V760 HydrophobicContact CB-CG1 3.56Å; L705-V760 HydrophobicContact CD1-CG1 3.88Å; L705-V760 HydrophobicContact CG-CG1 4.37Å; L705-G761 WeakPolarHBondContact O-CA 3.36Å; L705-G761 PolarHBondContact O-N 2.84Å
706	H	94.9	Very high	94.1	Very high	5 Å²	5	37.4 Å²	37.4	2%	0.023	18%	0.182	C	C	.	.			trans	-139.9	145.6	174.3	-75.5	71.8	0	0	0	109.4	H453 F704 G708 H711 C712 S715 P762	H453-H706 AromaticContact CD2-CE1 3.56Å; H453-H706 AromaticContact CE1-CE1 3.91Å; H453-H706 AromaticContact CG-CE1 3.42Å; H453-H706 VanDerWaalsContact CG-CE1 3.42Å; H453-H706 AromaticContact ND1-CE1 3.68Å; H453-H706 AromaticContact NE2-CE1 3.89Å; F704-H706 PolarHBondContact O-ND1 3.34Å; F704-H706 VanDerWaalsContact O-ND1 3.16Å; H706-G708 PolarHBondContact O-N 3Å; H706-H711 AromaticContact CD2-CD2 3.97Å; H706-C712 HydrophobicContact CB-CB 4.12Å; H706-C712 VanDerWaalsContact CD2-CA 3.49Å; H706-C712 WeakPolarHBondContact CD2-CA 3.31Å; H706-S715 WeakPolarHBondContact NE2-CB 3.49Å; H706-S715 PolarHBondContact NE2-OG 3.45Å; H706-P762 WeakPolarHBondContact CE1-CD 3.46Å; H706-P762 VanDerWaalsContact NE2-CD 3.29Å; H706-P762 WeakPolarHBondContact NE2-CD 3.47Å
707	A	92	Very high	94.3	Very high	13 Å²	13	36.7 Å²	36.7	11%	0.107	19%	0.189	C	C	.	.	S	Bend	trans	-65	-21.4	-176.6	0	0	0	0	0	113.6	N497 W499 V760	N497-A707 PolarHBondContact ND2-O 3.04Å; W499-A707 HydrophobicContact CB-CB 4.14Å; W499-A707 HydrophobicContact CG-CB 4.06Å; A707-V760 HydrophobicContact CB-CG2 3.84Å; A707-V760 VanDerWaalsContact N-CG2 3.28Å
708	G	92.7	Very high	94.4	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.	S	Bend	trans	175.5	-178.4	178.2	0	0	0	0	0	112.8	W499 I500 H706 L710 H711 C712	W499-G708 CarbonylContact O-C 3.51Å; W499-G708 VanDerWaalsContact O-C 3.29Å; W499-G708 WeakPolarHBondContact O-CA 3.46Å; I500-G708 CarbonylContact O-C 3.6Å; I500-G708 VanDerWaalsContact O-CA 3.26Å; I500-G708 WeakPolarHBondContact O-CA 3.43Å; H706-G708 PolarHBondContact O-N 3Å; G708-L710 PolarHBondContact O-N 2.92Å; G708-H711 PolarHBondContact O-N 3.11Å; G708-C712 PolarHBondContact O-N 2.98Å
709	I	94.6	Very high	94.4	Very high	72 Å²	72	35 Å²	35	37%	0.369	18%	0.183	S	C	.	.	H	α-helix	trans	-60.4	-43.9	-175.1	-62.4	169.7	0	0	0	111	V461 W499 I500 C712 M713	V461-I709 HydrophobicContact CG2-CG1 4.29Å; W499-I709 PolarHBondContact O-N 3.43Å; W499-I709 VanDerWaalsContact O-N 3.1Å; I500-I709 HydrophobicContact CG2-CD1 4.38Å; I500-I709 PolarHBondContact O-N 2.94Å; I709-C712 PolarHBondContact O-N 3.11Å; I709-M713 HydrophobicContact CG2-CG 4.49Å; I709-M713 HydrophobicContact CG2-SD 4.16Å; I709-M713 WeakPolarHBondContact O-CG 3.46Å; I709-M713 PolarHBondContact O-N 3.2Å
710	L	92.7	Very high	94.4	Very high	61 Å²	61	36.9 Å²	36.9	32%	0.319	19%	0.192	S	C	.	.	H	α-helix	trans	-65.2	-42.1	-179.6	-65.2	-179	0	0	0	111.6	W499 I500 G708 M713 V714	W499-L710 HydrophobicContact CE3-CB 4.08Å; W499-L710 WeakPolarHBondContact O-CB 3.45Å; W499-L710 PolarHBondContact O-N 3.33Å; I500-L710 HydrophobicContact CD1-CD1 3.82Å; I500-L710 HydrophobicContact CD1-CD2 4.48Å; I500-L710 HydrophobicContact CD1-CG 3.98Å; I500-L710 HydrophobicContact CG1-CD1 3.94Å; I500-L710 HydrophobicContact CG1-CG 4.16Å; G708-L710 PolarHBondContact O-N 2.92Å; L710-M713 PolarHBondContact O-N 3.23Å; L710-V714 WeakPolarHBondContact O-CG2 3.11Å; L710-V714 PolarHBondContact O-N 2.99Å
711	H	92.7	Very high	94.3	Very high	28 Å²	28	32.5 Å²	32.5	13%	0.13	18%	0.18	C	C	.	.	H	α-helix	trans	-62.9	-45.5	176	-175.4	-175.7	0	0	0	110.7	W499 H706 G708 M713 V714 S715 V760	W499-H711 HydrophobicContact CB-CB 4.16Å; W499-H711 HydrophobicContact CD2-CB 3.86Å; W499-H711 HydrophobicContact CE3-CB 3.75Å; W499-H711 HydrophobicContact CG-CB 4.06Å; W499-H711 HydrophobicContact CZ3-CB 4.43Å; H706-H711 AromaticContact CD2-CD2 3.97Å; G708-H711 PolarHBondContact O-N 3.11Å; H711-M713 VanDerWaalsContact C-N 3.33Å; H711-M713 PolarHBondContact O-N 3.47Å; H711-V714 PolarHBondContact O-N 3.33Å; H711-S715 WeakPolarHBondContact O-CB 3.49Å; H711-S715 PolarHBondContact O-N 2.99Å; H711-S715 PolarHBondContact O-OG 2.89Å; H711-V760 PolarHBondContact CE1-O 3.06Å; H711-V760 VanDerWaalsContact CE1-O 3.26Å
712	C	95.9	Very high	94.2	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.02	18%	0.175	C	C	.	.	H	α-helix	trans	-60.1	-40.4	174.5	-177.6	0	0	0	0	112.3	T457 H706 G708 I709 S715 V716	T457-C712 HydrophobicContact CG2-CB 3.86Å; T457-C712 PolarHBondContact OG1-SG 2.98Å; H706-C712 HydrophobicContact CB-CB 4.12Å; H706-C712 VanDerWaalsContact CD2-CA 3.49Å; H706-C712 WeakPolarHBondContact CD2-CA 3.31Å; G708-C712 PolarHBondContact O-N 2.98Å; I709-C712 PolarHBondContact O-N 3.11Å; C712-S715 PolarHBondContact O-N 3.33Å; C712-V716 WeakPolarHBondContact O-CB 3.36Å; C712-V716 VanDerWaalsContact O-CG2 3.28Å; C712-V716 WeakPolarHBondContact O-CG2 3.38Å; C712-V716 PolarHBondContact O-N 2.97Å
713	M	95.4	Very high	94.1	Very high	119 Å²	119	31.4 Å²	31.4	59%	0.586	17%	0.174	S	C	*	.	H	α-helix	trans	-62.2	-44	177.1	-76	179.1	63.4	0	0	112.8	I709 L710 H711 A717	I709-M713 HydrophobicContact CG2-CG 4.49Å; I709-M713 HydrophobicContact CG2-SD 4.16Å; I709-M713 WeakPolarHBondContact O-CG 3.46Å; I709-M713 PolarHBondContact O-N 3.2Å; L710-M713 PolarHBondContact O-N 3.23Å; H711-M713 VanDerWaalsContact C-N 3.33Å; H711-M713 PolarHBondContact O-N 3.47Å; M713-A717 WeakPolarHBondContact O-CB 3.17Å; M713-A717 PolarHBondContact O-N 2.67Å
714	V	93.5	Very high	94	Very high	89 Å²	89	35 Å²	35	54%	0.539	19%	0.188	S	C	.	.	H	α-helix	trans	-63.8	-47.4	175.8	174.9	0	0	0	0	110.8	L710 H711 V716 A717 F718	L710-V714 WeakPolarHBondContact O-CG2 3.11Å; L710-V714 PolarHBondContact O-N 2.99Å; H711-V714 PolarHBondContact O-N 3.33Å; V714-V716 PolarHBondContact O-N 3.31Å; V714-A717 WeakPolarHBondContact O-CB 3.19Å; V714-A717 PolarHBondContact O-N 2.84Å; V714-F718 PolarHBondContact O-N 3.39Å
715	S	94.8	Very high	93.7	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.007	19%	0.188	C	C	.	.	H	α-helix	trans	-60.8	-43.9	177.9	-72.8	0	0	0	0	112.9	H706 H711 C712 A717 F718 Q719 Q766	H706-S715 WeakPolarHBondContact NE2-CB 3.49Å; H706-S715 PolarHBondContact NE2-OG 3.45Å; H711-S715 WeakPolarHBondContact O-CB 3.49Å; H711-S715 PolarHBondContact O-N 2.99Å; H711-S715 PolarHBondContact O-OG 2.89Å; C712-S715 PolarHBondContact O-N 3.33Å; S715-A717 VanDerWaalsContact C-N 3.34Å; S715-A717 PolarHBondContact O-N 3.06Å; S715-F718 PolarHBondContact O-N 3.4Å; S715-Q719 WeakPolarHBondContact O-CB 3.28Å; S715-Q719 WeakPolarHBondContact O-CG 3.38Å; S715-Q719 PolarHBondContact O-N 3.25Å; S715-Q719 PolarHBondContact O-NE2 3.01Å; S715-Q766 PolarHBondContact OG-NE2 2.86Å
716	V	96.1	Very high	93.5	Very high	22 Å²	22	34.5 Å²	34.5	13%	0.133	19%	0.186	C	C	.	.	H	α-helix	trans	-67	-34.8	175.8	170.7	0	0	0	0	111.2	T450 L454 C712 V714 Q719 M720	T450-V716 HydrophobicContact CG2-CG1 4.2Å; T450-V716 HydrophobicContact CG2-CG2 4.33Å; L454-V716 HydrophobicContact CD2-CG2 4.32Å; L454-V716 HydrophobicContact CG-CG2 4.24Å; C712-V716 WeakPolarHBondContact O-CB 3.36Å; C712-V716 VanDerWaalsContact O-CG2 3.28Å; C712-V716 WeakPolarHBondContact O-CG2 3.38Å; C712-V716 PolarHBondContact O-N 2.97Å; V714-V716 PolarHBondContact O-N 3.31Å; V716-Q719 PolarHBondContact O-N 2.99Å; V716-M720 HydrophobicContact CG1-CG 4.19Å; V716-M720 WeakPolarHBondContact O-CB 3.49Å; V716-M720 VanDerWaalsContact O-CG 3.32Å; V716-M720 WeakPolarHBondContact O-CG 3.36Å; V716-M720 PolarHBondContact O-N 2.95Å
717	A	95.4	Very high	93.4	Very high	54 Å²	54	34.2 Å²	34.2	45%	0.446	19%	0.185	S	C	.	.	H	α-helix	trans	-64.5	-45.5	173.3	0	0	0	0	0	111.8	M713 V714 S715 T721	M713-A717 WeakPolarHBondContact O-CB 3.17Å; M713-A717 PolarHBondContact O-N 2.67Å; V714-A717 WeakPolarHBondContact O-CB 3.19Å; V714-A717 PolarHBondContact O-N 2.84Å; S715-A717 VanDerWaalsContact C-N 3.34Å; S715-A717 PolarHBondContact O-N 3.06Å; A717-T721 WeakPolarHBondContact O-CB 3.49Å; A717-T721 VanDerWaalsContact O-CG2 3.3Å; A717-T721 WeakPolarHBondContact O-CG2 3.17Å; A717-T721 PolarHBondContact O-N 2.72Å; A717-T721 PolarHBondContact O-OG1 3.29Å
718	F	94.6	Very high	93.2	Very high	31 Å²	31	36.3 Å²	36.3	14%	0.136	19%	0.192	C	C	.	.	H	α-helix	trans	-59.5	-46.3	173.1	-178.5	-81.9	0	0	0	111.5	V714 S715 T721 I722 Q766 I769	V714-F718 PolarHBondContact O-N 3.39Å; S715-F718 PolarHBondContact O-N 3.4Å; F718-T721 WeakPolarHBondContact CA-OG1 3.39Å; F718-T721 PolarHBondContact O-N 2.94Å; F718-T721 PolarHBondContact O-OG1 2.97Å; F718-T721 VanDerWaalsContact O-OG1 3.09Å; F718-I722 HydrophobicContact CD2-CD1 3.94Å; F718-I722 HydrophobicContact CE1-CB 4.29Å; F718-I722 HydrophobicContact CE1-CG2 4.29Å; F718-I722 HydrophobicContact CE2-CB 4.44Å; F718-I722 HydrophobicContact CE2-CD1 3.62Å; F718-I722 HydrophobicContact CZ-CB 4.21Å; F718-I722 HydrophobicContact CZ-CD1 4.16Å; F718-I722 HydrophobicContact CZ-CG2 4.01Å; F718-I722 PolarHBondContact O-N 2.77Å; F718-Q766 HydrophobicContact CD1-CB 4Å; F718-Q766 HydrophobicContact CD1-CG 3.6Å; F718-Q766 HydrophobicContact CE1-CB 3.76Å; F718-Q766 HydrophobicContact CE1-CG 3.8Å; F718-Q766 HydrophobicContact CE2-CB 4.37Å; F718-Q766 HydrophobicContact CG-CB 4.43Å; F718-Q766 HydrophobicContact CG-CG 4.14Å; F718-Q766 HydrophobicContact CZ-CB 3.96Å; F718-Q766 HydrophobicContact CZ-CG 4.46Å; F718-Q766 VanDerWaalsContact CZ-O 3.28Å; F718-Q766 WeakPolarHBondContact CZ-O 3.31Å; F718-I769 HydrophobicContact CE1-CB 4.28Å; F718-I769 HydrophobicContact CE1-CG2 3.95Å; F718-I769 HydrophobicContact CZ-CB 4.46Å; F718-I769 HydrophobicContact CZ-CG2 4.18Å
719	Q	94.9	Very high	92.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.193	C	C	.	.	I	π-helix	trans	-63.9	-48.4	-178.8	-69.7	157	26.8	0	0	111.1	T446 T450 H453 S715 V716 T721 L723 R724 Y739	T446-Q719 HydrophobicContact CG2-CB 4.38Å; T446-Q719 WeakPolarHBondContact CG2-O 3.4Å; T450-Q719 HydrophobicContact CG2-CB 3.58Å; T450-Q719 HydrophobicContact CG2-CG 4.42Å; H453-Q719 PolarHBondContact CE1-NE2 3.26Å; H453-Q719 VanDerWaalsContact CE1-NE2 3.31Å; H453-Q719 PolarHBondContact CE1-OE1 2.86Å; H453-Q719 PolarHBondContact ND1-NE2 3.28Å; H453-Q719 PolarHBondContact ND1-OE1 3.47Å; S715-Q719 WeakPolarHBondContact O-CB 3.28Å; S715-Q719 WeakPolarHBondContact O-CG 3.38Å; S715-Q719 PolarHBondContact O-N 3.25Å; S715-Q719 PolarHBondContact O-NE2 3.01Å; V716-Q719 PolarHBondContact O-N 2.99Å; Q719-T721 VanDerWaalsContact C-N 3.26Å; Q719-T721 PolarHBondContact O-N 3.09Å; Q719-L723 HydrophobicContact CB-CB 4.39Å; Q719-L723 HydrophobicContact CB-CD2 4.29Å; Q719-L723 HydrophobicContact CG-CD2 4.11Å; Q719-L723 WeakPolarHBondContact O-CB 3.46Å; Q719-L723 PolarHBondContact O-N 3.22Å; Q719-R724 PolarHBondContact O-N 2.91Å; Q719-Y739 PolarHBondContact NE2-OH 3.27Å
720	M	93	Very high	92.5	Very high	55 Å²	55	33.4 Å²	33.4	27%	0.271	18%	0.178	S	C	.	.	I	π-helix	trans	-67.4	-22.4	177.4	-71	-67.6	-175.5	0	0	113.7	Y447 T450 V716 R724	Y447-M720 HydrophobicContact CD1-CE 4.16Å; Y447-M720 HydrophobicContact CD1-SD 4.37Å; Y447-M720 HydrophobicContact CE1-CE 4.4Å; Y447-M720 HydrophobicContact CE1-SD 4.19Å; T450-M720 HydrophobicContact CG2-CE 4.02Å; T450-M720 HydrophobicContact CG2-CG 4.41Å; T450-M720 VanDerWaalsContact OG1-CE 3.31Å; T450-M720 WeakPolarHBondContact OG1-CE 3.29Å; V716-M720 HydrophobicContact CG1-CG 4.19Å; V716-M720 WeakPolarHBondContact O-CB 3.49Å; V716-M720 VanDerWaalsContact O-CG 3.32Å; V716-M720 WeakPolarHBondContact O-CG 3.36Å; V716-M720 PolarHBondContact O-N 2.95Å; M720-R724 PolarHBondContact O-NE 3.37Å; M720-R724 PolarHBondContact O-NH2 2.93Å
721	T	91	Very high	92.4	Very high	48 Å²	48	30.7 Å²	30.7	29%	0.294	17%	0.165	S	C	.	.	I	π-helix	trans	-91.8	-57.6	178.7	50.9	0	0	0	0	113	M414 A717 F718 Q719 D725	M414-T721 HydrophobicContact CE-CG2 3.86Å; M414-T721 HydrophobicContact SD-CG2 3.91Å; A717-T721 WeakPolarHBondContact O-CB 3.49Å; A717-T721 VanDerWaalsContact O-CG2 3.3Å; A717-T721 WeakPolarHBondContact O-CG2 3.17Å; A717-T721 PolarHBondContact O-N 2.72Å; A717-T721 PolarHBondContact O-OG1 3.29Å; F718-T721 WeakPolarHBondContact CA-OG1 3.39Å; F718-T721 PolarHBondContact O-N 2.94Å; F718-T721 PolarHBondContact O-OG1 2.97Å; F718-T721 VanDerWaalsContact O-OG1 3.09Å; Q719-T721 VanDerWaalsContact C-N 3.26Å; Q719-T721 PolarHBondContact O-N 3.09Å; T721-D725 WeakPolarHBondContact O-CB 3.12Å
722	I	92.4	Very high	92.4	Very high	24 Å²	24	35.8 Å²	35.8	12%	0.123	18%	0.183	C	C	.	.	I	π-helix	trans	-96	-51.8	-170.1	-68.2	169.9	0	0	0	111.6	V415 F718 R724 D725 L726 I769 L773	V415-I722 HydrophobicContact CG2-CD1 4.25Å; V415-I722 HydrophobicContact CG2-CG1 4.02Å; F718-I722 HydrophobicContact CD2-CD1 3.94Å; F718-I722 HydrophobicContact CE1-CB 4.29Å; F718-I722 HydrophobicContact CE1-CG2 4.29Å; F718-I722 HydrophobicContact CE2-CB 4.44Å; F718-I722 HydrophobicContact CE2-CD1 3.62Å; F718-I722 HydrophobicContact CZ-CB 4.21Å; F718-I722 HydrophobicContact CZ-CD1 4.16Å; F718-I722 HydrophobicContact CZ-CG2 4.01Å; F718-I722 PolarHBondContact O-N 2.77Å; I722-R724 PolarHBondContact O-N 2.97Å; I722-D725 WeakPolarHBondContact O-CB 3.15Å; I722-D725 PolarHBondContact O-N 3.47Å; I722-L726 HydrophobicContact CG2-CD1 4.15Å; I722-L726 PolarHBondContact O-N 3.43Å; I722-I769 HydrophobicContact CG2-CG2 3.93Å; I722-L773 HydrophobicContact CD1-CD1 4.47Å; I722-L773 HydrophobicContact CG2-CD1 3.83Å; I722-L773 HydrophobicContact CG2-CG 4.42Å
723	L	93.9	Very high	92.2	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	I	π-helix	trans	-60	-47.9	-177.8	-171.8	71.1	0	0	0	111.1	F445 T446 I449 Q719 D725 L726 E727 I735 Y739 I769	F445-L723 HydrophobicContact CD1-CD2 4.28Å; F445-L723 HydrophobicContact CE1-CD2 4.12Å; T446-L723 HydrophobicContact CG2-CB 4.42Å; T446-L723 HydrophobicContact CG2-CD2 4.24Å; T446-L723 HydrophobicContact CG2-CG 4.49Å; I449-L723 HydrophobicContact CG2-CD2 4.03Å; Q719-L723 HydrophobicContact CB-CB 4.39Å; Q719-L723 HydrophobicContact CB-CD2 4.29Å; Q719-L723 HydrophobicContact CG-CD2 4.11Å; Q719-L723 WeakPolarHBondContact O-CB 3.46Å; Q719-L723 PolarHBondContact O-N 3.22Å; L723-D725 PolarHBondContact O-N 2.98Å; L723-D725 VanDerWaalsContact O-N 3.09Å; L723-L726 PolarHBondContact O-N 3.38Å; L723-E727 WeakPolarHBondContact O-CB 3.44Å; L723-E727 PolarHBondContact O-N 3.33Å; L723-I735 HydrophobicContact CD1-CG2 3.39Å; L723-I735 HydrophobicContact CG-CG2 4.24Å; L723-Y739 HydrophobicContact CD1-CD2 3.84Å; L723-Y739 HydrophobicContact CD1-CE2 4.35Å; L723-Y739 HydrophobicContact CD2-CD2 4.09Å; L723-Y739 HydrophobicContact CD2-CE2 3.9Å; L723-I769 HydrophobicContact CD1-CD1 3.65Å; L723-I769 HydrophobicContact CD1-CG1 3.8Å; L723-I769 HydrophobicContact CD1-CG2 4.07Å
724	R	92.4	Very high	92.2	Very high	80 Å²	80	39.4 Å²	39.4	30%	0.302	20%	0.196	S	C	.	.	H	α-helix	trans	-59.7	-20.9	175.9	-163.8	-178.3	55.2	164.7	-9.4	113.7	P443 T446 Q719 M720 I722 K728	P443-R724 HydrophobicContact CB-CG 3.82Å; P443-R724 HydrophobicContact CG-CG 3.76Å; T446-R724 HydrophobicContact CG2-CB 3.76Å; T446-R724 HydrophobicContact CG2-CG 4.3Å; T446-R724 WeakPolarHBondContact OG1-CA 3.33Å; T446-R724 PolarHBondContact OG1-N 2.9Å; Q719-R724 PolarHBondContact O-N 2.91Å; M720-R724 PolarHBondContact O-NE 3.37Å; M720-R724 PolarHBondContact O-NH2 2.93Å; I722-R724 PolarHBondContact O-N 2.97Å; R724-K728 WeakPolarHBondContact O-CD 3.26Å; R724-K728 WeakPolarHBondContact O-CE 3.28Å; R724-K728 WeakPolarHBondContact O-CG 3.47Å
725	D	89.8	Confident	92.2	Very high	19 Å²	19	35.1 Å²	35.1	10%	0.102	17%	0.17	C	C	.	.	H	α-helix	trans	-88.8	-43.5	-179.1	-164.3	55.9	0	0	0	110.9	R408 G413 M414 T721 I722 L723	R408-D725 WeakPolarHBondContact CD-O 3.35Å; R408-D725 IonicContact CZ-OD2 3.02Å; R408-D725 VanDerWaalsContact CZ-OD2 3.31Å; R408-D725 PolarHBondContact NE-O 2.77Å; R408-D725 VanDerWaalsContact NE-O 3.17Å; R408-D725 IonicContact NE-OD1 3.81Å; R408-D725 PolarHBondContact NE-OD1 2.93Å; R408-D725 IonicContact NE-OD2 3.96Å; R408-D725 PolarHBondContact NE-OD2 3.47Å; R408-D725 IonicContact NH2-OD2 2.67Å; R408-D725 PolarHBondContact NH2-OD2 3.23Å; G413-D725 WeakPolarHBondContact CA-OD2 3.36Å; M414-D725 PolarHBondContact N-OD2 3.31Å; T721-D725 WeakPolarHBondContact O-CB 3.12Å; I722-D725 WeakPolarHBondContact O-CB 3.15Å; I722-D725 PolarHBondContact O-N 3.47Å; L723-D725 PolarHBondContact O-N 2.98Å; L723-D725 VanDerWaalsContact O-N 3.09Å
726	L	90	Very high	92.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-67.9	-35.4	172.1	-75.8	166.1	0	0	0	113.1	I722 L723 K728 L729 A730 I735 I769 C772 L773	I722-L726 HydrophobicContact CG2-CD1 4.15Å; I722-L726 PolarHBondContact O-N 3.43Å; L723-L726 PolarHBondContact O-N 3.38Å; L726-K728 VanDerWaalsContact C-N 3.29Å; L726-K728 PolarHBondContact O-N 3.47Å; L726-L729 WeakPolarHBondContact O-CA 3.38Å; L726-L729 VanDerWaalsContact O-CB 3.28Å; L726-L729 WeakPolarHBondContact O-CB 3.46Å; L726-L729 PolarHBondContact O-N 3.26Å; L726-A730 PolarHBondContact O-N 2.68Å; L726-I735 HydrophobicContact CB-CD1 4.11Å; L726-I769 HydrophobicContact CD1-CG2 3.74Å; L726-C772 HydrophobicContact CD1-CB 4.12Å; L726-L773 HydrophobicContact CD1-CD2 3.96Å; L726-L773 HydrophobicContact CD1-CG 4.12Å; L726-L773 HydrophobicContact CD2-CD2 4.1Å; L726-L773 HydrophobicContact CG-CD2 4.14Å
727	E	92.8	Very high	92.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.6	-30.4	-179.9	-157.1	-164.4	152.7	0	0	113.2	H441 P443 F444 F445 T446 L723 L729 G731 W732 I735	H441-E727 WeakPolarHBondContact CB-O 3.41Å; P443-E727 VanDerWaalsContact C-CD 3.47Å; P443-E727 VanDerWaalsContact C-OE2 3.25Å; P443-E727 VanDerWaalsContact CA-OE1 3.25Å; P443-E727 WeakPolarHBondContact CA-OE1 3.4Å; P443-E727 WeakPolarHBondContact CA-OE2 3.35Å; P443-E727 HydrophobicContact CB-CB 4.11Å; P443-E727 HydrophobicContact CB-CG 4.42Å; P443-E727 WeakPolarHBondContact CB-OE2 3.47Å; F444-E727 PolarHBondContact N-OE1 3.29Å; F445-E727 WeakPolarHBondContact CB-OE1 3.36Å; F445-E727 PolarHBondContact N-OE1 3.05Å; T446-E727 VanDerWaalsContact CB-OE2 3.22Å; T446-E727 WeakPolarHBondContact CB-OE2 3.46Å; T446-E727 PolarHBondContact N-OE2 3.34Å; T446-E727 PolarHBondContact OG1-OE2 3.14Å; L723-E727 WeakPolarHBondContact O-CB 3.44Å; L723-E727 PolarHBondContact O-N 3.33Å; E727-L729 PolarHBondContact O-N 2.85Å; E727-G731 VanDerWaalsContact O-CA 3.27Å; E727-G731 WeakPolarHBondContact O-CA 2.95Å; E727-G731 PolarHBondContact O-N 3.38Å; E727-W732 HydrophobicContact CG-CB 4.29Å; E727-W732 VanDerWaalsContact OE1-CA 3.31Å; E727-W732 WeakPolarHBondContact OE1-CA 3.35Å; E727-W732 WeakPolarHBondContact OE1-CB 3.36Å; E727-I735 HydrophobicContact CB-CG1 4.39Å; E727-I735 HydrophobicContact CB-CG2 4.46Å; E727-I735 HydrophobicContact CG-CB 4.27Å; E727-I735 HydrophobicContact CG-CG1 4.45Å; E727-I735 HydrophobicContact CG-CG2 4.44Å
728	K	88.7	Confident	92.3	Very high	56 Å²	56	34.8 Å²	34.8	24%	0.243	16%	0.161	C	C	.	.	H	α-helix	trans	-66.7	-27.5	171.4	-65.4	164	-168	156.1	0	112.6	H441 P443 R724 L726	H441-K728 PolarHBondContact N-O 3.01Å; P443-K728 HydrophobicContact CG-CG 4.4Å; R724-K728 WeakPolarHBondContact O-CD 3.26Å; R724-K728 WeakPolarHBondContact O-CE 3.28Å; R724-K728 WeakPolarHBondContact O-CG 3.47Å; L726-K728 VanDerWaalsContact C-N 3.29Å; L726-K728 PolarHBondContact O-N 3.47Å
729	L	85	Confident	92.4	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.031	16%	0.155	C	C	.	.	H	α-helix	trans	-83.7	-52.2	-176.5	-164.1	77.9	0	0	0	112	Y410 M438 L726 E727 E776	Y410-L729 HydrophobicContact CD2-CD1 3.57Å; Y410-L729 HydrophobicContact CD2-CD2 4.22Å; Y410-L729 HydrophobicContact CD2-CG 4.15Å; Y410-L729 HydrophobicContact CE2-CD1 4.02Å; Y410-L729 HydrophobicContact CE2-CD2 3.94Å; Y410-L729 HydrophobicContact CE2-CG 4.07Å; Y410-L729 HydrophobicContact CG-CD1 4.32Å; M438-L729 HydrophobicContact CE-CD1 3.6Å; M438-L729 HydrophobicContact CE-CG 3.92Å; M438-L729 WeakPolarHBondContact CE-O 3.42Å; L726-L729 WeakPolarHBondContact O-CA 3.38Å; L726-L729 VanDerWaalsContact O-CB 3.28Å; L726-L729 WeakPolarHBondContact O-CB 3.46Å; L726-L729 PolarHBondContact O-N 3.26Å; E727-L729 PolarHBondContact O-N 2.85Å; L729-E776 WeakPolarHBondContact CD2-OE1 3.47Å
730	A	87	Confident	92.5	Very high	6 Å²	6	35.7 Å²	35.7	5%	0.05	17%	0.166	C	C	.	.	H	α-helix	trans	-103.4	-8.7	-170.3	0	0	0	0	0	114.1	L726 R734 I735 L830 P831	L726-A730 PolarHBondContact O-N 2.68Å; A730-R734 WeakPolarHBondContact O-CD 3.49Å; A730-R734 WeakPolarHBondContact O-CG 3.48Å; A730-I735 HydrophobicContact CB-CD1 3.98Å; A730-I735 HydrophobicContact CB-CG1 4.1Å; A730-L830 HydrophobicContact CB-CD2 3.9Å; A730-P831 HydrophobicContact CB-CG 4.37Å
731	G	90.4	Very high	92.7	Very high	4 Å²	4	35.8 Å²	35.8	4%	0.041	17%	0.167	C	C	.	.			trans	84	154.1	-178.1	0	0	0	0	0	114.3	H441 E727 L733 R734 I735	H441-G731 WeakPolarHBondContact CD2-CA 3.4Å; E727-G731 VanDerWaalsContact O-CA 3.27Å; E727-G731 WeakPolarHBondContact O-CA 2.95Å; E727-G731 PolarHBondContact O-N 3.38Å; G731-L733 PolarHBondContact O-N 3.46Å; G731-R734 PolarHBondContact O-N 3.42Å; G731-I735 PolarHBondContact O-N 2.03Å
732	W	92.9	Very high	93	Very high	135 Å²	135	33.5 Å²	33.5	51%	0.511	15%	0.153	S	C	.	.	H	α-helix	trans	-54.4	-50.5	-172.7	72.1	-87	0	0	0	113.3	F445 E727 R734 I735 S736	F445-W732 HydrophobicContact CB-CB 4.17Å; E727-W732 HydrophobicContact CG-CB 4.29Å; E727-W732 VanDerWaalsContact OE1-CA 3.31Å; E727-W732 WeakPolarHBondContact OE1-CA 3.35Å; E727-W732 WeakPolarHBondContact OE1-CB 3.36Å; W732-R734 PolarHBondContact O-N 2.91Å; W732-I735 PolarHBondContact O-N 3.42Å; W732-S736 WeakPolarHBondContact O-CB 3.04Å; W732-S736 PolarHBondContact O-N 2.97Å; W732-S736 PolarHBondContact O-OG 3.42Å
733	L	93.1	Very high	93.2	Very high	90 Å²	90	32.4 Å²	32.4	47%	0.471	15%	0.147	S	C	.	.	H	α-helix	trans	-65.2	-36.3	-174.4	-179.9	147.5	0	0	0	113	G731 S736 I737	G731-L733 PolarHBondContact O-N 3.46Å; L733-S736 WeakPolarHBondContact CA-OG 3.02Å; L733-S736 PolarHBondContact O-OG 3.03Å; L733-S736 VanDerWaalsContact O-OG 3.04Å; L733-I737 HydrophobicContact CD2-CD1 3.71Å; L733-I737 HydrophobicContact CG-CD1 4.31Å; L733-I737 WeakPolarHBondContact O-CD1 3.36Å; L733-I737 VanDerWaalsContact O-CG1 3.25Å; L733-I737 WeakPolarHBondContact O-CG1 3.35Å; L733-I737 PolarHBondContact O-N 2.93Å
734	R	93.9	Very high	93.3	Very high	107 Å²	107	33.8 Å²	33.8	40%	0.404	16%	0.155	S	C	.	.	H	α-helix	trans	-73.1	-43.6	-179.9	-53.3	-159.9	-168.7	-165.5	3.3	111	A730 G731 W732 I737 I738 F829	A730-R734 WeakPolarHBondContact O-CD 3.49Å; A730-R734 WeakPolarHBondContact O-CG 3.48Å; G731-R734 PolarHBondContact O-N 3.42Å; W732-R734 PolarHBondContact O-N 2.91Å; R734-I737 PolarHBondContact O-N 3.32Å; R734-I738 WeakPolarHBondContact O-CG1 3.36Å; R734-I738 PolarHBondContact O-N 3.36Å; R734-I738 VanDerWaalsContact O-N 3.12Å; R734-F829 WeakPolarHBondContact CD-O 3.37Å; R734-F829 PolarHBondContact NH1-O 2.92Å
735	I	94.8	Very high	93.5	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-67.6	-37	177.2	-67.4	-53.6	0	0	0	111.5	F445 L723 L726 E727 A730 G731 W732 I738 Y739 I769	F445-I735 HydrophobicContact CD1-CG2 4.32Å; L723-I735 HydrophobicContact CD1-CG2 3.39Å; L723-I735 HydrophobicContact CG-CG2 4.24Å; L726-I735 HydrophobicContact CB-CD1 4.11Å; E727-I735 HydrophobicContact CB-CG1 4.39Å; E727-I735 HydrophobicContact CB-CG2 4.46Å; E727-I735 HydrophobicContact CG-CB 4.27Å; E727-I735 HydrophobicContact CG-CG1 4.45Å; E727-I735 HydrophobicContact CG-CG2 4.44Å; A730-I735 HydrophobicContact CB-CD1 3.98Å; A730-I735 HydrophobicContact CB-CG1 4.1Å; G731-I735 PolarHBondContact O-N 2.03Å; W732-I735 PolarHBondContact O-N 3.42Å; I735-I738 HydrophobicContact CD1-CD1 4.22Å; I735-I738 PolarHBondContact O-N 2.96Å; I735-Y739 WeakPolarHBondContact O-CB 3.35Å; I735-Y739 PolarHBondContact O-N 2.94Å; I735-I769 HydrophobicContact CG2-CD1 4.1Å
736	S	95.4	Very high	93.8	Very high	17 Å²	17	29.1 Å²	29.1	12%	0.119	14%	0.136	C	C	.	.	H	α-helix	trans	-65.6	-38.8	176.4	65.4	0	0	0	0	112.6	F445 W732 L733 Y739 I740	F445-S736 VanDerWaalsContact CD2-CB 3.49Å; W732-S736 WeakPolarHBondContact O-CB 3.04Å; W732-S736 PolarHBondContact O-N 2.97Å; W732-S736 PolarHBondContact O-OG 3.42Å; L733-S736 WeakPolarHBondContact CA-OG 3.02Å; L733-S736 PolarHBondContact O-OG 3.03Å; L733-S736 VanDerWaalsContact O-OG 3.04Å; S736-Y739 PolarHBondContact O-N 3.31Å; S736-I740 WeakPolarHBondContact O-CB 3.23Å; S736-I740 VanDerWaalsContact O-CG1 3.27Å; S736-I740 WeakPolarHBondContact O-CG1 3.48Å; S736-I740 PolarHBondContact O-N 3.48Å
737	I	95.9	Very high	94	Very high	53 Å²	53	29.6 Å²	29.6	27%	0.272	14%	0.138	S	C	.	.	H	α-helix	trans	-62.3	-49.7	173.4	-68.9	167.1	0	0	0	110.9	L733 R734 Y739 L741 F829	L733-I737 HydrophobicContact CD2-CD1 3.71Å; L733-I737 HydrophobicContact CG-CD1 4.31Å; L733-I737 WeakPolarHBondContact O-CD1 3.36Å; L733-I737 VanDerWaalsContact O-CG1 3.25Å; L733-I737 WeakPolarHBondContact O-CG1 3.35Å; L733-I737 PolarHBondContact O-N 2.93Å; R734-I737 PolarHBondContact O-N 3.32Å; I737-Y739 VanDerWaalsContact C-N 3.34Å; I737-Y739 PolarHBondContact O-N 2.87Å; I737-L741 HydrophobicContact CG2-CD1 3.79Å; I737-L741 WeakPolarHBondContact O-CB 3.3Å; I737-L741 PolarHBondContact O-N 3.02Å; I737-L741 VanDerWaalsContact O-N 3.09Å; I737-F829 HydrophobicContact CG2-CD2 4.17Å; I737-F829 HydrophobicContact CG2-CE1 4.33Å; I737-F829 HydrophobicContact CG2-CE2 3.73Å; I737-F829 HydrophobicContact CG2-CZ 3.83Å
738	I	96.5	Very high	94.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.6	-46.7	177.8	-64.3	162.5	0	0	0	110.5	R734 I735 S742 I769 L825 F829	R734-I738 WeakPolarHBondContact O-CG1 3.36Å; R734-I738 PolarHBondContact O-N 3.36Å; R734-I738 VanDerWaalsContact O-N 3.12Å; I735-I738 HydrophobicContact CD1-CD1 4.22Å; I735-I738 PolarHBondContact O-N 2.96Å; I738-S742 VanDerWaalsContact O-CB 3.32Å; I738-S742 WeakPolarHBondContact O-CB 3.39Å; I738-S742 PolarHBondContact O-N 2.85Å; I738-S742 VanDerWaalsContact O-N 3.1Å; I738-S742 PolarHBondContact O-OG 2.71Å; I738-I769 HydrophobicContact CG2-CD1 4.11Å; I738-L825 HydrophobicContact CG1-CB 4.21Å; I738-L825 HydrophobicContact CG2-CB 4.47Å; I738-F829 HydrophobicContact CD1-CB 4.11Å; I738-F829 HydrophobicContact CG1-CB 4.22Å; I738-F829 HydrophobicContact CG1-CD2 4.34Å
739	Y	97.2	Very high	94.3	Very high	3 Å²	3	27.1 Å²	27.1	1%	0.012	13%	0.128	C	C	.	.	H	α-helix	trans	-61.9	-51.2	-178.2	-174.7	-84.8	0	0	0	112.7	F445 I449 H453 Q719 L723 I735 S736 I737 S742 G743 P762 S765 I769	F445-Y739 HydrophobicContact CE1-CD1 4.06Å; F445-Y739 HydrophobicContact CE1-CD2 4.17Å; F445-Y739 AromaticContact CE1-CG 3.81Å; F445-Y739 HydrophobicContact CE1-CG 3.81Å; F445-Y739 AromaticContact CZ-CD1 3.68Å; F445-Y739 HydrophobicContact CZ-CD1 3.68Å; F445-Y739 HydrophobicContact CZ-CE1 4.19Å; F445-Y739 AromaticContact CZ-CG 3.9Å; F445-Y739 HydrophobicContact CZ-CG 3.9Å; I449-Y739 HydrophobicContact CD1-CE1 4.28Å; I449-Y739 HydrophobicContact CG1-CE1 4.1Å; H453-Y739 PolarHBondContact CE1-OH 3.26Å; Q719-Y739 PolarHBondContact NE2-OH 3.27Å; L723-Y739 HydrophobicContact CD1-CD2 3.84Å; L723-Y739 HydrophobicContact CD1-CE2 4.35Å; L723-Y739 HydrophobicContact CD2-CD2 4.09Å; L723-Y739 HydrophobicContact CD2-CE2 3.9Å; I735-Y739 WeakPolarHBondContact O-CB 3.35Å; I735-Y739 PolarHBondContact O-N 2.94Å; S736-Y739 PolarHBondContact O-N 3.31Å; I737-Y739 VanDerWaalsContact C-N 3.34Å; I737-Y739 PolarHBondContact O-N 2.87Å; Y739-S742 PolarHBondContact O-OG 2.78Å; Y739-G743 PolarHBondContact O-N 2.64Å; Y739-G743 VanDerWaalsContact O-N 3.13Å; Y739-P762 HydrophobicContact CE1-CB 4.19Å; Y739-P762 WeakPolarHBondContact OH-CB 3.47Å; Y739-P762 WeakPolarHBondContact OH-CG 3.37Å; Y739-S765 WeakPolarHBondContact O-CB 3.5Å; Y739-S765 PolarHBondContact O-OG 2.94Å; Y739-I769 HydrophobicContact CD2-CG1 3.96Å
740	I	96.6	Very high	94.6	Very high	47 Å²	47	26.8 Å²	26.8	24%	0.241	13%	0.126	C	C	.	.	H	α-helix	trans	-69.2	-47.7	-175.4	-66.4	169.4	0	0	0	110.5	S736 G743 I744	S736-I740 WeakPolarHBondContact O-CB 3.23Å; S736-I740 VanDerWaalsContact O-CG1 3.27Å; S736-I740 WeakPolarHBondContact O-CG1 3.48Å; S736-I740 PolarHBondContact O-N 3.48Å; I740-G743 PolarHBondContact O-N 2.03Å; I740-I744 HydrophobicContact CG2-CD1 3.72Å; I740-I744 HydrophobicContact CG2-CG1 4.41Å; I740-I744 WeakPolarHBondContact O-CG1 3.33Å; I740-I744 PolarHBondContact O-N 2.98Å
741	L	97	Very high	94.8	Very high	57 Å²	57	26.6 Å²	26.6	30%	0.298	12%	0.124	S	C	.	.	H	α-helix	trans	-70.7	-36.7	-175.9	-67.8	177.8	0	0	0	113.1	I737 G743 T745 L825 F854	I737-L741 HydrophobicContact CG2-CD1 3.79Å; I737-L741 WeakPolarHBondContact O-CB 3.3Å; I737-L741 PolarHBondContact O-N 3.02Å; I737-L741 VanDerWaalsContact O-N 3.09Å; L741-G743 VanDerWaalsContact C-N 3.33Å; L741-T745 WeakPolarHBondContact O-CB 3.36Å; L741-T745 PolarHBondContact O-N 2.82Å; L741-T745 PolarHBondContact O-OG1 3.08Å; L741-L825 HydrophobicContact CB-CD2 3.58Å; L741-L825 HydrophobicContact CD1-CD2 3.81Å; L741-L825 HydrophobicContact CG-CD2 4.3Å; L741-F854 HydrophobicContact CB-CZ 4.37Å; L741-F854 HydrophobicContact CD1-CE1 4.46Å
742	S	97.2	Very high	94.7	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.5	-35	172.6	57.1	0	0	0	0	112.4	I738 Y739 G746 S821	I738-S742 VanDerWaalsContact O-CB 3.32Å; I738-S742 WeakPolarHBondContact O-CB 3.39Å; I738-S742 PolarHBondContact O-N 2.85Å; I738-S742 VanDerWaalsContact O-N 3.1Å; I738-S742 PolarHBondContact O-OG 2.71Å; Y739-S742 PolarHBondContact O-OG 2.78Å; S742-G746 PolarHBondContact O-N 3.15Å; S742-S821 WeakPolarHBondContact CA-OG 3.32Å
743	G	96.4	Very high	94.4	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.3	-55.5	171.1	0	0	0	0	0	112.9	Y739 I740 L741 T745 G746 N747 S765	Y739-G743 PolarHBondContact O-N 2.64Å; Y739-G743 VanDerWaalsContact O-N 3.13Å; I740-G743 PolarHBondContact O-N 2.03Å; L741-G743 VanDerWaalsContact C-N 3.33Å; G743-T745 VanDerWaalsContact C-N 3.27Å; G743-T745 PolarHBondContact O-N 3.22Å; G743-G746 PolarHBondContact O-N 3.02Å; G743-G746 VanDerWaalsContact O-N 3.16Å; G743-N747 WeakPolarHBondContact O-CB 3.4Å; G743-N747 VanDerWaalsContact O-CG 3.29Å; G743-N747 PolarHBondContact O-N 3.32Å; G743-N747 PolarHBondContact O-OD1 3.32Å; G743-S765 WeakPolarHBondContact CA-OG 3.18Å; G743-S765 PolarHBondContact N-OG 3.2Å
744	I	96.9	Very high	94	Very high	30 Å²	30	19.2 Å²	19.2	15%	0.154	9%	0.092	C	C	.	.	H	α-helix	trans	-59.3	-39.7	179.1	-65.7	170.2	0	0	0	110.8	L699 W700 L703 I740 N747 L748 F858	L699-I744 HydrophobicContact CB-CG2 4.34Å; W700-I744 HydrophobicContact CB-CD1 4.19Å; W700-I744 HydrophobicContact CB-CG1 4.37Å; W700-I744 HydrophobicContact CG-CD1 4.41Å; L703-I744 HydrophobicContact CD1-CG1 4.11Å; I740-I744 HydrophobicContact CG2-CD1 3.72Å; I740-I744 HydrophobicContact CG2-CG1 4.41Å; I740-I744 WeakPolarHBondContact O-CG1 3.33Å; I740-I744 PolarHBondContact O-N 2.98Å; I744-N747 PolarHBondContact O-N 2.84Å; I744-L748 VanDerWaalsContact O-CB 3.24Å; I744-L748 WeakPolarHBondContact O-CB 3.32Å; I744-L748 PolarHBondContact O-N 3.43Å; I744-F858 HydrophobicContact CG2-CE2 4.11Å; I744-F858 HydrophobicContact CG2-CZ 4.4Å
745	T	96.4	Very high	93.6	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-67.9	-38.5	178.1	-49.5	0	0	0	0	112.2	L741 G743 A749 F854 L857 F858 L861	L741-T745 WeakPolarHBondContact O-CB 3.36Å; L741-T745 PolarHBondContact O-N 2.82Å; L741-T745 PolarHBondContact O-OG1 3.08Å; G743-T745 VanDerWaalsContact C-N 3.27Å; G743-T745 PolarHBondContact O-N 3.22Å; T745-A749 PolarHBondContact O-N 2.78Å; T745-A749 VanDerWaalsContact O-N 3.13Å; T745-F854 HydrophobicContact CG2-CE2 4.46Å; T745-L857 HydrophobicContact CG2-CD2 3.78Å; T745-F858 HydrophobicContact CG2-CD2 4.31Å; T745-L861 HydrophobicContact CG2-CD1 3.68Å
746	G	95.4	Very high	93.1	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63.7	-49.6	172.5	0	0	0	0	0	112.2	S742 G743 L748 A749 S750 A814	S742-G746 PolarHBondContact O-N 3.15Å; G743-G746 PolarHBondContact O-N 3.02Å; G743-G746 VanDerWaalsContact O-N 3.16Å; G746-L748 VanDerWaalsContact C-N 3.3Å; G746-L748 PolarHBondContact O-N 2.99Å; G746-A749 PolarHBondContact O-N 2.82Å; G746-S750 PolarHBondContact O-N 3.08Å; G746-A814 WeakPolarHBondContact O-CA 3.26Å
747	N	95.1	Very high	92.4	Very high	10 Å²	10	19 Å²	19	5%	0.053	9%	0.093	C	C	.	.	H	α-helix	trans	-62.5	-35.8	179	-67.5	-0.7	0	0	0	112.3	L699 S702 L703 G743 I744 A751	L699-N747 HydrophobicContact CD2-CB 4.14Å; L699-N747 PolarHBondContact O-ND2 3.32Å; S702-N747 PolarHBondContact OG-ND2 3.38Å; L703-N747 WeakPolarHBondContact CD2-ND2 3.35Å; G743-N747 WeakPolarHBondContact O-CB 3.4Å; G743-N747 VanDerWaalsContact O-CG 3.29Å; G743-N747 PolarHBondContact O-N 3.32Å; G743-N747 PolarHBondContact O-OD1 3.32Å; I744-N747 PolarHBondContact O-N 2.84Å; N747-A751 VanDerWaalsContact O-CB 3.27Å; N747-A751 WeakPolarHBondContact O-CB 3.41Å; N747-A751 PolarHBondContact O-N 2.84Å
748	L	94.6	Very high	92	Very high	4 Å²	4	17.5 Å²	17.5	2%	0.021	9%	0.088	C	C	.	.	H	α-helix	trans	-65.8	-44.4	174.5	178.7	61.8	0	0	0	111.7	L699 I744 G746 A751 I752 F858 L861 V862 F865	L699-L748 HydrophobicContact CD1-CB 4.43Å; L699-L748 HydrophobicContact CD1-CD1 4.07Å; I744-L748 VanDerWaalsContact O-CB 3.24Å; I744-L748 WeakPolarHBondContact O-CB 3.32Å; I744-L748 PolarHBondContact O-N 3.43Å; G746-L748 VanDerWaalsContact C-N 3.3Å; G746-L748 PolarHBondContact O-N 2.99Å; L748-A751 PolarHBondContact O-N 2.85Å; L748-I752 HydrophobicContact CG-CD1 4.48Å; L748-I752 WeakPolarHBondContact O-CD1 3.48Å; L748-I752 WeakPolarHBondContact O-CG1 3.4Å; L748-I752 PolarHBondContact O-N 3.1Å; L748-F858 HydrophobicContact CD2-CD2 4.44Å; L748-F858 HydrophobicContact CD2-CE2 4.07Å; L748-L861 HydrophobicContact CD2-CB 3.68Å; L748-L861 HydrophobicContact CG-CB 4.11Å; L748-V862 HydrophobicContact CD2-CG2 3.68Å; L748-F865 HydrophobicContact CD1-CB 3.92Å; L748-F865 HydrophobicContact CD1-CD2 4.09Å; L748-F865 HydrophobicContact CD1-CG 3.95Å
749	A	92.9	Very high	91.7	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62.9	-46.3	174.9	0	0	0	0	0	111.9	T745 G746 A751 I752 F753 C817 L861	T745-A749 PolarHBondContact O-N 2.78Å; T745-A749 VanDerWaalsContact O-N 3.13Å; G746-A749 PolarHBondContact O-N 2.82Å; A749-A751 VanDerWaalsContact C-N 3.26Å; A749-A751 PolarHBondContact O-N 2.99Å; A749-I752 WeakPolarHBondContact O-CB 3.47Å; A749-I752 PolarHBondContact O-N 3.15Å; A749-F753 HydrophobicContact CB-CE2 4.5Å; A749-F753 WeakPolarHBondContact O-CD2 3.41Å; A749-F753 PolarHBondContact O-N 3.18Å; A749-F753 VanDerWaalsContact O-N 3.08Å; A749-C817 HydrophobicContact CB-CB 3.53Å; A749-C817 WeakPolarHBondContact CB-SG 3.5Å; A749-L861 HydrophobicContact CB-CD1 4.49Å; A749-L861 HydrophobicContact CB-CD2 4.4Å
750	S	90.9	Very high	91.4	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-54.6	-41.8	172.3	170.9	0	0	0	0	112.3	K513 G746 I752 F753 L754 E759 D811	K513-S750 WeakPolarHBondContact CD-OG 3.04Å; K513-S750 WeakPolarHBondContact CE-OG 3.37Å; K513-S750 PolarHBondContact NZ-OG 3.17Å; G746-S750 PolarHBondContact O-N 3.08Å; S750-I752 PolarHBondContact O-N 3.18Å; S750-F753 PolarHBondContact O-N 3.44Å; S750-L754 CarbonylContact O-C 3.53Å; S750-L754 WeakPolarHBondContact O-CA 3Å; S750-L754 PolarHBondContact O-N 3.34Å; S750-E759 PolarHBondContact OG-OE1 2.94Å; S750-E759 VanDerWaalsContact OG-OE1 3.13Å; S750-E759 PolarHBondContact OG-OE2 2.76Å; S750-D811 WeakPolarHBondContact CB-OD2 3.32Å; S750-D811 PolarHBondContact OG-OD2 3.22Å
751	A	90.5	Very high	91.2	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.008	9%	0.091	C	C	.	.	H	α-helix	trans	-68.3	-18	178.9	0	0	0	0	0	114.1	K513 S515 M518 L699 N747 L748 A749 F865	K513-A751 HydrophobicContact CG-CB 4.26Å; S515-A751 VanDerWaalsContact OG-CA 3.31Å; S515-A751 WeakPolarHBondContact OG-CA 3.38Å; S515-A751 WeakPolarHBondContact OG-CB 3.4Å; S515-A751 PolarHBondContact OG-O 2.66Å; M518-A751 HydrophobicContact CE-CB 3.68Å; L699-A751 HydrophobicContact CD2-CB 4.32Å; N747-A751 VanDerWaalsContact O-CB 3.27Å; N747-A751 WeakPolarHBondContact O-CB 3.41Å; N747-A751 PolarHBondContact O-N 2.84Å; L748-A751 PolarHBondContact O-N 2.85Å; A749-A751 VanDerWaalsContact C-N 3.26Å; A749-A751 PolarHBondContact O-N 2.99Å; A751-F865 HydrophobicContact CB-CD2 4.21Å; A751-F865 HydrophobicContact CB-CE2 3.77Å
752	I	89.6	Confident	91.1	Very high	14 Å²	14	15.2 Å²	15.2	7%	0.072	8%	0.077	C	C	.	.	H	α-helix	trans	-85.5	-49.7	173	-63.4	156.6	0	0	0	110.6	L748 A749 S750 L861 L864 F865	L748-I752 HydrophobicContact CG-CD1 4.48Å; L748-I752 WeakPolarHBondContact O-CD1 3.48Å; L748-I752 WeakPolarHBondContact O-CG1 3.4Å; L748-I752 PolarHBondContact O-N 3.1Å; A749-I752 WeakPolarHBondContact O-CB 3.47Å; A749-I752 PolarHBondContact O-N 3.15Å; S750-I752 PolarHBondContact O-N 3.18Å; I752-L861 HydrophobicContact CD1-CB 4.3Å; I752-L861 HydrophobicContact CD1-CD2 3.91Å; I752-L861 WeakPolarHBondContact CD1-O 3.21Å; I752-L864 HydrophobicContact CD1-CB 4.27Å; I752-L864 HydrophobicContact CD1-CD2 4.18Å; I752-L864 HydrophobicContact CD1-CG 4.38Å; I752-L864 HydrophobicContact CG2-CD2 4Å; I752-L864 HydrophobicContact CG2-CG 4.14Å; I752-F865 HydrophobicContact CD1-CB 4.14Å; I752-F865 HydrophobicContact CG1-CB 3.89Å; I752-F865 HydrophobicContact CG1-CD2 3.91Å; I752-F865 HydrophobicContact CG1-CG 4.42Å
753	F	86.8	Confident	90.9	Very high	50 Å²	50	16.2 Å²	16.2	22%	0.219	9%	0.085	C	C	.	.	H	α-helix	trans	-85.7	-26	-172	-61.9	-66.2	0	0	0	114.4	A749 S750 F813 I870	A749-F753 HydrophobicContact CB-CE2 4.5Å; A749-F753 WeakPolarHBondContact O-CD2 3.41Å; A749-F753 PolarHBondContact O-N 3.18Å; A749-F753 VanDerWaalsContact O-N 3.08Å; S750-F753 PolarHBondContact O-N 3.44Å; F753-F813 HydrophobicContact CB-CD1 3.87Å; F753-F813 HydrophobicContact CB-CD2 3.85Å; F753-F813 HydrophobicContact CB-CE1 3.99Å; F753-F813 HydrophobicContact CB-CE2 3.97Å; F753-F813 HydrophobicContact CB-CG 3.81Å; F753-F813 HydrophobicContact CB-CZ 4.05Å; F753-F813 HydrophobicContact CD1-CD1 4.48Å; F753-F813 HydrophobicContact CD1-CE1 4.19Å; F753-F813 HydrophobicContact CD2-CB 4.19Å; F753-F813 AromaticContact CD2-CD1 3.28Å; F753-F813 HydrophobicContact CD2-CD1 3.28Å; F753-F813 AromaticContact CD2-CE1 3.79Å; F753-F813 HydrophobicContact CD2-CE1 3.79Å; F753-F813 AromaticContact CD2-CG 3.8Å; F753-F813 HydrophobicContact CD2-CG 3.8Å; F753-F813 AromaticContact CE2-CD1 3.92Å; F753-F813 HydrophobicContact CE2-CD1 3.92Å; F753-F813 HydrophobicContact CE2-CE1 4.33Å; F753-F813 AromaticContact CG-CD1 3.63Å; F753-F813 HydrophobicContact CG-CD1 3.63Å; F753-F813 AromaticContact CG-CE1 3.72Å; F753-F813 HydrophobicContact CG-CE1 3.72Å; F753-F813 HydrophobicContact CG-CG 4.06Å; F753-F813 HydrophobicContact CG-CZ 4.23Å; F753-I870 HydrophobicContact CE1-CD1 4.17Å
754	L	84.6	Confident	90.7	Very high	11 Å²	11	16.2 Å²	16.2	6%	0.058	9%	0.085	C	C	.	.			trans	-130.2	68.7	-179.2	-63.3	176.6	0	0	0	110.8	K513 S750 Y756 R757 D811 F813 T879	K513-L754 PolarHBondContact NZ-O 3.16Å; S750-L754 CarbonylContact O-C 3.53Å; S750-L754 WeakPolarHBondContact O-CA 3Å; S750-L754 PolarHBondContact O-N 3.34Å; L754-Y756 VanDerWaalsContact C-N 3.33Å; L754-Y756 PolarHBondContact O-N 2.84Å; L754-R757 HydrophobicContact CB-CB 4.38Å; L754-R757 PolarHBondContact O-N 3.05Å; L754-D811 HydrophobicContact CD1-CB 4.33Å; L754-D811 WeakPolarHBondContact CD1-OD1 3.23Å; L754-F813 HydrophobicContact CD1-CD2 4.14Å; L754-F813 HydrophobicContact CG-CD2 4.17Å; L754-T879 HydrophobicContact CD1-CG2 4Å
755	P	84.8	Confident	90.7	Very high	30 Å²	30	14.8 Å²	14.8	20%	0.195	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-33.1	-170.6	24	-34.2	0	0	0	114.4	S515 P516	S515-P755 WeakPolarHBondContact CB-O 3.36Å; S515-P755 PolarHBondContact N-O 3.23Å; S515-P755 VanDerWaalsContact N-O 3.17Å; P516-P755 WeakPolarHBondContact CD-O 3.37Å
756	Y	83.3	Confident	90.6	Very high	43 Å²	43	15.8 Å²	15.8	17%	0.169	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-1.5	-174	-52.7	-51.1	0	0	0	115	Y514 P516 D521 Q523 L754 L893	Y514-Y756 WeakPolarHBondContact CE2-O 3.34Å; P516-Y756 HydrophobicContact CG-CD1 4.14Å; P516-Y756 HydrophobicContact CG-CE1 4.14Å; D521-Y756 PolarHBondContact OD1-OH 2.96Å; D521-Y756 VanDerWaalsContact OD1-OH 3.05Å; Q523-Y756 PolarHBondContact OE1-OH 3.22Å; L754-Y756 VanDerWaalsContact C-N 3.33Å; L754-Y756 PolarHBondContact O-N 2.84Å; Y756-L893 HydrophobicContact CD2-CD1 4.37Å; Y756-L893 HydrophobicContact CE2-CD2 4.31Å
757	R	82.8	Confident	90.6	Very high	47 Å²	47	16.6 Å²	16.6	18%	0.177	9%	0.086	C	C	.	.			trans	-91	117.9	174.2	-69.3	-166.3	171.8	-170.1	-3.2	110.1	K513 L754 E759 Y891	K513-R757 PolarHBondContact NZ-O 3Å; L754-R757 HydrophobicContact CB-CB 4.38Å; L754-R757 PolarHBondContact O-N 3.05Å; R757-E759 PolarHBondContact O-N 3.1Å; R757-Y891 HydrophobicContact CG-CD2 3.99Å; R757-Y891 HydrophobicContact CG-CE2 3.76Å
758	A	87.4	Confident	90.7	Very high	20 Å²	20	16.1 Å²	16.1	17%	0.165	8%	0.083	C	C	.	.			trans	-73.8	116.9	174.4	0	0	0	0	0	109.9	I508 K513 Y514	I508-A758 HydrophobicContact CD1-CB 3.93Å; I508-A758 HydrophobicContact CG1-CB 3.56Å; K513-A758 WeakPolarHBondContact O-CA 3.23Å; Y514-A758 HydrophobicContact CD2-CB 4.2Å
759	E	88.6	Confident	90.7	Very high	37 Å²	37	15.9 Å²	15.9	17%	0.173	8%	0.082	C	C	.	.	B	Isolated β-bridge	trans	-126.7	146	-174.9	-69.5	160.5	-133.2	0	0	112.7	K513 S750 R757 D811	K513-E759 HydrophobicContact CD-CB 3.78Å; K513-E759 HydrophobicContact CD-CG 4.32Å; K513-E759 PolarHBondContact N-O 2.86Å; K513-E759 VanDerWaalsContact NZ-CD 3.29Å; K513-E759 IonicContact NZ-OE1 2.96Å; K513-E759 PolarHBondContact NZ-OE1 2.81Å; K513-E759 IonicContact NZ-OE2 3.79Å; K513-E759 PolarHBondContact O-N 3.04Å; S750-E759 PolarHBondContact OG-OE1 2.94Å; S750-E759 VanDerWaalsContact OG-OE1 3.13Å; S750-E759 PolarHBondContact OG-OE2 2.76Å; R757-E759 PolarHBondContact O-N 3.1Å; E759-D811 VanDerWaalsContact OE2-CB 3.3Å; E759-D811 WeakPolarHBondContact OE2-CB 3.26Å
760	V	92.3	Very high	90.8	Very high	19 Å²	19	16.1 Å²	16.1	12%	0.115	8%	0.084	C	C	.	.			trans	-147.8	146.6	-176.1	-72.3	0	0	0	0	109.7	L507 A512 L705 A707 H711	L507-V760 HydrophobicContact CB-CG1 4.47Å; L507-V760 HydrophobicContact CD1-CG2 4.12Å; L507-V760 HydrophobicContact CD2-CG1 4.42Å; L507-V760 HydrophobicContact CD2-CG2 4.32Å; A512-V760 HydrophobicContact CB-CG1 3.42Å; A512-V760 VanDerWaalsContact CB-CG1 3.42Å; L705-V760 HydrophobicContact CB-CB 3.78Å; L705-V760 HydrophobicContact CB-CG1 3.56Å; L705-V760 HydrophobicContact CD1-CG1 3.88Å; L705-V760 HydrophobicContact CG-CG1 4.37Å; A707-V760 HydrophobicContact CB-CG2 3.84Å; A707-V760 VanDerWaalsContact N-CG2 3.28Å; H711-V760 PolarHBondContact CE1-O 3.06Å; H711-V760 VanDerWaalsContact CE1-O 3.26Å
761	G	92.3	Very high	91	Very high	3 Å²	3	16.1 Å²	16.1	3%	0.031	8%	0.084	C	C	.	.	S	Bend	trans	122.5	151.9	177.1	0	0	0	0	0	112.3	S702 L705 A763	S702-G761 PolarHBondContact O-N 3.15Å; L705-G761 WeakPolarHBondContact O-CA 3.36Å; L705-G761 PolarHBondContact O-N 2.84Å; G761-A763 PolarHBondContact O-N 3.18Å
762	P	94.3	Very high	91.2	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.083	C	C	.	.	S	Bend	trans	-79	33.2	175.6	32.2	-33.2	0	0	0	111.9	L703 H706 Y739 S765 Q766	L703-P762 WeakPolarHBondContact O-CB 3.36Å; L703-P762 VanDerWaalsContact O-CD 3.29Å; L703-P762 WeakPolarHBondContact O-CD 3.5Å; H706-P762 WeakPolarHBondContact CE1-CD 3.46Å; H706-P762 VanDerWaalsContact NE2-CD 3.29Å; H706-P762 WeakPolarHBondContact NE2-CD 3.47Å; Y739-P762 HydrophobicContact CE1-CB 4.19Å; Y739-P762 WeakPolarHBondContact OH-CB 3.47Å; Y739-P762 WeakPolarHBondContact OH-CG 3.37Å; P762-S765 CarbonylContact O-C 3.58Å; P762-S765 WeakPolarHBondContact O-CA 3.47Å; P762-S765 VanDerWaalsContact O-CB 3.32Å; P762-S765 WeakPolarHBondContact O-CB 3.34Å; P762-S765 PolarHBondContact O-N 2.88Å; P762-S765 VanDerWaalsContact O-N 3.13Å; P762-Q766 WeakPolarHBondContact O-CG 3.43Å; P762-Q766 PolarHBondContact O-N 2.83Å
763	A	92.3	Very high	91.3	Very high	22 Å²	22	15.5 Å²	15.5	18%	0.182	8%	0.08	C	C	.	.	H	α-helix	trans	-63.6	-46.8	-170.2	0	0	0	0	0	111.6	G761 S765 Q766 F767	G761-A763 PolarHBondContact O-N 3.18Å; A763-S765 VanDerWaalsContact C-N 3.31Å; A763-S765 PolarHBondContact O-N 2.72Å; A763-Q766 WeakPolarHBondContact O-CB 3.45Å; A763-Q766 PolarHBondContact O-N 3.4Å; A763-Q766 VanDerWaalsContact O-N 3.07Å; A763-F767 WeakPolarHBondContact O-CD2 3.4Å; A763-F767 PolarHBondContact O-N 3.04Å
764	G	93.6	Very high	91.5	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-57.3	-39.9	170.9	0	0	0	0	0	113.3	Q766 F767 G768 A814 G818	G764-Q766 PolarHBondContact O-N 3.19Å; G764-F767 PolarHBondContact O-N 3.24Å; G764-G768 PolarHBondContact O-N 2.94Å; G764-A814 WeakPolarHBondContact CA-O 3.22Å; G764-G818 WeakPolarHBondContact O-CA 3.43Å
765	S	95.8	Very high	91.9	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-63.9	-38.1	173.9	-56.2	0	0	0	0	112.7	Y739 G743 P762 A763 G768 I769	Y739-S765 WeakPolarHBondContact O-CB 3.5Å; Y739-S765 PolarHBondContact O-OG 2.94Å; G743-S765 WeakPolarHBondContact CA-OG 3.18Å; G743-S765 PolarHBondContact N-OG 3.2Å; P762-S765 CarbonylContact O-C 3.58Å; P762-S765 WeakPolarHBondContact O-CA 3.47Å; P762-S765 VanDerWaalsContact O-CB 3.32Å; P762-S765 WeakPolarHBondContact O-CB 3.34Å; P762-S765 PolarHBondContact O-N 2.88Å; P762-S765 VanDerWaalsContact O-N 3.13Å; A763-S765 VanDerWaalsContact C-N 3.31Å; A763-S765 PolarHBondContact O-N 2.72Å; S765-G768 PolarHBondContact O-N 2.76Å; S765-I769 WeakPolarHBondContact O-CB 3.41Å; S765-I769 VanDerWaalsContact O-CG1 3.24Å; S765-I769 WeakPolarHBondContact O-CG1 3.34Å; S765-I769 PolarHBondContact O-N 3.27Å
766	Q	95.6	Very high	92	Very high	21 Å²	21	11.8 Å²	11.8	10%	0.098	6%	0.061	C	C	.	.	H	α-helix	trans	-65.6	-42.7	177.2	-69.4	178.5	53.7	0	0	111	S715 F718 P762 A763 G764 I769 L770	S715-Q766 PolarHBondContact OG-NE2 2.86Å; F718-Q766 HydrophobicContact CD1-CB 4Å; F718-Q766 HydrophobicContact CD1-CG 3.6Å; F718-Q766 HydrophobicContact CE1-CB 3.76Å; F718-Q766 HydrophobicContact CE1-CG 3.8Å; F718-Q766 HydrophobicContact CE2-CB 4.37Å; F718-Q766 HydrophobicContact CG-CB 4.43Å; F718-Q766 HydrophobicContact CG-CG 4.14Å; F718-Q766 HydrophobicContact CZ-CB 3.96Å; F718-Q766 HydrophobicContact CZ-CG 4.46Å; F718-Q766 VanDerWaalsContact CZ-O 3.28Å; F718-Q766 WeakPolarHBondContact CZ-O 3.31Å; P762-Q766 WeakPolarHBondContact O-CG 3.43Å; P762-Q766 PolarHBondContact O-N 2.83Å; A763-Q766 WeakPolarHBondContact O-CB 3.45Å; A763-Q766 PolarHBondContact O-N 3.4Å; A763-Q766 VanDerWaalsContact O-N 3.07Å; G764-Q766 PolarHBondContact O-N 3.19Å; Q766-I769 CarbonylContact O-C 3.25Å; Q766-I769 PolarHBondContact O-N 3.45Å; Q766-L770 WeakPolarHBondContact O-CB 3.43Å; Q766-L770 PolarHBondContact O-N 2.88Å
767	F	95.1	Very high	92.3	Very high	16 Å²	16	9.8 Å²	9.8	7%	0.07	5%	0.053	C	C	.	.	H	α-helix	trans	-67.3	-34.4	173.9	-84.6	-101.4	0	0	0	112.6	A763 G764 I769 L770 A771 L801 F802 H815 F819	A763-F767 WeakPolarHBondContact O-CD2 3.4Å; A763-F767 PolarHBondContact O-N 3.04Å; G764-F767 PolarHBondContact O-N 3.24Å; F767-I769 VanDerWaalsContact C-N 3.34Å; F767-I769 PolarHBondContact O-N 3.15Å; F767-L770 HydrophobicContact CD1-CD2 4.32Å; F767-L770 HydrophobicContact CE1-CD2 4.47Å; F767-L770 WeakPolarHBondContact O-CB 3.49Å; F767-L770 PolarHBondContact O-N 3.25Å; F767-A771 PolarHBondContact O-N 2.8Å; F767-L801 HydrophobicContact CE1-CB 4.25Å; F767-L801 HydrophobicContact CZ-CB 3.87Å; F767-F802 AromaticContact CD1-CE1 3.96Å; F767-F802 HydrophobicContact CD1-CE1 3.96Å; F767-F802 HydrophobicContact CD1-CE2 4.15Å; F767-F802 AromaticContact CD1-CZ 3.65Å; F767-F802 HydrophobicContact CD1-CZ 3.65Å; F767-F802 AromaticContact CE1-CD1 3.99Å; F767-F802 HydrophobicContact CE1-CD1 3.99Å; F767-F802 HydrophobicContact CE1-CD2 4.2Å; F767-F802 AromaticContact CE1-CE1 3.69Å; F767-F802 HydrophobicContact CE1-CE1 3.69Å; F767-F802 AromaticContact CE1-CE2 3.93Å; F767-F802 HydrophobicContact CE1-CE2 3.93Å; F767-F802 HydrophobicContact CE1-CG 4.23Å; F767-F802 AromaticContact CE1-CZ 3.66Å; F767-F802 HydrophobicContact CE1-CZ 3.66Å; F767-H815 WeakPolarHBondContact CB-O 3.28Å; F767-H815 HydrophobicContact CD1-CB 3.93Å; F767-H815 HydrophobicContact CD2-CB 3.93Å; F767-H815 AromaticContact CD2-CD2 3.29Å; F767-H815 WeakPolarHBondContact CD2-CD2 3.42Å; F767-H815 AromaticContact CD2-CG 3.63Å; F767-H815 AromaticContact CD2-NE2 3.76Å; F767-H815 HydrophobicContact CE1-CB 4.01Å; F767-H815 HydrophobicContact CE2-CB 4.01Å; F767-H815 AromaticContact CE2-CD2 3.3Å; F767-H815 WeakPolarHBondContact CE2-CD2 3.32Å; F767-H815 AromaticContact CE2-CE1 3.53Å; F767-H815 AromaticContact CE2-CG 3.43Å; F767-H815 VanDerWaalsContact CE2-CG 3.43Å; F767-H815 AromaticContact CE2-ND1 3.6Å; F767-H815 AromaticContact CE2-NE2 3.35Å; F767-H815 VanDerWaalsContact CE2-NE2 3.35Å; F767-H815 WeakPolarHBondContact CE2-NE2 3.45Å; F767-H815 HydrophobicContact CG-CB 3.88Å; F767-H815 HydrophobicContact CZ-CB 4.04Å; F767-H815 AromaticContact CZ-CE1 3.96Å; F767-H815 AromaticContact CZ-CG 3.74Å; F767-H815 AromaticContact CZ-ND1 3.69Å; F767-F819 HydrophobicContact CB-CB 4.26Å; F767-F819 WeakPolarHBondContact O-CD2 3.42Å
768	G	95.9	Very high	92.6	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-64.4	-36	170.7	0	0	0	0	0	113.7	G764 S765 A771 C772 G818	G764-G768 PolarHBondContact O-N 2.94Å; S765-G768 PolarHBondContact O-N 2.76Å; G768-A771 WeakPolarHBondContact O-CB 3.49Å; G768-A771 PolarHBondContact O-N 3.05Å; G768-C772 PolarHBondContact O-N 3.17Å; G768-C772 VanDerWaalsContact O-N 3.12Å; G768-G818 WeakPolarHBondContact CA-O 3.4Å; G768-G818 PolarHBondContact N-O 3.37Å
769	I	95.9	Very high	92.5	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-74.8	-25.8	172.8	-67.7	-68.6	0	0	0	112.1	F718 I722 L723 L726 I735 I738 Y739 S765 Q766 F767 C772	F718-I769 HydrophobicContact CE1-CB 4.28Å; F718-I769 HydrophobicContact CE1-CG2 3.95Å; F718-I769 HydrophobicContact CZ-CB 4.46Å; F718-I769 HydrophobicContact CZ-CG2 4.18Å; I722-I769 HydrophobicContact CG2-CG2 3.93Å; L723-I769 HydrophobicContact CD1-CD1 3.65Å; L723-I769 HydrophobicContact CD1-CG1 3.8Å; L723-I769 HydrophobicContact CD1-CG2 4.07Å; L726-I769 HydrophobicContact CD1-CG2 3.74Å; I735-I769 HydrophobicContact CG2-CD1 4.1Å; I738-I769 HydrophobicContact CG2-CD1 4.11Å; Y739-I769 HydrophobicContact CD2-CG1 3.96Å; S765-I769 WeakPolarHBondContact O-CB 3.41Å; S765-I769 VanDerWaalsContact O-CG1 3.24Å; S765-I769 WeakPolarHBondContact O-CG1 3.34Å; S765-I769 PolarHBondContact O-N 3.27Å; Q766-I769 CarbonylContact O-C 3.25Å; Q766-I769 PolarHBondContact O-N 3.45Å; F767-I769 VanDerWaalsContact C-N 3.34Å; F767-I769 PolarHBondContact O-N 3.15Å; I769-C772 VanDerWaalsContact O-CB 3.29Å; I769-C772 WeakPolarHBondContact O-CB 3.41Å; I769-C772 PolarHBondContact O-N 3.35Å
770	L	94.4	Very high	92.2	Very high	5 Å²	5	10.8 Å²	10.8	3%	0.026	6%	0.055	C	C	.	.	H	α-helix	trans	-70.7	-38.2	169.4	-176.1	55.6	0	0	0	111.2	Q766 F767 C772 L773 L794 V798 L801 F819	Q766-L770 WeakPolarHBondContact O-CB 3.43Å; Q766-L770 PolarHBondContact O-N 2.88Å; F767-L770 HydrophobicContact CD1-CD2 4.32Å; F767-L770 HydrophobicContact CE1-CD2 4.47Å; F767-L770 WeakPolarHBondContact O-CB 3.49Å; F767-L770 PolarHBondContact O-N 3.25Å; L770-C772 VanDerWaalsContact C-N 3.3Å; L770-C772 PolarHBondContact O-N 2.03Å; L770-L773 HydrophobicContact CD1-CD1 3.99Å; L770-L773 WeakPolarHBondContact O-CB 3.29Å; L770-L773 PolarHBondContact O-N 2.74Å; L770-L773 VanDerWaalsContact O-N 3.14Å; L770-L794 HydrophobicContact CD1-CD1 4.23Å; L770-V798 HydrophobicContact CD1-CG2 3.94Å; L770-V798 HydrophobicContact CD2-CB 4.39Å; L770-V798 HydrophobicContact CD2-CG1 4.43Å; L770-V798 HydrophobicContact CD2-CG2 3.6Å; L770-V798 HydrophobicContact CG-CG2 3.72Å; L770-L801 HydrophobicContact CD2-CD1 3.78Å; L770-F819 HydrophobicContact CG-CE2 4.49Å
771	A	95.2	Very high	91.9	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-62	-35.8	170.4	0	0	0	0	0	112.5	F767 G768 L773 F774 V775 F819 F823	F767-A771 PolarHBondContact O-N 2.8Å; G768-A771 WeakPolarHBondContact O-CB 3.49Å; G768-A771 PolarHBondContact O-N 3.05Å; A771-L773 PolarHBondContact O-N 3.27Å; A771-F774 WeakPolarHBondContact O-CB 3.43Å; A771-F774 PolarHBondContact O-N 3.46Å; A771-V775 PolarHBondContact O-N 3.27Å; A771-V775 VanDerWaalsContact O-N 3.17Å; A771-F819 HydrophobicContact CB-CD1 4.27Å; A771-F819 HydrophobicContact CB-CD2 3.72Å; A771-F819 HydrophobicContact CB-CE1 4.3Å; A771-F819 HydrophobicContact CB-CE2 3.76Å; A771-F819 HydrophobicContact CB-CG 3.98Å; A771-F819 HydrophobicContact CB-CZ 4.06Å; A771-F819 WeakPolarHBondContact CB-O 3.24Å; A771-F823 HydrophobicContact CB-CB 4.01Å
772	C	93.8	Very high	91.4	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-56.7	-32	172.9	-173.5	0	0	0	0	113.1	L726 G768 I769 L770 V775 E776 S826	L726-C772 HydrophobicContact CD1-CB 4.12Å; G768-C772 PolarHBondContact O-N 3.17Å; G768-C772 VanDerWaalsContact O-N 3.12Å; I769-C772 VanDerWaalsContact O-CB 3.29Å; I769-C772 WeakPolarHBondContact O-CB 3.41Å; I769-C772 PolarHBondContact O-N 3.35Å; L770-C772 VanDerWaalsContact C-N 3.3Å; L770-C772 PolarHBondContact O-N 2.03Å; C772-V775 PolarHBondContact O-N 3.41Å; C772-E776 PolarHBondContact O-N 2.7Å; C772-S826 VanDerWaalsContact CA-OG 3.24Å; C772-S826 WeakPolarHBondContact CA-OG 3.26Å; C772-S826 VanDerWaalsContact CB-OG 3.28Å; C772-S826 WeakPolarHBondContact CB-OG 3.46Å
773	L	91.5	Very high	90.8	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-72.1	-25.7	175.2	-65.4	168.1	0	0	0	113.4	V415 I722 L726 L770 A771 L777 L794	V415-L773 HydrophobicContact CG2-CD1 3.88Å; V415-L773 HydrophobicContact CG2-CD2 4.41Å; I722-L773 HydrophobicContact CD1-CD1 4.47Å; I722-L773 HydrophobicContact CG2-CD1 3.83Å; I722-L773 HydrophobicContact CG2-CG 4.42Å; L726-L773 HydrophobicContact CD1-CD2 3.96Å; L726-L773 HydrophobicContact CD1-CG 4.12Å; L726-L773 HydrophobicContact CD2-CD2 4.1Å; L726-L773 HydrophobicContact CG-CD2 4.14Å; L770-L773 HydrophobicContact CD1-CD1 3.99Å; L770-L773 WeakPolarHBondContact O-CB 3.29Å; L770-L773 PolarHBondContact O-N 2.74Å; L770-L773 VanDerWaalsContact O-N 3.14Å; A771-L773 PolarHBondContact O-N 3.27Å; L773-L777 WeakPolarHBondContact O-CB 3.4Å; L773-L777 PolarHBondContact O-N 3.08Å; L773-L777 VanDerWaalsContact O-N 3.14Å; L773-L794 HydrophobicContact CB-CD2 4.09Å
774	F	92.1	Very high	90.3	Very high	9 Å²	9	20.7 Å²	20.7	4%	0.039	9%	0.093	C	C	.	.	H	α-helix	trans	-72.7	-42.5	169.6	-75.8	-92	0	0	0	111.1	A771 L777 F778 F791 L794 V798 F819	A771-F774 WeakPolarHBondContact O-CB 3.43Å; A771-F774 PolarHBondContact O-N 3.46Å; F774-L777 CarbonylContact O-C 3.58Å; F774-L777 WeakPolarHBondContact O-CA 2.99Å; F774-L777 WeakPolarHBondContact O-CB 3.45Å; F774-L777 PolarHBondContact O-N 2.85Å; F774-L777 VanDerWaalsContact O-N 3.11Å; F774-F778 HydrophobicContact CB-CD2 4.3Å; F774-F778 HydrophobicContact CB-CE2 4.05Å; F774-F778 HydrophobicContact CD1-CE2 4.43Å; F774-F778 WeakPolarHBondContact O-CD2 3.36Å; F774-F778 WeakPolarHBondContact O-CG 3.38Å; F774-F778 PolarHBondContact O-N 3.15Å; F774-F791 AromaticContact CD1-CD2 3.98Å; F774-F791 HydrophobicContact CD1-CD2 3.98Å; F774-F791 AromaticContact CD1-CE2 3.77Å; F774-F791 HydrophobicContact CD1-CE2 3.77Å; F774-F791 AromaticContact CE1-CD2 3.96Å; F774-F791 HydrophobicContact CE1-CD2 3.96Å; F774-F791 AromaticContact CE1-CE2 3.68Å; F774-F791 HydrophobicContact CE1-CE2 3.68Å; F774-L794 HydrophobicContact CD1-CD2 3.87Å; F774-L794 HydrophobicContact CD1-CG 4.5Å; F774-L794 HydrophobicContact CD2-CD2 3.69Å; F774-L794 HydrophobicContact CD2-CG 4.19Å; F774-L794 HydrophobicContact CE1-CB 4.35Å; F774-L794 HydrophobicContact CE1-CD2 3.93Å; F774-L794 HydrophobicContact CE1-CG 4.06Å; F774-L794 HydrophobicContact CE2-CD2 3.76Å; F774-L794 HydrophobicContact CE2-CG 3.73Å; F774-L794 HydrophobicContact CG-CD2 3.76Å; F774-L794 HydrophobicContact CZ-CB 4.24Å; F774-L794 HydrophobicContact CZ-CD2 3.89Å; F774-L794 HydrophobicContact CZ-CG 3.66Å; F774-V798 HydrophobicContact CE2-CB 4.48Å; F774-V798 HydrophobicContact CE2-CG2 3.52Å; F774-V798 HydrophobicContact CZ-CB 4.46Å; F774-V798 HydrophobicContact CZ-CG2 3.8Å; F774-F819 AromaticContact CD2-CE2 3.86Å; F774-F819 HydrophobicContact CD2-CE2 3.86Å; F774-F819 AromaticContact CD2-CZ 3.65Å; F774-F819 HydrophobicContact CD2-CZ 3.65Å; F774-F819 AromaticContact CE2-CE2 3.71Å; F774-F819 HydrophobicContact CE2-CE2 3.71Å; F774-F819 AromaticContact CE2-CZ 3.61Å; F774-F819 HydrophobicContact CE2-CZ 3.61Å; F774-F819 HydrophobicContact CG-CZ 4.43Å; F774-F819 HydrophobicContact CZ-CZ 4.38Å
775	V	91.8	Very high	89.8	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-66.5	-39.4	177.7	-174.9	0	0	0	0	111.1	A771 C772 L777 F778 Q779 F823 F827 L830	A771-V775 PolarHBondContact O-N 3.27Å; A771-V775 VanDerWaalsContact O-N 3.17Å; C772-V775 PolarHBondContact O-N 3.41Å; V775-L777 VanDerWaalsContact C-N 3.32Å; V775-L777 PolarHBondContact O-N 2.81Å; V775-F778 PolarHBondContact O-N 3.17Å; V775-Q779 HydrophobicContact CG1-CG 4.42Å; V775-Q779 WeakPolarHBondContact O-CB 3.33Å; V775-Q779 VanDerWaalsContact O-CG 3.29Å; V775-Q779 WeakPolarHBondContact O-CG 3.46Å; V775-Q779 PolarHBondContact O-N 3.12Å; V775-F823 HydrophobicContact CG2-CD2 3.86Å; V775-F823 HydrophobicContact CG2-CE2 4.14Å; V775-F827 HydrophobicContact CB-CE2 4.41Å; V775-F827 HydrophobicContact CB-CZ 4.47Å; V775-F827 HydrophobicContact CG1-CD1 3.76Å; V775-F827 HydrophobicContact CG1-CD2 4.13Å; V775-F827 HydrophobicContact CG1-CE1 3.74Å; V775-F827 HydrophobicContact CG1-CE2 4.1Å; V775-F827 HydrophobicContact CG1-CG 3.95Å; V775-F827 HydrophobicContact CG1-CZ 3.92Å; V775-F827 HydrophobicContact CG2-CD2 3.72Å; V775-F827 HydrophobicContact CG2-CE2 3.52Å; V775-F827 HydrophobicContact CG2-CG 4.36Å; V775-F827 HydrophobicContact CG2-CZ 4.02Å; V775-L830 HydrophobicContact CB-CD1 3.9Å; V775-L830 HydrophobicContact CG1-CD1 3.75Å
776	E	88.9	Confident	89.3	Confident	4 Å²	4	28 Å²	28	2%	0.019	14%	0.135	C	C	.	.	H	α-helix	trans	-55.1	-46.5	168.2	179.1	171.3	-151.9	0	0	111	R408 G411 L729 C772 C780	R408-E776 IonicContact CZ-OE1 3.87Å; R408-E776 IonicContact CZ-OE2 3.88Å; R408-E776 IonicContact NH1-OE1 3.86Å; R408-E776 PolarHBondContact NH1-OE1 3.07Å; R408-E776 IonicContact NH1-OE2 3.96Å; R408-E776 IonicContact NH2-OE1 2.67Å; R408-E776 PolarHBondContact NH2-OE1 3.3Å; R408-E776 IonicContact NH2-OE2 2.72Å; R408-E776 PolarHBondContact NH2-OE2 3.44Å; G411-E776 VanDerWaalsContact CA-OE1 3.27Å; G411-E776 WeakPolarHBondContact CA-OE1 2.99Å; G411-E776 PolarHBondContact N-OE1 3.28Å; L729-E776 WeakPolarHBondContact CD2-OE1 3.47Å; C772-E776 PolarHBondContact O-N 2.7Å; E776-C780 WeakPolarHBondContact O-CB 3.32Å; E776-C780 PolarHBondContact O-N 3.16Å; E776-C780 PolarHBondContact O-SG 3.23Å
777	L	88.4	Confident	88.8	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-64.4	-43.7	178.2	178.4	62.2	0	0	0	113.5	L773 F774 V775 C780 W781 L784 A790 F791	L773-L777 WeakPolarHBondContact O-CB 3.4Å; L773-L777 PolarHBondContact O-N 3.08Å; L773-L777 VanDerWaalsContact O-N 3.14Å; F774-L777 CarbonylContact O-C 3.58Å; F774-L777 WeakPolarHBondContact O-CA 2.99Å; F774-L777 WeakPolarHBondContact O-CB 3.45Å; F774-L777 PolarHBondContact O-N 2.85Å; F774-L777 VanDerWaalsContact O-N 3.11Å; V775-L777 VanDerWaalsContact C-N 3.32Å; V775-L777 PolarHBondContact O-N 2.81Å; L777-C780 CarbonylContact O-C 3.56Å; L777-C780 PolarHBondContact O-N 3.34Å; L777-W781 PolarHBondContact O-N 3.4Å; L777-W781 VanDerWaalsContact O-N 3.1Å; L777-L784 HydrophobicContact CD1-CD2 3.66Å; L777-A790 HydrophobicContact CD1-CB 3.96Å; L777-F791 VanDerWaalsContact CD2-CA 3.48Å; L777-F791 HydrophobicContact CD2-CB 3.82Å; L777-F791 HydrophobicContact CD2-CD2 4.29Å
778	F	88.6	Confident	88.5	Confident	79 Å²	79	35.2 Å²	35.2	35%	0.346	16%	0.164	S	C	.	.	H	α-helix	trans	-66.5	-38.7	178.7	-71.1	-54.1	0	0	0	111.9	F774 V775 C780 W781 F791 F823	F774-F778 HydrophobicContact CB-CD2 4.3Å; F774-F778 HydrophobicContact CB-CE2 4.05Å; F774-F778 HydrophobicContact CD1-CE2 4.43Å; F774-F778 WeakPolarHBondContact O-CD2 3.36Å; F774-F778 WeakPolarHBondContact O-CG 3.38Å; F774-F778 PolarHBondContact O-N 3.15Å; V775-F778 PolarHBondContact O-N 3.17Å; F778-C780 VanDerWaalsContact C-N 3.32Å; F778-C780 PolarHBondContact O-N 2.81Å; F778-W781 AromaticContact CD1-CE3 3.84Å; F778-W781 HydrophobicContact CD1-CE3 3.84Å; F778-W781 AromaticContact CD1-CZ3 3.99Å; F778-W781 HydrophobicContact CD1-CZ3 3.99Å; F778-W781 HydrophobicContact CE1-CE3 4.24Å; F778-W781 AromaticContact CE1-CZ3 3.9Å; F778-W781 HydrophobicContact CE1-CZ3 3.9Å; F778-W781 WeakPolarHBondContact O-CB 3.48Å; F778-W781 PolarHBondContact O-N 2.64Å; F778-F791 HydrophobicContact CE1-CD2 4.24Å; F778-F791 HydrophobicContact CE1-CE2 4.22Å; F778-F791 HydrophobicContact CZ-CD2 4.09Å; F778-F791 AromaticContact CZ-CE2 3.7Å; F778-F791 HydrophobicContact CZ-CE2 3.7Å; F778-F823 HydrophobicContact CD2-CE2 4.37Å; F778-F823 HydrophobicContact CE2-CE2 4.04Å; F778-F823 HydrophobicContact CE2-CZ 4.47Å
779	Q	85.3	Confident	88.1	Confident	46 Å²	46	42.9 Å²	42.9	22%	0.215	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-36.7	172.1	-70.1	177.8	8.6	0	0	112	Y410 V775 W781 P831 Y832	Y410-Q779 PolarHBondContact OH-OE1 2.99Å; V775-Q779 HydrophobicContact CG1-CG 4.42Å; V775-Q779 WeakPolarHBondContact O-CB 3.33Å; V775-Q779 VanDerWaalsContact O-CG 3.29Å; V775-Q779 WeakPolarHBondContact O-CG 3.46Å; V775-Q779 PolarHBondContact O-N 3.12Å; Q779-W781 VanDerWaalsContact C-N 3.32Å; Q779-W781 PolarHBondContact O-N 2.85Å; Q779-P831 PolarHBondContact OE1-O 2.94Å; Q779-Y832 HydrophobicContact CG-CD1 4.4Å; Q779-Y832 HydrophobicContact CG-CE1 4.16Å; Q779-Y832 VanDerWaalsContact NE2-CE1 3.29Å
780	C	82.1	Confident	87.7	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.007	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	0.9	179.4	-59.2	0	0	0	0	114.7	Y410 E776 L777 F778 Q782 I783 L784	Y410-C780 WeakPolarHBondContact CD1-SG 3.31Å; Y410-C780 WeakPolarHBondContact CE1-SG 3.45Å; E776-C780 WeakPolarHBondContact O-CB 3.32Å; E776-C780 PolarHBondContact O-N 3.16Å; E776-C780 PolarHBondContact O-SG 3.23Å; L777-C780 CarbonylContact O-C 3.56Å; L777-C780 PolarHBondContact O-N 3.34Å; F778-C780 VanDerWaalsContact C-N 3.32Å; F778-C780 PolarHBondContact O-N 2.81Å; C780-Q782 VanDerWaalsContact C-N 3.3Å; C780-Q782 PolarHBondContact O-N 3.34Å; C780-Q782 VanDerWaalsContact O-N 3.14Å; C780-I783 WeakPolarHBondContact O-CA 3.45Å; C780-I783 WeakPolarHBondContact O-CB 3.31Å; C780-I783 PolarHBondContact O-N 3Å; C780-L784 HydrophobicContact CB-CD1 3.49Å; C780-L784 VanDerWaalsContact CB-CD1 3.49Å; C780-L784 WeakPolarHBondContact O-CD1 3.48Å; C780-L784 PolarHBondContact O-N 3.15Å
781	W	86.1	Confident	87.5	Confident	69 Å²	69	45 Å²	45	26%	0.261	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-38.4	-164.3	-167.2	-83.3	0	0	0	114.1	L777 F778 Q779 I783 P787 W788 F791	L777-W781 PolarHBondContact O-N 3.4Å; L777-W781 VanDerWaalsContact O-N 3.1Å; F778-W781 AromaticContact CD1-CE3 3.84Å; F778-W781 HydrophobicContact CD1-CE3 3.84Å; F778-W781 AromaticContact CD1-CZ3 3.99Å; F778-W781 HydrophobicContact CD1-CZ3 3.99Å; F778-W781 HydrophobicContact CE1-CE3 4.24Å; F778-W781 AromaticContact CE1-CZ3 3.9Å; F778-W781 HydrophobicContact CE1-CZ3 3.9Å; F778-W781 WeakPolarHBondContact O-CB 3.48Å; F778-W781 PolarHBondContact O-N 2.64Å; Q779-W781 VanDerWaalsContact C-N 3.32Å; Q779-W781 PolarHBondContact O-N 2.85Å; W781-I783 VanDerWaalsContact C-N 3.33Å; W781-P787 HydrophobicContact CD2-CB 3.59Å; W781-P787 HydrophobicContact CD2-CG 4.16Å; W781-P787 HydrophobicContact CE3-CB 3.89Å; W781-P787 HydrophobicContact CG-CB 3.95Å; W781-P787 HydrophobicContact CG-CG 4.29Å; W781-P787 HydrophobicContact CH2-CB 4.43Å; W781-P787 HydrophobicContact CZ2-CB 4.15Å; W781-P787 HydrophobicContact CZ2-CG 4.35Å; W781-P787 HydrophobicContact CZ3-CB 4.31Å; W781-W788 AromaticContact CH2-CD2 3.96Å; W781-W788 HydrophobicContact CH2-CD2 3.96Å; W781-W788 HydrophobicContact CH2-CE3 4.08Å; W781-W788 HydrophobicContact CH2-CG 4.37Å; W781-W788 HydrophobicContact CH2-CZ3 4.44Å; W781-W788 AromaticContact CZ2-CD2 3.85Å; W781-W788 HydrophobicContact CZ2-CD2 3.85Å; W781-W788 AromaticContact CZ2-CE2 3.73Å; W781-W788 HydrophobicContact CZ2-CE3 4.41Å; W781-W788 HydrophobicContact CZ2-CG 4.08Å; W781-W788 HydrophobicContact CZ2-CZ2 4.2Å; W781-W788 AromaticContact CZ2-NE1 3.86Å; W781-F791 HydrophobicContact CH2-CB 4.21Å; W781-F791 HydrophobicContact CH2-CG 4.5Å; W781-F791 HydrophobicContact CZ3-CB 4.03Å; W781-F791 HydrophobicContact CZ3-CD2 4.45Å; W781-F791 HydrophobicContact CZ3-CG 4.36Å
782	Q	83.1	Confident	87.3	Confident	158 Å²	158	49.3 Å²	49.3	74%	0.738	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-15	178.2	-66.1	-179.8	-24.2	0	0	114.1	C780	C780-Q782 VanDerWaalsContact C-N 3.3Å; C780-Q782 PolarHBondContact O-N 3.34Å; C780-Q782 VanDerWaalsContact O-N 3.14Å
783	I	80.4	Confident	87.1	Confident	15 Å²	15	53.7 Å²	53.7	8%	0.077	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-28.7	-172.8	-46.8	-178.7	0	0	0	111.2	Y423 R424 I427 V431 I435 C780 W781	Y423-I783 HydrophobicContact CD1-CG2 3.82Å; Y423-I783 HydrophobicContact CE1-CG2 4.02Å; R424-I783 PolarHBondContact N-O 2.96Å; I427-I783 HydrophobicContact CD1-CG2 3.6Å; I427-I783 HydrophobicContact CG1-CG2 4.24Å; V431-I783 HydrophobicContact CG1-CD1 4.13Å; I435-I783 HydrophobicContact CD1-CD1 4.25Å; C780-I783 WeakPolarHBondContact O-CA 3.45Å; C780-I783 WeakPolarHBondContact O-CB 3.31Å; C780-I783 PolarHBondContact O-N 3Å; W781-I783 VanDerWaalsContact C-N 3.33Å
784	L	82.1	Confident	87	Confident	10 Å²	10	53.8 Å²	53.8	5%	0.052	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-72.8	148.6	176.6	-92.8	69.7	0	0	0	112.5	R421 L777 C780 P787 A790	R421-L784 HydrophobicContact CB-CD2 4.4Å; R421-L784 HydrophobicContact CG-CD2 4.12Å; L777-L784 HydrophobicContact CD1-CD2 3.66Å; C780-L784 HydrophobicContact CB-CD1 3.49Å; C780-L784 VanDerWaalsContact CB-CD1 3.49Å; C780-L784 WeakPolarHBondContact O-CD1 3.48Å; C780-L784 PolarHBondContact O-N 3.15Å; L784-P787 HydrophobicContact CB-CB 4.37Å; L784-A790 HydrophobicContact CD2-CB 3.97Å
785	A	83.7	Confident	87	Confident	47 Å²	47	56.2 Å²	56.2	39%	0.388	26%	0.258	S	S	.	.	S	Bend	trans	-74.8	-29.9	174.2	0	0	0	0	0	113.7	T422	T422-A785 PolarHBondContact O-N 3.04Å
786	Q	84.4	Confident	87.1	Confident	105 Å²	105	59.7 Å²	59.7	49%	0.491	28%	0.281	S	S	.	.			trans	-143.8	68.8	-177.6	-65.3	-168.8	-22.3	0	0	111.8	W788 R789 A790	Q786-W788 PolarHBondContact O-N 2.86Å; Q786-R789 HydrophobicContact CB-CB 4.37Å; Q786-R789 PolarHBondContact O-N 3Å; Q786-A790 PolarHBondContact O-N 3.47Å
787	P	86.2	Confident	87.1	Confident	21 Å²	21	62.7 Å²	62.7	14%	0.136	30%	0.3	C	S	.	.	H	α-helix	trans	-63.1	-42.5	-173.9	25	-34.3	0	0	0	113.4	W781 L784 R789 A790 F791	W781-P787 HydrophobicContact CD2-CB 3.59Å; W781-P787 HydrophobicContact CD2-CG 4.16Å; W781-P787 HydrophobicContact CE3-CB 3.89Å; W781-P787 HydrophobicContact CG-CB 3.95Å; W781-P787 HydrophobicContact CG-CG 4.29Å; W781-P787 HydrophobicContact CH2-CB 4.43Å; W781-P787 HydrophobicContact CZ2-CB 4.15Å; W781-P787 HydrophobicContact CZ2-CG 4.35Å; W781-P787 HydrophobicContact CZ3-CB 4.31Å; L784-P787 HydrophobicContact CB-CB 4.37Å; P787-R789 PolarHBondContact O-N 3.44Å; P787-A790 CarbonylContact O-C 3.55Å; P787-A790 WeakPolarHBondContact O-CA 3.27Å; P787-A790 WeakPolarHBondContact O-CB 3.31Å; P787-A790 PolarHBondContact O-N 3.33Å; P787-F791 PolarHBondContact O-N 2.88Å
788	W	88.9	Confident	87.3	Confident	168 Å²	168	63 Å²	63	64%	0.636	30%	0.301	S	S	*	.	H	α-helix	trans	-56.4	-44.4	178	-81.7	114	0	0	0	113.6	W781 Q786 A790 F791 I792	W781-W788 AromaticContact CH2-CD2 3.96Å; W781-W788 HydrophobicContact CH2-CD2 3.96Å; W781-W788 HydrophobicContact CH2-CE3 4.08Å; W781-W788 HydrophobicContact CH2-CG 4.37Å; W781-W788 HydrophobicContact CH2-CZ3 4.44Å; W781-W788 AromaticContact CZ2-CD2 3.85Å; W781-W788 HydrophobicContact CZ2-CD2 3.85Å; W781-W788 AromaticContact CZ2-CE2 3.73Å; W781-W788 HydrophobicContact CZ2-CE3 4.41Å; W781-W788 HydrophobicContact CZ2-CG 4.08Å; W781-W788 HydrophobicContact CZ2-CZ2 4.2Å; W781-W788 AromaticContact CZ2-NE1 3.86Å; Q786-W788 PolarHBondContact O-N 2.86Å; W788-A790 VanDerWaalsContact C-N 3.27Å; W788-A790 PolarHBondContact O-N 3.27Å; W788-F791 HydrophobicContact CE3-CD1 4.3Å; W788-F791 HydrophobicContact CZ3-CD1 4.31Å; W788-F791 PolarHBondContact O-N 3.4Å; W788-I792 WeakPolarHBondContact O-CG1 3.33Å; W788-I792 PolarHBondContact O-N 3.27Å
789	R	88.1	Confident	87.4	Confident	162 Å²	162	64 Å²	64	61%	0.611	31%	0.31	S	S	*	.	H	α-helix	trans	-66.3	-30	175.7	-73.1	173.1	171.3	-168.1	-5	112.3	Q786 P787 K793	Q786-R789 HydrophobicContact CB-CB 4.37Å; Q786-R789 PolarHBondContact O-N 3Å; P787-R789 PolarHBondContact O-N 3.44Å; R789-K793 VanDerWaalsContact O-CG 3.26Å; R789-K793 WeakPolarHBondContact O-CG 3.41Å; R789-K793 PolarHBondContact O-N 2.98Å
790	A	86.3	Confident	87.7	Confident	5 Å²	5	67.7 Å²	67.7	4%	0.041	33%	0.326	C	S	.	.	H	α-helix	trans	-77.3	-28	175.5	0	0	0	0	0	113.1	R421 L777 L784 Q786 P787 W788 L794	R421-A790 HydrophobicContact CG-CB 3.82Å; R421-A790 PolarHBondContact NH2-O 3.11Å; L777-A790 HydrophobicContact CD1-CB 3.96Å; L784-A790 HydrophobicContact CD2-CB 3.97Å; Q786-A790 PolarHBondContact O-N 3.47Å; P787-A790 CarbonylContact O-C 3.55Å; P787-A790 WeakPolarHBondContact O-CA 3.27Å; P787-A790 WeakPolarHBondContact O-CB 3.31Å; P787-A790 PolarHBondContact O-N 3.33Å; W788-A790 VanDerWaalsContact C-N 3.27Å; W788-A790 PolarHBondContact O-N 3.27Å; A790-L794 PolarHBondContact O-N 3.03Å
791	F	90.6	Very high	88	Confident	43 Å²	43	70.8 Å²	70.8	19%	0.189	34%	0.342	C	S	.	.	H	α-helix	trans	-73.4	-55.1	173.1	175.8	-100.6	0	0	0	111.1	F774 L777 F778 W781 P787 W788 K793 L794 L795	F774-F791 AromaticContact CD1-CD2 3.98Å; F774-F791 HydrophobicContact CD1-CD2 3.98Å; F774-F791 AromaticContact CD1-CE2 3.77Å; F774-F791 HydrophobicContact CD1-CE2 3.77Å; F774-F791 AromaticContact CE1-CD2 3.96Å; F774-F791 HydrophobicContact CE1-CD2 3.96Å; F774-F791 AromaticContact CE1-CE2 3.68Å; F774-F791 HydrophobicContact CE1-CE2 3.68Å; L777-F791 VanDerWaalsContact CD2-CA 3.48Å; L777-F791 HydrophobicContact CD2-CB 3.82Å; L777-F791 HydrophobicContact CD2-CD2 4.29Å; F778-F791 HydrophobicContact CE1-CD2 4.24Å; F778-F791 HydrophobicContact CE1-CE2 4.22Å; F778-F791 HydrophobicContact CZ-CD2 4.09Å; F778-F791 AromaticContact CZ-CE2 3.7Å; F778-F791 HydrophobicContact CZ-CE2 3.7Å; W781-F791 HydrophobicContact CH2-CB 4.21Å; W781-F791 HydrophobicContact CH2-CG 4.5Å; W781-F791 HydrophobicContact CZ3-CB 4.03Å; W781-F791 HydrophobicContact CZ3-CD2 4.45Å; W781-F791 HydrophobicContact CZ3-CG 4.36Å; P787-F791 PolarHBondContact O-N 2.88Å; W788-F791 HydrophobicContact CE3-CD1 4.3Å; W788-F791 HydrophobicContact CZ3-CD1 4.31Å; W788-F791 PolarHBondContact O-N 3.4Å; F791-K793 VanDerWaalsContact C-N 3.31Å; F791-K793 PolarHBondContact O-N 3.02Å; F791-L794 PolarHBondContact O-N 2.82Å; F791-L795 HydrophobicContact CE1-CD2 3.98Å; F791-L795 HydrophobicContact CZ-CD2 4.26Å; F791-L795 PolarHBondContact O-N 2.02Å
792	I	90.7	Very high	88.1	Confident	91 Å²	91	69.4 Å²	69.4	47%	0.467	34%	0.338	S	S	.	.	H	α-helix	trans	-56	-46	-179.5	-66.4	166.1	0	0	0	110.6	W788 L794 L795 C796	W788-I792 WeakPolarHBondContact O-CG1 3.33Å; W788-I792 PolarHBondContact O-N 3.27Å; I792-L794 VanDerWaalsContact C-N 3.32Å; I792-L794 PolarHBondContact O-N 3.47Å; I792-L795 PolarHBondContact O-N 3.22Å; I792-C796 PolarHBondContact O-N 3.27Å; I792-C796 PolarHBondContact O-SG 3.48Å
793	K	89.9	Confident	88.3	Confident	92 Å²	92	64.5 Å²	64.5	40%	0.4	32%	0.324	S	S	.	.	H	α-helix	trans	-59.5	-38.6	175.6	-74	179.6	-175.1	-172.7	0	113.8	T419 R789 F791 V797	T419-K793 HydrophobicContact CG2-CB 3.84Å; T419-K793 HydrophobicContact CG2-CD 4.11Å; T419-K793 PolarHBondContact O-NZ 3.36Å; R789-K793 VanDerWaalsContact O-CG 3.26Å; R789-K793 WeakPolarHBondContact O-CG 3.41Å; R789-K793 PolarHBondContact O-N 2.98Å; F791-K793 VanDerWaalsContact C-N 3.31Å; F791-K793 PolarHBondContact O-N 3.02Å; K793-V797 WeakPolarHBondContact O-CG2 3.26Å; K793-V797 PolarHBondContact O-N 3.13Å
794	L	89.4	Confident	88.5	Confident	4 Å²	4	69 Å²	69	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-71.5	-41.7	178.5	-173.8	63.6	0	0	0	110.5	V415 L770 L773 F774 A790 F791 I792 V797 V798	V415-L794 HydrophobicContact CG1-CD1 4.15Å; L770-L794 HydrophobicContact CD1-CD1 4.23Å; L773-L794 HydrophobicContact CB-CD2 4.09Å; F774-L794 HydrophobicContact CD1-CD2 3.87Å; F774-L794 HydrophobicContact CD1-CG 4.5Å; F774-L794 HydrophobicContact CD2-CD2 3.69Å; F774-L794 HydrophobicContact CD2-CG 4.19Å; F774-L794 HydrophobicContact CE1-CB 4.35Å; F774-L794 HydrophobicContact CE1-CD2 3.93Å; F774-L794 HydrophobicContact CE1-CG 4.06Å; F774-L794 HydrophobicContact CE2-CD2 3.76Å; F774-L794 HydrophobicContact CE2-CG 3.73Å; F774-L794 HydrophobicContact CG-CD2 3.76Å; F774-L794 HydrophobicContact CZ-CB 4.24Å; F774-L794 HydrophobicContact CZ-CD2 3.89Å; F774-L794 HydrophobicContact CZ-CG 3.66Å; A790-L794 PolarHBondContact O-N 3.03Å; F791-L794 PolarHBondContact O-N 2.82Å; I792-L794 VanDerWaalsContact C-N 3.32Å; I792-L794 PolarHBondContact O-N 3.47Å; L794-V797 PolarHBondContact O-N 3.23Å; L794-V798 WeakPolarHBondContact O-CG2 3.42Å; L794-V798 PolarHBondContact O-N 2.93Å
795	L	92.4	Very high	88.3	Confident	61 Å²	61	68.6 Å²	68.6	32%	0.319	34%	0.341	S	S	.	.	H	α-helix	trans	-60.7	-45.1	174.8	-177.3	61.2	0	0	0	112	F791 I792 V797 V798 L799	F791-L795 HydrophobicContact CE1-CD2 3.98Å; F791-L795 HydrophobicContact CZ-CD2 4.26Å; F791-L795 PolarHBondContact O-N 2.02Å; I792-L795 PolarHBondContact O-N 3.22Å; L795-V797 VanDerWaalsContact C-N 3.32Å; L795-V797 PolarHBondContact O-N 2.91Å; L795-V798 PolarHBondContact O-N 2.96Å; L795-V798 VanDerWaalsContact O-N 3.12Å; L795-L799 HydrophobicContact CD1-CD1 4.14Å; L795-L799 HydrophobicContact CD1-CG 4.1Å; L795-L799 HydrophobicContact CG-CD1 3.91Å; L795-L799 HydrophobicContact CG-CG 4.31Å; L795-L799 WeakPolarHBondContact O-CB 3.47Å; L795-L799 WeakPolarHBondContact O-CG 3.38Å; L795-L799 PolarHBondContact O-N 3.04Å
796	C	92.5	Very high	88	Confident	72 Å²	72	68.5 Å²	68.5	49%	0.486	33%	0.334	S	S	.	.	H	α-helix	trans	-59.2	-40.4	175	-65.2	0	0	0	0	112.4	I792 V798 F800	I792-C796 PolarHBondContact O-N 3.27Å; I792-C796 PolarHBondContact O-SG 3.48Å; C796-V798 VanDerWaalsContact C-N 3.34Å; C796-F800 WeakPolarHBondContact O-CB 3.35Å; C796-F800 PolarHBondContact O-N 3.46Å
797	V	90.4	Very high	87.6	Confident	68 Å²	68	66.9 Å²	66.9	41%	0.412	33%	0.328	S	S	.	.	H	α-helix	trans	-65.1	-38	175.4	169.4	0	0	0	0	111.4	K793 L794 L795 L801	K793-V797 WeakPolarHBondContact O-CG2 3.26Å; K793-V797 PolarHBondContact O-N 3.13Å; L794-V797 PolarHBondContact O-N 3.23Å; L795-V797 VanDerWaalsContact C-N 3.32Å; L795-V797 PolarHBondContact O-N 2.91Å; V797-L801 HydrophobicContact CG1-CD1 4.2Å; V797-L801 VanDerWaalsContact O-CG 3.3Å; V797-L801 WeakPolarHBondContact O-CG 3.41Å; V797-L801 PolarHBondContact O-N 3.33Å
798	V	91.2	Very high	86.6	Confident	5 Å²	5	67 Å²	67	3%	0.03	33%	0.329	C	S	.	.	H	α-helix	trans	-72	-45	179.5	175	0	0	0	0	111.6	L770 F774 L794 L795 C796 F800 L801 F802 F819	L770-V798 HydrophobicContact CD1-CG2 3.94Å; L770-V798 HydrophobicContact CD2-CB 4.39Å; L770-V798 HydrophobicContact CD2-CG1 4.43Å; L770-V798 HydrophobicContact CD2-CG2 3.6Å; L770-V798 HydrophobicContact CG-CG2 3.72Å; F774-V798 HydrophobicContact CE2-CB 4.48Å; F774-V798 HydrophobicContact CE2-CG2 3.52Å; F774-V798 HydrophobicContact CZ-CB 4.46Å; F774-V798 HydrophobicContact CZ-CG2 3.8Å; L794-V798 WeakPolarHBondContact O-CG2 3.42Å; L794-V798 PolarHBondContact O-N 2.93Å; L795-V798 PolarHBondContact O-N 2.96Å; L795-V798 VanDerWaalsContact O-N 3.12Å; C796-V798 VanDerWaalsContact C-N 3.34Å; V798-F800 VanDerWaalsContact C-N 3.3Å; V798-F800 PolarHBondContact O-N 2.64Å; V798-L801 PolarHBondContact O-N 3.21Å; V798-F802 HydrophobicContact CG1-CD2 3.74Å; V798-F802 HydrophobicContact CG1-CE2 3.5Å; V798-F802 VanDerWaalsContact CG1-CE2 3.5Å; V798-F802 VanDerWaalsContact O-CD2 3.24Å; V798-F802 WeakPolarHBondContact O-CD2 3.06Å; V798-F802 PolarHBondContact O-N 2.77Å; V798-F819 HydrophobicContact CG1-CE2 4.15Å
799	L	91.6	Very high	85.7	Confident	101 Å²	101	63 Å²	63	53%	0.529	31%	0.314	S	S	.	.	H	α-helix	trans	-62.9	-37	174.7	-67.9	173.2	0	0	0	111.8	L795 F802 A803	L795-L799 HydrophobicContact CD1-CD1 4.14Å; L795-L799 HydrophobicContact CD1-CG 4.1Å; L795-L799 HydrophobicContact CG-CD1 3.91Å; L795-L799 HydrophobicContact CG-CG 4.31Å; L795-L799 WeakPolarHBondContact O-CB 3.47Å; L795-L799 WeakPolarHBondContact O-CG 3.38Å; L795-L799 PolarHBondContact O-N 3.04Å; L799-F802 PolarHBondContact O-N 2.86Å; L799-A803 WeakPolarHBondContact O-CB 3.3Å; L799-A803 PolarHBondContact O-N 3.26Å
800	F	90.9	Very high	85.4	Confident	124 Å²	124	57.1 Å²	57.1	54%	0.544	29%	0.294	S	S	.	.	H	α-helix	trans	-62	-44.8	171.6	178.8	-87.1	0	0	0	111.8	C796 V798 F802 A803 F804	C796-F800 WeakPolarHBondContact O-CB 3.35Å; C796-F800 PolarHBondContact O-N 3.46Å; V798-F800 VanDerWaalsContact C-N 3.3Å; V798-F800 PolarHBondContact O-N 2.64Å; F800-F802 PolarHBondContact O-N 3.3Å; F800-A803 PolarHBondContact O-N 2.95Å; F800-F804 HydrophobicContact CD1-CD2 4.03Å; F800-F804 HydrophobicContact CD1-CE2 4.28Å; F800-F804 HydrophobicContact CD2-CD2 4.41Å; F800-F804 HydrophobicContact CD2-CE2 4.18Å; F800-F804 AromaticContact CE1-CD2 3.74Å; F800-F804 HydrophobicContact CE1-CD2 3.74Å; F800-F804 AromaticContact CE1-CE2 3.64Å; F800-F804 HydrophobicContact CE1-CE2 3.64Å; F800-F804 HydrophobicContact CE1-CZ 4.33Å; F800-F804 HydrophobicContact CE2-CD2 4.16Å; F800-F804 AromaticContact CE2-CE2 3.53Å; F800-F804 HydrophobicContact CE2-CE2 3.53Å; F800-F804 HydrophobicContact CE2-CZ 4.41Å; F800-F804 HydrophobicContact CG-CD2 4.36Å; F800-F804 AromaticContact CZ-CD2 3.82Å; F800-F804 HydrophobicContact CZ-CD2 3.82Å; F800-F804 AromaticContact CZ-CE2 3.22Å; F800-F804 HydrophobicContact CZ-CE2 3.22Å; F800-F804 AromaticContact CZ-CZ 3.84Å; F800-F804 HydrophobicContact CZ-CZ 3.84Å; F800-F804 WeakPolarHBondContact O-CD2 3.18Å; F800-F804 PolarHBondContact O-N 3.43Å
801	L	89.8	Confident	85.5	Confident	66 Å²	66	57.4 Å²	57.4	35%	0.346	30%	0.295	S	S	.	.	H	α-helix	trans	-65.4	-36.5	176.5	-72.1	168.3	0	0	0	112.8	F767 L770 V797 V798 G805	F767-L801 HydrophobicContact CE1-CB 4.25Å; F767-L801 HydrophobicContact CZ-CB 3.87Å; L770-L801 HydrophobicContact CD2-CD1 3.78Å; V797-L801 HydrophobicContact CG1-CD1 4.2Å; V797-L801 VanDerWaalsContact O-CG 3.3Å; V797-L801 WeakPolarHBondContact O-CG 3.41Å; V797-L801 PolarHBondContact O-N 3.33Å; V798-L801 PolarHBondContact O-N 3.21Å; L801-G805 PolarHBondContact O-N 3.37Å
802	F	87.4	Confident	85.4	Confident	40 Å²	40	55.6 Å²	55.6	18%	0.175	29%	0.287	C	S	.	.	H	α-helix	trans	-68.2	-39.3	171.4	-78.4	-63.1	0	0	0	112.6	F767 V798 L799 F800 F804 G805 L806 H815 I816 F819	F767-F802 AromaticContact CD1-CE1 3.96Å; F767-F802 HydrophobicContact CD1-CE1 3.96Å; F767-F802 HydrophobicContact CD1-CE2 4.15Å; F767-F802 AromaticContact CD1-CZ 3.65Å; F767-F802 HydrophobicContact CD1-CZ 3.65Å; F767-F802 AromaticContact CE1-CD1 3.99Å; F767-F802 HydrophobicContact CE1-CD1 3.99Å; F767-F802 HydrophobicContact CE1-CD2 4.2Å; F767-F802 AromaticContact CE1-CE1 3.69Å; F767-F802 HydrophobicContact CE1-CE1 3.69Å; F767-F802 AromaticContact CE1-CE2 3.93Å; F767-F802 HydrophobicContact CE1-CE2 3.93Å; F767-F802 HydrophobicContact CE1-CG 4.23Å; F767-F802 AromaticContact CE1-CZ 3.66Å; F767-F802 HydrophobicContact CE1-CZ 3.66Å; V798-F802 HydrophobicContact CG1-CD2 3.74Å; V798-F802 HydrophobicContact CG1-CE2 3.5Å; V798-F802 VanDerWaalsContact CG1-CE2 3.5Å; V798-F802 VanDerWaalsContact O-CD2 3.24Å; V798-F802 WeakPolarHBondContact O-CD2 3.06Å; V798-F802 PolarHBondContact O-N 2.77Å; L799-F802 PolarHBondContact O-N 2.86Å; F800-F802 PolarHBondContact O-N 3.3Å; F802-F804 VanDerWaalsContact C-N 3.35Å; F802-F804 PolarHBondContact O-N 2.91Å; F802-G805 CarbonylContact O-C 3.6Å; F802-G805 WeakPolarHBondContact O-CA 2.99Å; F802-G805 PolarHBondContact O-N 3.48Å; F802-L806 PolarHBondContact O-N 2.64Å; F802-H815 HydrophobicContact CD1-CB 4.16Å; F802-H815 HydrophobicContact CE1-CB 3.51Å; F802-H815 HydrophobicContact CZ-CB 4.38Å; F802-I816 HydrophobicContact CD1-CG1 4.25Å; F802-I816 HydrophobicContact CE1-CB 4.45Å; F802-I816 HydrophobicContact CE1-CG1 3.54Å; F802-I816 HydrophobicContact CZ-CG1 4.04Å; F802-F819 HydrophobicContact CZ-CB 4.48Å
803	A	86.4	Confident	85.4	Confident	55 Å²	55	51.9 Å²	51.9	46%	0.455	27%	0.268	S	S	.	.	H	α-helix	trans	-64.7	-37.9	175.7	0	0	0	0	0	112.3	L799 F800 G805 L806	L799-A803 WeakPolarHBondContact O-CB 3.3Å; L799-A803 PolarHBondContact O-N 3.26Å; F800-A803 PolarHBondContact O-N 2.95Å; A803-G805 PolarHBondContact O-N 2.88Å; A803-L806 WeakPolarHBondContact O-CB 3.41Å; A803-L806 PolarHBondContact O-N 2.83Å
804	F	84.7	Confident	85.6	Confident	109 Å²	109	47.8 Å²	47.8	48%	0.478	25%	0.251	S	S	.	.	H	α-helix	trans	-66.8	-26.8	169	-91.7	-102.5	0	0	0	112.7	F800 F802 L806 L807	F800-F804 HydrophobicContact CD1-CD2 4.03Å; F800-F804 HydrophobicContact CD1-CE2 4.28Å; F800-F804 HydrophobicContact CD2-CD2 4.41Å; F800-F804 HydrophobicContact CD2-CE2 4.18Å; F800-F804 AromaticContact CE1-CD2 3.74Å; F800-F804 HydrophobicContact CE1-CD2 3.74Å; F800-F804 AromaticContact CE1-CE2 3.64Å; F800-F804 HydrophobicContact CE1-CE2 3.64Å; F800-F804 HydrophobicContact CE1-CZ 4.33Å; F800-F804 HydrophobicContact CE2-CD2 4.16Å; F800-F804 AromaticContact CE2-CE2 3.53Å; F800-F804 HydrophobicContact CE2-CE2 3.53Å; F800-F804 HydrophobicContact CE2-CZ 4.41Å; F800-F804 HydrophobicContact CG-CD2 4.36Å; F800-F804 AromaticContact CZ-CD2 3.82Å; F800-F804 HydrophobicContact CZ-CD2 3.82Å; F800-F804 AromaticContact CZ-CE2 3.22Å; F800-F804 HydrophobicContact CZ-CE2 3.22Å; F800-F804 AromaticContact CZ-CZ 3.84Å; F800-F804 HydrophobicContact CZ-CZ 3.84Å; F800-F804 WeakPolarHBondContact O-CD2 3.18Å; F800-F804 PolarHBondContact O-N 3.43Å; F802-F804 VanDerWaalsContact C-N 3.35Å; F802-F804 PolarHBondContact O-N 2.91Å; F804-L806 PolarHBondContact O-N 2.64Å; F804-L807 HydrophobicContact CD1-CD1 4.22Å; F804-L807 WeakPolarHBondContact O-CB 3.36Å; F804-L807 WeakPolarHBondContact O-CD1 3.22Å; F804-L807 VanDerWaalsContact O-CG 3.27Å; F804-L807 WeakPolarHBondContact O-CG 3.14Å; F804-L807 PolarHBondContact O-N 3.41Å
805	G	78.6	Confident	85.8	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.01	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-7.1	173.1	0	0	0	0	0	115.1	L801 F802 A803 L807 N812	L801-G805 PolarHBondContact O-N 3.37Å; F802-G805 CarbonylContact O-C 3.6Å; F802-G805 WeakPolarHBondContact O-CA 2.99Å; F802-G805 PolarHBondContact O-N 3.48Å; A803-G805 PolarHBondContact O-N 2.88Å; G805-L807 PolarHBondContact O-N 2.79Å; G805-N812 VanDerWaalsContact C-ND2 3.26Å; G805-N812 WeakPolarHBondContact CA-OD1 3.47Å; G805-N812 PolarHBondContact O-ND2 3.26Å; G805-N812 PolarHBondContact O-OD1 3.24Å
806	L	78.4	Confident	85.9	Confident	45 Å²	45	48.3 Å²	48.3	24%	0.236	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-0.6	171.5	-58.5	167.9	0	0	0	113	F802 A803 F804 I881	F802-L806 PolarHBondContact O-N 2.64Å; A803-L806 WeakPolarHBondContact O-CB 3.41Å; A803-L806 PolarHBondContact O-N 2.83Å; F804-L806 PolarHBondContact O-N 2.64Å; L806-I881 HydrophobicContact CD1-CD1 3.92Å; L806-I881 HydrophobicContact CD2-CD1 4.35Å; L806-I881 HydrophobicContact CD2-CG1 4.33Å
807	L	74.5	Confident	86	Confident	71 Å²	71	46 Å²	46	37%	0.372	24%	0.237	S	C	.	.	S	Bend	trans	-74.3	148.5	170.6	-65.7	172.1	0	0	0	110.4	F804 G805 I810 F887	F804-L807 HydrophobicContact CD1-CD1 4.22Å; F804-L807 WeakPolarHBondContact O-CB 3.36Å; F804-L807 WeakPolarHBondContact O-CD1 3.22Å; F804-L807 VanDerWaalsContact O-CG 3.27Å; F804-L807 WeakPolarHBondContact O-CG 3.14Å; F804-L807 PolarHBondContact O-N 3.41Å; G805-L807 PolarHBondContact O-N 2.79Å; L807-I810 HydrophobicContact CB-CD1 4.31Å; L807-F887 HydrophobicContact CD2-CE1 4.19Å; L807-F887 HydrophobicContact CD2-CZ 3.86Å
808	P	66.6	Low	86.3	Confident	23 Å²	23	42.8 Å²	42.8	15%	0.149	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	157	170.6	25.9	-35.2	0	0	0	111.2	I810 F887	P808-I810 PolarHBondContact O-N 2.97Å; P808-F887 VanDerWaalsContact CD-CZ 3.49Å; P808-F887 HydrophobicContact CG-CD1 4.42Å; P808-F887 HydrophobicContact CG-CE1 4.13Å; P808-F887 HydrophobicContact CG-CE2 4.21Å; P808-F887 HydrophobicContact CG-CZ 4.02Å
809	W	69.5	Low	86.5	Confident	85 Å²	85	44.4 Å²	44.4	32%	0.322	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	5.2	-176.4	-49.1	98.3	0	0	0	116.7	Q495 Y891	Q495-W809 HydrophobicContact CB-CH2 3.73Å; Q495-W809 HydrophobicContact CB-CZ2 4.16Å; Q495-W809 HydrophobicContact CG-CH2 4.19Å; W809-Y891 WeakPolarHBondContact CZ3-OH 3.09Å
810	I	82.1	Confident	86.7	Confident	38 Å²	38	42.8 Å²	42.8	20%	0.195	22%	0.216	C	C	.	.			trans	-115.6	146.1	172.9	-55.5	179.9	0	0	0	108.8	W499 L807 P808 H815 T879	W499-I810 HydrophobicContact CZ2-CG1 4.32Å; L807-I810 HydrophobicContact CB-CD1 4.31Å; P808-I810 PolarHBondContact O-N 2.97Å; I810-H815 WeakPolarHBondContact CG2-CE1 3.44Å; I810-T879 WeakPolarHBondContact O-CG2 3.35Å
811	D	87.3	Confident	87	Confident	11 Å²	11	36.9 Å²	36.9	6%	0.059	19%	0.19	C	C	.	.			trans	-114.2	118.2	176.2	176.8	38.8	0	0	0	113.1	S750 L754 E759 F813 A814 H815 T879	S750-D811 WeakPolarHBondContact CB-OD2 3.32Å; S750-D811 PolarHBondContact OG-OD2 3.22Å; L754-D811 HydrophobicContact CD1-CB 4.33Å; L754-D811 WeakPolarHBondContact CD1-OD1 3.23Å; E759-D811 VanDerWaalsContact OE2-CB 3.3Å; E759-D811 WeakPolarHBondContact OE2-CB 3.26Å; D811-F813 WeakPolarHBondContact OD1-CD2 3.39Å; D811-F813 PolarHBondContact OD1-N 3.47Å; D811-F813 PolarHBondContact OD2-N 3.42Å; D811-A814 WeakPolarHBondContact OD2-CB 3.44Å; D811-A814 PolarHBondContact OD2-N 3.37Å; D811-H815 PolarHBondContact O-CD2 3.44Å; D811-H815 PolarHBondContact O-N 3.15Å; D811-H815 PolarHBondContact O-ND1 2.9Å; D811-T879 PolarHBondContact OD1-OG1 3.22Å
812	N	90	Very high	87.4	Confident	5 Å²	5	33.7 Å²	33.7	3%	0.027	17%	0.173	C	C	.	.	H	α-helix	trans	-79.5	-20.3	175.5	-66.2	-40.8	0	0	0	113.7	G805 H815 I816 I878	G805-N812 VanDerWaalsContact C-ND2 3.26Å; G805-N812 WeakPolarHBondContact CA-OD1 3.47Å; G805-N812 PolarHBondContact O-ND2 3.26Å; G805-N812 PolarHBondContact O-OD1 3.24Å; N812-H815 PolarHBondContact O-N 2.84Å; N812-I816 HydrophobicContact CB-CD1 4.43Å; N812-I816 VanDerWaalsContact O-CB 3.31Å; N812-I816 WeakPolarHBondContact O-CB 3.44Å; N812-I816 WeakPolarHBondContact O-CD1 3.46Å; N812-I816 WeakPolarHBondContact O-CG1 3.5Å; N812-I816 PolarHBondContact O-N 3.2Å; N812-I878 HydrophobicContact CB-CG2 4.48Å; N812-I878 PolarHBondContact ND2-O 3.36Å
813	F	90.7	Very high	87.8	Confident	14 Å²	14	34.5 Å²	34.5	6%	0.061	18%	0.177	C	C	.	.	H	α-helix	trans	-68.5	-45.4	176.9	-70.4	-77	0	0	0	111.5	F753 L754 D811 H815 I816 C817 C875 I878 T879	F753-F813 HydrophobicContact CB-CD1 3.87Å; F753-F813 HydrophobicContact CB-CD2 3.85Å; F753-F813 HydrophobicContact CB-CE1 3.99Å; F753-F813 HydrophobicContact CB-CE2 3.97Å; F753-F813 HydrophobicContact CB-CG 3.81Å; F753-F813 HydrophobicContact CB-CZ 4.05Å; F753-F813 HydrophobicContact CD1-CD1 4.48Å; F753-F813 HydrophobicContact CD1-CE1 4.19Å; F753-F813 HydrophobicContact CD2-CB 4.19Å; F753-F813 AromaticContact CD2-CD1 3.28Å; F753-F813 HydrophobicContact CD2-CD1 3.28Å; F753-F813 AromaticContact CD2-CE1 3.79Å; F753-F813 HydrophobicContact CD2-CE1 3.79Å; F753-F813 AromaticContact CD2-CG 3.8Å; F753-F813 HydrophobicContact CD2-CG 3.8Å; F753-F813 AromaticContact CE2-CD1 3.92Å; F753-F813 HydrophobicContact CE2-CD1 3.92Å; F753-F813 HydrophobicContact CE2-CE1 4.33Å; F753-F813 AromaticContact CG-CD1 3.63Å; F753-F813 HydrophobicContact CG-CD1 3.63Å; F753-F813 AromaticContact CG-CE1 3.72Å; F753-F813 HydrophobicContact CG-CE1 3.72Å; F753-F813 HydrophobicContact CG-CG 4.06Å; F753-F813 HydrophobicContact CG-CZ 4.23Å; L754-F813 HydrophobicContact CD1-CD2 4.14Å; L754-F813 HydrophobicContact CG-CD2 4.17Å; D811-F813 WeakPolarHBondContact OD1-CD2 3.39Å; D811-F813 PolarHBondContact OD1-N 3.47Å; D811-F813 PolarHBondContact OD2-N 3.42Å; F813-H815 VanDerWaalsContact C-N 3.34Å; F813-H815 PolarHBondContact O-N 3.35Å; F813-I816 PolarHBondContact O-N 3.43Å; F813-C817 VanDerWaalsContact O-CB 3.26Å; F813-C817 WeakPolarHBondContact O-CB 3.49Å; F813-C817 PolarHBondContact O-N 3.47Å; F813-C817 PolarHBondContact O-SG 2.85Å; F813-C817 VanDerWaalsContact O-SG 3.37Å; F813-C875 HydrophobicContact CE1-CB 4.48Å; F813-C875 HydrophobicContact CE2-CB 4.15Å; F813-C875 WeakPolarHBondContact CE2-O 3.39Å; F813-C875 HydrophobicContact CZ-CB 3.59Å; F813-C875 WeakPolarHBondContact CZ-O 3.46Å; F813-I878 HydrophobicContact CE1-CD1 4.31Å; F813-I878 HydrophobicContact CE1-CG2 4.32Å; F813-I878 HydrophobicContact CE2-CB 4.24Å; F813-I878 HydrophobicContact CE2-CG2 4.35Å; F813-I878 HydrophobicContact CZ-CB 3.85Å; F813-I878 HydrophobicContact CZ-CD1 4.05Å; F813-I878 HydrophobicContact CZ-CG1 4.48Å; F813-I878 HydrophobicContact CZ-CG2 3.97Å; F813-T879 WeakPolarHBondContact CD2-OG1 3.22Å; F813-T879 VanDerWaalsContact CE2-OG1 3.32Å; F813-T879 WeakPolarHBondContact CE2-OG1 3.03Å
814	A	92.9	Very high	88.2	Confident	5 Å²	5	33.7 Å²	33.7	4%	0.041	16%	0.163	C	C	.	.	H	α-helix	trans	-62.1	-39.3	171.4	0	0	0	0	0	112	G746 G764 D811 G818	G746-A814 WeakPolarHBondContact O-CA 3.26Å; G764-A814 WeakPolarHBondContact CA-O 3.22Å; D811-A814 WeakPolarHBondContact OD2-CB 3.44Å; D811-A814 PolarHBondContact OD2-N 3.37Å; A814-G818 VanDerWaalsContact O-CA 3.31Å; A814-G818 WeakPolarHBondContact O-CA 3.38Å; A814-G818 PolarHBondContact O-N 3Å
815	H	93.8	Very high	88.7	Confident	15 Å²	15	28.6 Å²	28.6	7%	0.069	14%	0.141	C	C	.	.	H	α-helix	trans	-65.3	-49.6	175.6	-65.5	168.2	0	0	0	112.7	F767 F802 I810 D811 N812 F813 F819	F767-H815 WeakPolarHBondContact CB-O 3.28Å; F767-H815 HydrophobicContact CD1-CB 3.93Å; F767-H815 HydrophobicContact CD2-CB 3.93Å; F767-H815 AromaticContact CD2-CD2 3.29Å; F767-H815 WeakPolarHBondContact CD2-CD2 3.42Å; F767-H815 AromaticContact CD2-CG 3.63Å; F767-H815 AromaticContact CD2-NE2 3.76Å; F767-H815 HydrophobicContact CE1-CB 4.01Å; F767-H815 HydrophobicContact CE2-CB 4.01Å; F767-H815 AromaticContact CE2-CD2 3.3Å; F767-H815 WeakPolarHBondContact CE2-CD2 3.32Å; F767-H815 AromaticContact CE2-CE1 3.53Å; F767-H815 AromaticContact CE2-CG 3.43Å; F767-H815 VanDerWaalsContact CE2-CG 3.43Å; F767-H815 AromaticContact CE2-ND1 3.6Å; F767-H815 AromaticContact CE2-NE2 3.35Å; F767-H815 VanDerWaalsContact CE2-NE2 3.35Å; F767-H815 WeakPolarHBondContact CE2-NE2 3.45Å; F767-H815 HydrophobicContact CG-CB 3.88Å; F767-H815 HydrophobicContact CZ-CB 4.04Å; F767-H815 AromaticContact CZ-CE1 3.96Å; F767-H815 AromaticContact CZ-CG 3.74Å; F767-H815 AromaticContact CZ-ND1 3.69Å; F802-H815 HydrophobicContact CD1-CB 4.16Å; F802-H815 HydrophobicContact CE1-CB 3.51Å; F802-H815 HydrophobicContact CZ-CB 4.38Å; I810-H815 WeakPolarHBondContact CG2-CE1 3.44Å; D811-H815 PolarHBondContact O-CD2 3.44Å; D811-H815 PolarHBondContact O-N 3.15Å; D811-H815 PolarHBondContact O-ND1 2.9Å; N812-H815 PolarHBondContact O-N 2.84Å; F813-H815 VanDerWaalsContact C-N 3.34Å; F813-H815 PolarHBondContact O-N 3.35Å; H815-F819 VanDerWaalsContact O-CB 3.27Å; H815-F819 WeakPolarHBondContact O-CB 3.4Å; H815-F819 PolarHBondContact O-N 2.98Å
816	I	93.8	Very high	89.5	Confident	62 Å²	62	28.5 Å²	28.5	32%	0.318	14%	0.14	S	C	.	.	H	α-helix	trans	-65.8	-50.4	-178.8	-68.6	166.9	0	0	0	110	F802 N812 F813 F819 I820 I878	F802-I816 HydrophobicContact CD1-CG1 4.25Å; F802-I816 HydrophobicContact CE1-CB 4.45Å; F802-I816 HydrophobicContact CE1-CG1 3.54Å; F802-I816 HydrophobicContact CZ-CG1 4.04Å; N812-I816 HydrophobicContact CB-CD1 4.43Å; N812-I816 VanDerWaalsContact O-CB 3.31Å; N812-I816 WeakPolarHBondContact O-CB 3.44Å; N812-I816 WeakPolarHBondContact O-CD1 3.46Å; N812-I816 WeakPolarHBondContact O-CG1 3.5Å; N812-I816 PolarHBondContact O-N 3.2Å; F813-I816 PolarHBondContact O-N 3.43Å; I816-F819 PolarHBondContact O-N 3.16Å; I816-I820 HydrophobicContact CG2-CD1 3.73Å; I816-I820 VanDerWaalsContact O-CG1 3.31Å; I816-I820 WeakPolarHBondContact O-CG1 3.43Å; I816-I820 PolarHBondContact O-N 2.89Å; I816-I878 HydrophobicContact CD1-CG2 4.28Å
817	C	95.2	Very high	90.2	Very high	23 Å²	23	27.3 Å²	27.3	16%	0.155	13%	0.133	C	C	.	.	H	α-helix	trans	-73	-31.8	-177.6	-61.5	0	0	0	0	112.2	A749 F813 S821	A749-C817 HydrophobicContact CB-CB 3.53Å; A749-C817 WeakPolarHBondContact CB-SG 3.5Å; F813-C817 VanDerWaalsContact O-CB 3.26Å; F813-C817 WeakPolarHBondContact O-CB 3.49Å; F813-C817 PolarHBondContact O-N 3.47Å; F813-C817 PolarHBondContact O-SG 2.85Å; F813-C817 VanDerWaalsContact O-SG 3.37Å; C817-S821 VanDerWaalsContact O-CB 3.29Å; C817-S821 WeakPolarHBondContact O-CB 3.41Å; C817-S821 PolarHBondContact O-N 3.42Å; C817-S821 PolarHBondContact O-OG 3.13Å
818	G	96.1	Very high	91	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.5	-42.5	168.7	0	0	0	0	0	112.5	G764 G768 A814 S821 G822	G764-G818 WeakPolarHBondContact O-CA 3.43Å; G768-G818 WeakPolarHBondContact CA-O 3.4Å; G768-G818 PolarHBondContact N-O 3.37Å; A814-G818 VanDerWaalsContact O-CA 3.31Å; A814-G818 WeakPolarHBondContact O-CA 3.38Å; A814-G818 PolarHBondContact O-N 3Å; G818-S821 PolarHBondContact O-OG 2.77Å; G818-G822 PolarHBondContact O-N 2.96Å
819	F	96.5	Very high	92.2	Very high	39 Å²	39	26.3 Å²	26.3	17%	0.171	13%	0.125	C	C	.	.	H	α-helix	trans	-63.5	-49	173.9	-172.2	-87.7	0	0	0	112.1	F767 L770 A771 F774 V798 F802 H815 I816 G822 F823	F767-F819 HydrophobicContact CB-CB 4.26Å; F767-F819 WeakPolarHBondContact O-CD2 3.42Å; L770-F819 HydrophobicContact CG-CE2 4.49Å; A771-F819 HydrophobicContact CB-CD1 4.27Å; A771-F819 HydrophobicContact CB-CD2 3.72Å; A771-F819 HydrophobicContact CB-CE1 4.3Å; A771-F819 HydrophobicContact CB-CE2 3.76Å; A771-F819 HydrophobicContact CB-CG 3.98Å; A771-F819 HydrophobicContact CB-CZ 4.06Å; A771-F819 WeakPolarHBondContact CB-O 3.24Å; F774-F819 AromaticContact CD2-CE2 3.86Å; F774-F819 HydrophobicContact CD2-CE2 3.86Å; F774-F819 AromaticContact CD2-CZ 3.65Å; F774-F819 HydrophobicContact CD2-CZ 3.65Å; F774-F819 AromaticContact CE2-CE2 3.71Å; F774-F819 HydrophobicContact CE2-CE2 3.71Å; F774-F819 AromaticContact CE2-CZ 3.61Å; F774-F819 HydrophobicContact CE2-CZ 3.61Å; F774-F819 HydrophobicContact CG-CZ 4.43Å; F774-F819 HydrophobicContact CZ-CZ 4.38Å; V798-F819 HydrophobicContact CG1-CE2 4.15Å; F802-F819 HydrophobicContact CZ-CB 4.48Å; H815-F819 VanDerWaalsContact O-CB 3.27Å; H815-F819 WeakPolarHBondContact O-CB 3.4Å; H815-F819 PolarHBondContact O-N 2.98Å; I816-F819 PolarHBondContact O-N 3.16Å; F819-G822 PolarHBondContact O-N 3.26Å; F819-F823 WeakPolarHBondContact O-CB 3.49Å; F819-F823 PolarHBondContact O-N 3.43Å
820	I	96.6	Very high	93	Very high	67 Å²	67	22.5 Å²	22.5	34%	0.344	11%	0.111	S	C	.	.	H	α-helix	trans	-64	-46.8	-178.6	-68.3	167.7	0	0	0	111.3	I816 F823 F824 L857	I816-I820 HydrophobicContact CG2-CD1 3.73Å; I816-I820 VanDerWaalsContact O-CG1 3.31Å; I816-I820 WeakPolarHBondContact O-CG1 3.43Å; I816-I820 PolarHBondContact O-N 2.89Å; I820-F823 WeakPolarHBondContact O-CB 3.46Å; I820-F823 PolarHBondContact O-N 3.27Å; I820-F824 HydrophobicContact CG2-CD2 4.15Å; I820-F824 HydrophobicContact CG2-CE2 3.63Å; I820-F824 HydrophobicContact CG2-CZ 4.46Å; I820-F824 VanDerWaalsContact O-CD2 3.27Å; I820-F824 WeakPolarHBondContact O-CD2 3.37Å; I820-F824 PolarHBondContact O-N 3.23Å; I820-L857 HydrophobicContact CG2-CD1 3.83Å
821	S	97	Very high	93.1	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-64.8	-45.4	176.2	57.7	0	0	0	0	111.7	S742 C817 G818 F823 F824 L825	S742-S821 WeakPolarHBondContact CA-OG 3.32Å; C817-S821 VanDerWaalsContact O-CB 3.29Å; C817-S821 WeakPolarHBondContact O-CB 3.41Å; C817-S821 PolarHBondContact O-N 3.42Å; C817-S821 PolarHBondContact O-OG 3.13Å; G818-S821 PolarHBondContact O-OG 2.77Å; S821-F823 VanDerWaalsContact C-N 3.27Å; S821-F823 PolarHBondContact O-N 3.16Å; S821-F824 PolarHBondContact O-N 3.06Å; S821-L825 WeakPolarHBondContact O-CD1 3.38Å; S821-L825 PolarHBondContact O-N 3.49Å
822	G	96.4	Very high	92.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.2	-33	175.6	0	0	0	0	0	113.7	G818 F819 S826	G818-G822 PolarHBondContact O-N 2.96Å; F819-G822 PolarHBondContact O-N 3.26Å; G822-S826 WeakPolarHBondContact O-CB 3.38Å; G822-S826 PolarHBondContact O-N 3.47Å; G822-S826 PolarHBondContact O-OG 3.31Å
823	F	96	Very high	91.8	Very high	56 Å²	56	24.1 Å²	24.1	25%	0.246	12%	0.119	C	C	.	.	H	α-helix	trans	-62	-52.5	173.4	-175.6	-107.4	0	0	0	111.3	A771 V775 F778 F819 I820 S821 S826 F827	A771-F823 HydrophobicContact CB-CB 4.01Å; V775-F823 HydrophobicContact CG2-CD2 3.86Å; V775-F823 HydrophobicContact CG2-CE2 4.14Å; F778-F823 HydrophobicContact CD2-CE2 4.37Å; F778-F823 HydrophobicContact CE2-CE2 4.04Å; F778-F823 HydrophobicContact CE2-CZ 4.47Å; F819-F823 WeakPolarHBondContact O-CB 3.49Å; F819-F823 PolarHBondContact O-N 3.43Å; I820-F823 WeakPolarHBondContact O-CB 3.46Å; I820-F823 PolarHBondContact O-N 3.27Å; S821-F823 VanDerWaalsContact C-N 3.27Å; S821-F823 PolarHBondContact O-N 3.16Å; F823-S826 PolarHBondContact O-N 2.77Å; F823-F827 HydrophobicContact CD1-CD2 4.45Å; F823-F827 HydrophobicContact CD1-CE2 4.3Å; F823-F827 HydrophobicContact CD2-CE2 4.27Å; F823-F827 HydrophobicContact CE1-CD2 4.34Å; F823-F827 AromaticContact CE1-CE2 3.84Å; F823-F827 HydrophobicContact CE1-CE2 3.84Å; F823-F827 AromaticContact CE2-CE2 3.8Å; F823-F827 HydrophobicContact CE2-CE2 3.8Å; F823-F827 HydrophobicContact CZ-CD2 4.48Å; F823-F827 AromaticContact CZ-CE2 3.59Å; F823-F827 HydrophobicContact CZ-CE2 3.59Å; F823-F827 HydrophobicContact CZ-CZ 4.42Å; F823-F827 WeakPolarHBondContact O-CD2 3.47Å; F823-F827 PolarHBondContact O-N 2.98Å
824	F	96.1	Very high	91	Very high	39 Å²	39	24.2 Å²	24.2	17%	0.171	12%	0.122	C	C	.	.	H	α-helix	trans	-65.1	-43	178.3	-62.3	-47.8	0	0	0	112.5	I820 S821 S826 F827 A828 F850 V853 F854 L857	I820-F824 HydrophobicContact CG2-CD2 4.15Å; I820-F824 HydrophobicContact CG2-CE2 3.63Å; I820-F824 HydrophobicContact CG2-CZ 4.46Å; I820-F824 VanDerWaalsContact O-CD2 3.27Å; I820-F824 WeakPolarHBondContact O-CD2 3.37Å; I820-F824 PolarHBondContact O-N 3.23Å; S821-F824 PolarHBondContact O-N 3.06Å; F824-S826 VanDerWaalsContact C-N 3.3Å; F824-S826 PolarHBondContact O-N 3.13Å; F824-F827 PolarHBondContact O-N 3.37Å; F824-A828 PolarHBondContact O-N 2.04Å; F824-F850 AromaticContact CD1-CD1 3.51Å; F824-F850 HydrophobicContact CD1-CD1 3.51Å; F824-F850 AromaticContact CD1-CE1 3.88Å; F824-F850 HydrophobicContact CD1-CE1 3.88Å; F824-F850 HydrophobicContact CE1-CD1 4.01Å; F824-F850 AromaticContact CE1-CE1 3.99Å; F824-F850 HydrophobicContact CE1-CE1 3.99Å; F824-V853 HydrophobicContact CD1-CG1 4.24Å; F824-V853 HydrophobicContact CD2-CG1 4.1Å; F824-V853 HydrophobicContact CE1-CG1 4.02Å; F824-V853 HydrophobicContact CE2-CG1 3.87Å; F824-V853 HydrophobicContact CG-CG1 4.28Å; F824-V853 HydrophobicContact CZ-CG1 3.82Å; F824-F854 HydrophobicContact CB-CB 4.22Å; F824-L857 HydrophobicContact CD2-CD1 4.46Å; F824-L857 HydrophobicContact CE2-CD1 4.09Å
825	L	95.5	Very high	90	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-62.6	-36	174.6	-90.8	85.4	0	0	0	112.8	I738 L741 S821 F827 A828 F829 F854	I738-L825 HydrophobicContact CG1-CB 4.21Å; I738-L825 HydrophobicContact CG2-CB 4.47Å; L741-L825 HydrophobicContact CB-CD2 3.58Å; L741-L825 HydrophobicContact CD1-CD2 3.81Å; L741-L825 HydrophobicContact CG-CD2 4.3Å; S821-L825 WeakPolarHBondContact O-CD1 3.38Å; S821-L825 PolarHBondContact O-N 3.49Å; L825-F827 VanDerWaalsContact C-N 3.3Å; L825-F827 PolarHBondContact O-N 2.95Å; L825-A828 PolarHBondContact O-N 2.89Å; L825-A828 VanDerWaalsContact O-N 3.08Å; L825-F829 HydrophobicContact CB-CD2 4.28Å; L825-F829 HydrophobicContact CD2-CD2 4.37Å; L825-F829 HydrophobicContact CD2-CE2 4.17Å; L825-F829 HydrophobicContact CG-CD2 4.29Å; L825-F829 HydrophobicContact CG-CE2 4.18Å; L825-F829 WeakPolarHBondContact O-CD2 3.02Å; L825-F829 PolarHBondContact O-N 3.42Å; L825-F854 HydrophobicContact CD1-CB 4.19Å; L825-F854 HydrophobicContact CD1-CD1 3.67Å; L825-F854 HydrophobicContact CD1-CD2 3.27Å; L825-F854 HydrophobicContact CD1-CE1 3.85Å; L825-F854 HydrophobicContact CD1-CE2 3.47Å; L825-F854 VanDerWaalsContact CD1-CE2 3.47Å; L825-F854 HydrophobicContact CD1-CG 3.37Å; L825-F854 HydrophobicContact CD1-CZ 3.76Å; L825-F854 HydrophobicContact CG-CD1 4.48Å; L825-F854 HydrophobicContact CG-CG 4.48Å
826	S	94.6	Very high	89.3	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65.5	-35.5	177.4	-64.2	0	0	0	0	111.6	C772 G822 F823 F824 L830	C772-S826 VanDerWaalsContact CA-OG 3.24Å; C772-S826 WeakPolarHBondContact CA-OG 3.26Å; C772-S826 VanDerWaalsContact CB-OG 3.28Å; C772-S826 WeakPolarHBondContact CB-OG 3.46Å; G822-S826 WeakPolarHBondContact O-CB 3.38Å; G822-S826 PolarHBondContact O-N 3.47Å; G822-S826 PolarHBondContact O-OG 3.31Å; F823-S826 PolarHBondContact O-N 2.77Å; F824-S826 VanDerWaalsContact C-N 3.3Å; F824-S826 PolarHBondContact O-N 3.13Å; S826-L830 VanDerWaalsContact O-CB 3.24Å; S826-L830 WeakPolarHBondContact O-CB 3.18Å; S826-L830 VanDerWaalsContact O-CG 3.29Å; S826-L830 WeakPolarHBondContact O-CG 3.1Å; S826-L830 PolarHBondContact O-N 2.88Å; S826-L830 VanDerWaalsContact O-N 3.13Å
827	F	92.7	Very high	88.7	Confident	20 Å²	20	37.4 Å²	37.4	9%	0.088	18%	0.179	C	C	.	.	H	α-helix	trans	-69.9	-29.1	169.5	-80	-72.8	0	0	0	113.5	V775 F823 F824 L825 Y832 Q846 F850	V775-F827 HydrophobicContact CB-CE2 4.41Å; V775-F827 HydrophobicContact CB-CZ 4.47Å; V775-F827 HydrophobicContact CG1-CD1 3.76Å; V775-F827 HydrophobicContact CG1-CD2 4.13Å; V775-F827 HydrophobicContact CG1-CE1 3.74Å; V775-F827 HydrophobicContact CG1-CE2 4.1Å; V775-F827 HydrophobicContact CG1-CG 3.95Å; V775-F827 HydrophobicContact CG1-CZ 3.92Å; V775-F827 HydrophobicContact CG2-CD2 3.72Å; V775-F827 HydrophobicContact CG2-CE2 3.52Å; V775-F827 HydrophobicContact CG2-CG 4.36Å; V775-F827 HydrophobicContact CG2-CZ 4.02Å; F823-F827 HydrophobicContact CD1-CD2 4.45Å; F823-F827 HydrophobicContact CD1-CE2 4.3Å; F823-F827 HydrophobicContact CD2-CE2 4.27Å; F823-F827 HydrophobicContact CE1-CD2 4.34Å; F823-F827 AromaticContact CE1-CE2 3.84Å; F823-F827 HydrophobicContact CE1-CE2 3.84Å; F823-F827 AromaticContact CE2-CE2 3.8Å; F823-F827 HydrophobicContact CE2-CE2 3.8Å; F823-F827 HydrophobicContact CZ-CD2 4.48Å; F823-F827 AromaticContact CZ-CE2 3.59Å; F823-F827 HydrophobicContact CZ-CE2 3.59Å; F823-F827 HydrophobicContact CZ-CZ 4.42Å; F823-F827 WeakPolarHBondContact O-CD2 3.47Å; F823-F827 PolarHBondContact O-N 2.98Å; F824-F827 PolarHBondContact O-N 3.37Å; L825-F827 VanDerWaalsContact C-N 3.3Å; L825-F827 PolarHBondContact O-N 2.95Å; F827-Y832 WeakPolarHBondContact CA-OH 3.47Å; F827-Y832 WeakPolarHBondContact CD1-OH 3.2Å; F827-Y832 WeakPolarHBondContact O-CE2 3.02Å; F827-Y832 PolarHBondContact O-OH 2.96Å; F827-Q846 VanDerWaalsContact CD1-NE2 3.32Å; F827-F850 HydrophobicContact CB-CB 4.11Å; F827-F850 HydrophobicContact CB-CD2 3.5Å; F827-F850 VanDerWaalsContact CB-CD2 3.5Å; F827-F850 HydrophobicContact CB-CE2 4.07Å; F827-F850 HydrophobicContact CB-CG 3.89Å; F827-F850 HydrophobicContact CD1-CD2 4.37Å; F827-F850 HydrophobicContact CD1-CE2 4.15Å; F827-F850 HydrophobicContact CD2-CD2 4.43Å; F827-F850 HydrophobicContact CD2-CE2 4.26Å; F827-F850 HydrophobicContact CD2-CZ 4.45Å; F827-F850 AromaticContact CG-CD2 3.88Å; F827-F850 HydrophobicContact CG-CD2 3.88Å; F827-F850 AromaticContact CG-CE2 3.91Å; F827-F850 HydrophobicContact CG-CE2 3.91Å; F827-F850 HydrophobicContact CG-CG 4.48Å
828	A	92.1	Very high	88.1	Confident	11 Å²	11	43.5 Å²	43.5	9%	0.091	21%	0.207	C	C	.	.	H	α-helix	trans	-74.7	-41.2	175.9	0	0	0	0	0	113.2	F824 L825 L851	F824-A828 PolarHBondContact O-N 2.04Å; L825-A828 PolarHBondContact O-N 2.89Å; L825-A828 VanDerWaalsContact O-N 3.08Å; A828-L851 HydrophobicContact CB-CB 4.49Å
829	F	91.2	Very high	87.4	Confident	61 Å²	61	45 Å²	45	27%	0.268	22%	0.215	S	C	.	.	H	α-helix	trans	-110.2	-20.4	-165.5	-67.9	-70.6	0	0	0	116.5	R734 I737 I738 L825	R734-F829 WeakPolarHBondContact CD-O 3.37Å; R734-F829 PolarHBondContact NH1-O 2.92Å; I737-F829 HydrophobicContact CG2-CD2 4.17Å; I737-F829 HydrophobicContact CG2-CE1 4.33Å; I737-F829 HydrophobicContact CG2-CE2 3.73Å; I737-F829 HydrophobicContact CG2-CZ 3.83Å; I738-F829 HydrophobicContact CD1-CB 4.11Å; I738-F829 HydrophobicContact CG1-CB 4.22Å; I738-F829 HydrophobicContact CG1-CD2 4.34Å; L825-F829 HydrophobicContact CB-CD2 4.28Å; L825-F829 HydrophobicContact CD2-CD2 4.37Å; L825-F829 HydrophobicContact CD2-CE2 4.17Å; L825-F829 HydrophobicContact CG-CD2 4.29Å; L825-F829 HydrophobicContact CG-CE2 4.18Å; L825-F829 WeakPolarHBondContact O-CD2 3.02Å; L825-F829 PolarHBondContact O-N 3.42Å
830	L	87.3	Confident	86.7	Confident	5 Å²	5	47 Å²	47	3%	0.026	23%	0.227	C	C	.	.	S	Bend	trans	-63.2	148.4	-178.6	-78	173.4	0	0	0	112.9	A730 V775 S826 Y832	A730-L830 HydrophobicContact CB-CD2 3.9Å; V775-L830 HydrophobicContact CB-CD1 3.9Å; V775-L830 HydrophobicContact CG1-CD1 3.75Å; S826-L830 VanDerWaalsContact O-CB 3.24Å; S826-L830 WeakPolarHBondContact O-CB 3.18Å; S826-L830 VanDerWaalsContact O-CG 3.29Å; S826-L830 WeakPolarHBondContact O-CG 3.1Å; S826-L830 PolarHBondContact O-N 2.88Å; S826-L830 VanDerWaalsContact O-N 3.13Å; L830-Y832 VanDerWaalsContact O-CD2 3.32Å; L830-Y832 WeakPolarHBondContact O-CD2 3.06Å; L830-Y832 PolarHBondContact O-N 2.87Å
831	P	83.1	Confident	86.3	Confident	22 Å²	22	51.3 Å²	51.3	14%	0.143	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-66.3	132.3	172.2	29.1	-34.1	0	0	0	110.3	Y410 A730 Q779	Y410-P831 PolarHBondContact OH-O 3.02Å; A730-P831 HydrophobicContact CB-CG 4.37Å; Q779-P831 PolarHBondContact OE1-O 2.94Å
832	Y	77.8	Confident	85.9	Confident	44 Å²	44	59.9 Å²	59.9	17%	0.173	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-102.4	133.3	178.4	-76	-84.9	0	0	0	111.7	Q779 F827 L830 K843 I847	Q779-Y832 HydrophobicContact CG-CD1 4.4Å; Q779-Y832 HydrophobicContact CG-CE1 4.16Å; Q779-Y832 VanDerWaalsContact NE2-CE1 3.29Å; F827-Y832 WeakPolarHBondContact CA-OH 3.47Å; F827-Y832 WeakPolarHBondContact CD1-OH 3.2Å; F827-Y832 WeakPolarHBondContact O-CE2 3.02Å; F827-Y832 PolarHBondContact O-OH 2.96Å; L830-Y832 VanDerWaalsContact O-CD2 3.32Å; L830-Y832 WeakPolarHBondContact O-CD2 3.06Å; L830-Y832 PolarHBondContact O-N 2.87Å; Y832-K843 HydrophobicContact CD1-CD 3.87Å; Y832-K843 HydrophobicContact CD1-CG 4.3Å; Y832-K843 HydrophobicContact CE1-CD 4.09Å; Y832-K843 HydrophobicContact CG-CD 4.42Å; Y832-K843 HydrophobicContact CG-CG 4.38Å; Y832-I847 HydrophobicContact CD2-CD1 4.1Å; Y832-I847 HydrophobicContact CE2-CD1 3.85Å; Y832-I847 HydrophobicContact CE2-CG1 3.87Å
833	V	73.1	Confident	85.5	Confident	23 Å²	23	62.2 Å²	62.2	14%	0.139	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-74.8	139.6	157	-172.8	0	0	0	0	107.5	V431 Q434 F835	V431-V833 HydrophobicContact CG1-CG1 4.36Å; Q434-V833 HydrophobicContact CG-CG1 4.4Å; V833-F835 HydrophobicContact CB-CZ 4.48Å; V833-F835 HydrophobicContact CG1-CE1 3.56Å; V833-F835 HydrophobicContact CG1-CZ 3.73Å
834	S	73.9	Confident	85.2	Confident	15 Å²	15	67.8 Å²	67.8	11%	0.105	30%	0.302	C	S	.	.			trans	-142.6	131.9	-168.6	63	0	0	0	0	113	D839	S834-D839 VanDerWaalsContact CA-OD2 3.3Å; S834-D839 WeakPolarHBondContact CA-OD2 3.33Å
835	F	71.3	Confident	85	Confident	104 Å²	104	68.1 Å²	68.1	46%	0.456	31%	0.309	S	S	.	.			trans	-105.9	31.6	-168.8	-51.1	-54	0	0	0	114.4	V431 V833 D839	V431-F835 HydrophobicContact CB-CE1 4.22Å; V431-F835 HydrophobicContact CG1-CE1 3.9Å; V431-F835 HydrophobicContact CG1-CZ 4.16Å; V431-F835 HydrophobicContact CG2-CD1 4.11Å; V431-F835 HydrophobicContact CG2-CE1 3.53Å; V431-F835 HydrophobicContact CG2-CZ 4.26Å; V833-F835 HydrophobicContact CB-CZ 4.48Å; V833-F835 HydrophobicContact CG1-CE1 3.56Å; V833-F835 HydrophobicContact CG1-CZ 3.73Å; F835-D839 PolarHBondContact N-OD2 3.03Å
836	G	78.4	Confident	84.7	Confident	33 Å²	33	70.3 Å²	70.3	34%	0.34	32%	0.319	S	S	.	.	S	Bend	trans	139.9	180	172.3	0	0	0	0	0	114.3	M838 D839 L840	G836-M838 PolarHBondContact O-N 3.36Å; G836-D839 PolarHBondContact O-N 3.26Å; G836-L840 WeakPolarHBondContact O-CB 3.36Å; G836-L840 WeakPolarHBondContact O-CG 3.43Å; G836-L840 PolarHBondContact O-N 3.37Å
837	R	81.4	Confident	84.6	Confident	223 Å²	223	72.7 Å²	72.7	84%	0.842	33%	0.331	S	S	*	.	H	α-helix	trans	-61.8	-40.4	-178.4	-69.8	-177	179.1	172.2	-0.2	113.1	L840 Y841	R837-L840 PolarHBondContact O-N 2.86Å; R837-Y841 PolarHBondContact O-N 2.92Å; R837-Y841 VanDerWaalsContact O-N 3.09Å
838	M	82.8	Confident	84.6	Confident	151 Å²	151	76.5 Å²	76.5	74%	0.744	35%	0.351	S	S	*	.	H	α-helix	trans	-69.2	-39.8	177.9	-67.5	-64.7	99.7	0	0	112.3	G836 Y841 R842	G836-M838 PolarHBondContact O-N 3.36Å; M838-Y841 PolarHBondContact O-N 2.04Å; M838-R842 WeakPolarHBondContact O-CB 3.08Å; M838-R842 PolarHBondContact O-N 3.26Å
839	D	81.7	Confident	84.8	Confident	32 Å²	32	80 Å²	80	17%	0.171	37%	0.371	C	S	.	.	H	α-helix	trans	-66.2	-42.3	174.5	-173.3	44.5	0	0	0	111.1	S834 F835 G836 Y841 R842 K843	S834-D839 VanDerWaalsContact CA-OD2 3.3Å; S834-D839 WeakPolarHBondContact CA-OD2 3.33Å; F835-D839 PolarHBondContact N-OD2 3.03Å; G836-D839 PolarHBondContact O-N 3.26Å; D839-Y841 VanDerWaalsContact C-N 3.3Å; D839-Y841 PolarHBondContact O-N 2.98Å; D839-R842 CarbonylContact O-C 3.46Å; D839-R842 WeakPolarHBondContact O-CB 3.34Å; D839-R842 PolarHBondContact O-N 3.16Å; D839-R842 VanDerWaalsContact O-N 3.11Å; D839-K843 WeakPolarHBondContact O-CG 3.45Å; D839-K843 PolarHBondContact O-N 3.26Å; D839-K843 VanDerWaalsContact OD1-CE 3.24Å; D839-K843 WeakPolarHBondContact OD1-CE 3.35Å; D839-K843 IonicContact OD1-NZ 2.61Å
840	L	82.9	Confident	85	Confident	80 Å²	80	79.4 Å²	79.4	42%	0.419	37%	0.369	S	S	.	.	H	α-helix	trans	-55.6	-41.5	172	-78	168	0	0	0	112.9	G836 R837 R844	G836-L840 WeakPolarHBondContact O-CB 3.36Å; G836-L840 WeakPolarHBondContact O-CG 3.43Å; G836-L840 PolarHBondContact O-N 3.37Å; R837-L840 PolarHBondContact O-N 2.86Å; L840-R844 WeakPolarHBondContact O-CG 3.44Å; L840-R844 PolarHBondContact O-N 3.06Å
841	Y	87.7	Confident	85.3	Confident	157 Å²	157	82.7 Å²	82.7	62%	0.616	39%	0.386	S	S	*	.	H	α-helix	trans	-66.1	-45.4	174.3	-174	-102	0	0	0	111.7	R837 M838 D839 K843 R844 C845	R837-Y841 PolarHBondContact O-N 2.92Å; R837-Y841 VanDerWaalsContact O-N 3.09Å; M838-Y841 PolarHBondContact O-N 2.04Å; D839-Y841 VanDerWaalsContact C-N 3.3Å; D839-Y841 PolarHBondContact O-N 2.98Å; Y841-K843 PolarHBondContact O-N 2.99Å; Y841-R844 PolarHBondContact O-N 3.15Å; Y841-R844 VanDerWaalsContact O-N 3.17Å; Y841-C845 VanDerWaalsContact CE1-SG 3.52Å; Y841-C845 PolarHBondContact O-N 2.79Å; Y841-C845 PolarHBondContact O-SG 3.14Å
842	R	88.3	Confident	86	Confident	181 Å²	181	87.1 Å²	87.1	68%	0.683	41%	0.408	S	S	*	.	H	α-helix	trans	-58.3	-42.8	175.7	-170.6	179.3	-176.8	176.1	3.7	112.2	M838 D839 C845 Q846	M838-R842 WeakPolarHBondContact O-CB 3.08Å; M838-R842 PolarHBondContact O-N 3.26Å; D839-R842 CarbonylContact O-C 3.46Å; D839-R842 WeakPolarHBondContact O-CB 3.34Å; D839-R842 PolarHBondContact O-N 3.16Å; D839-R842 VanDerWaalsContact O-N 3.11Å; R842-C845 PolarHBondContact O-N 3.01Å; R842-Q846 WeakPolarHBondContact O-CB 3.46Å; R842-Q846 PolarHBondContact O-N 3.06Å
843	K	87.1	Confident	86.9	Confident	49 Å²	49	88 Å²	88	21%	0.213	42%	0.418	C	S	.	.	H	α-helix	trans	-65.7	-39.4	175.2	-62.1	-48.7	176.6	-170.4	0	112.3	Y832 D839 Y841 Q846 I847	Y832-K843 HydrophobicContact CD1-CD 3.87Å; Y832-K843 HydrophobicContact CD1-CG 4.3Å; Y832-K843 HydrophobicContact CE1-CD 4.09Å; Y832-K843 HydrophobicContact CG-CD 4.42Å; Y832-K843 HydrophobicContact CG-CG 4.38Å; D839-K843 WeakPolarHBondContact O-CG 3.45Å; D839-K843 PolarHBondContact O-N 3.26Å; D839-K843 VanDerWaalsContact OD1-CE 3.24Å; D839-K843 WeakPolarHBondContact OD1-CE 3.35Å; D839-K843 IonicContact OD1-NZ 2.61Å; Y841-K843 PolarHBondContact O-N 2.99Å; K843-Q846 WeakPolarHBondContact O-CB 3.35Å; K843-Q846 PolarHBondContact O-N 3.36Å; K843-I847 WeakPolarHBondContact O-CD1 3.44Å; K843-I847 VanDerWaalsContact O-CG1 3.27Å; K843-I847 WeakPolarHBondContact O-CG1 3.35Å; K843-I847 PolarHBondContact O-N 2.83Å
844	R	89.7	Confident	88	Confident	172 Å²	172	87.7 Å²	87.7	65%	0.649	41%	0.414	S	S	*	.	H	α-helix	trans	-62.2	-45.3	174.3	-74.9	174.7	178.4	-164.6	-1.1	111.8	L840 Y841 Q846 I847 I848	L840-R844 WeakPolarHBondContact O-CG 3.44Å; L840-R844 PolarHBondContact O-N 3.06Å; Y841-R844 PolarHBondContact O-N 3.15Å; Y841-R844 VanDerWaalsContact O-N 3.17Å; R844-Q846 PolarHBondContact O-N 2.89Å; R844-I847 PolarHBondContact O-N 2.93Å; R844-I848 WeakPolarHBondContact O-CG1 3.4Å; R844-I848 PolarHBondContact O-N 3.38Å
845	C	91.8	Very high	89.1	Confident	46 Å²	46	90.8 Å²	90.8	31%	0.311	43%	0.432	S	S	.	.	H	α-helix	trans	-61.4	-44.1	174.6	-60.8	0	0	0	0	111.4	Y841 R842 I847 I848 V849	Y841-C845 VanDerWaalsContact CE1-SG 3.52Å; Y841-C845 PolarHBondContact O-N 2.79Å; Y841-C845 PolarHBondContact O-SG 3.14Å; R842-C845 PolarHBondContact O-N 3.01Å; C845-I847 PolarHBondContact O-N 2.84Å; C845-I848 PolarHBondContact O-N 3.44Å; C845-V849 WeakPolarHBondContact O-CG2 3.48Å; C845-V849 PolarHBondContact O-N 3.12Å
846	Q	89.9	Confident	90.3	Very high	48 Å²	48	87.7 Å²	87.7	22%	0.224	43%	0.43	C	S	.	.	H	α-helix	trans	-58.4	-44.3	176.1	-177.1	176.1	-3.5	0	0	112.3	F827 R842 K843 R844 F850	F827-Q846 VanDerWaalsContact CD1-NE2 3.32Å; R842-Q846 WeakPolarHBondContact O-CB 3.46Å; R842-Q846 PolarHBondContact O-N 3.06Å; K843-Q846 WeakPolarHBondContact O-CB 3.35Å; K843-Q846 PolarHBondContact O-N 3.36Å; R844-Q846 PolarHBondContact O-N 2.89Å; Q846-F850 HydrophobicContact CG-CD2 3.72Å; Q846-F850 HydrophobicContact CG-CE2 3.65Å; Q846-F850 VanDerWaalsContact O-CD2 3.24Å; Q846-F850 WeakPolarHBondContact O-CD2 3.35Å; Q846-F850 PolarHBondContact O-N 3.31Å
847	I	91.9	Very high	91.1	Very high	50 Å²	50	88.6 Å²	88.6	26%	0.256	43%	0.427	S	S	.	.	H	α-helix	trans	-61.4	-47.2	176	-72.2	161.7	0	0	0	111	Y832 K843 R844 C845 F850 L851	Y832-I847 HydrophobicContact CD2-CD1 4.1Å; Y832-I847 HydrophobicContact CE2-CD1 3.85Å; Y832-I847 HydrophobicContact CE2-CG1 3.87Å; K843-I847 WeakPolarHBondContact O-CD1 3.44Å; K843-I847 VanDerWaalsContact O-CG1 3.27Å; K843-I847 WeakPolarHBondContact O-CG1 3.35Å; K843-I847 PolarHBondContact O-N 2.83Å; R844-I847 PolarHBondContact O-N 2.93Å; C845-I847 PolarHBondContact O-N 2.84Å; I847-F850 PolarHBondContact O-N 2.95Å; I847-L851 VanDerWaalsContact O-CB 3.3Å; I847-L851 WeakPolarHBondContact O-CB 3.34Å; I847-L851 PolarHBondContact O-N 3.45Å
848	I	94	Very high	91.8	Very high	100 Å²	100	81.1 Å²	81.1	51%	0.513	40%	0.4	S	S	.	.	H	α-helix	trans	-62.8	-46.3	-179.7	-67.2	164.4	0	0	0	110.7	R844 C845 L851 L852	R844-I848 WeakPolarHBondContact O-CG1 3.4Å; R844-I848 PolarHBondContact O-N 3.38Å; C845-I848 PolarHBondContact O-N 3.44Å; I848-L851 PolarHBondContact O-N 2.65Å; I848-L852 HydrophobicContact CG2-CD1 3.97Å; I848-L852 HydrophobicContact CG2-CG 4.47Å; I848-L852 WeakPolarHBondContact O-CG 3.43Å; I848-L852 PolarHBondContact O-N 3.4Å
849	V	95.3	Very high	92.4	Very high	83 Å²	83	76.7 Å²	76.7	50%	0.503	38%	0.384	S	S	.	.	H	α-helix	trans	-61.2	-47.8	178.8	170.7	0	0	0	0	111.3	C845 L851 L852 V853	C845-V849 WeakPolarHBondContact O-CG2 3.48Å; C845-V849 PolarHBondContact O-N 3.12Å; V849-L851 VanDerWaalsContact C-N 3.34Å; V849-L851 PolarHBondContact O-N 2.88Å; V849-L852 PolarHBondContact O-N 3.23Å; V849-V853 WeakPolarHBondContact O-CG2 3.37Å; V849-V853 PolarHBondContact O-N 3.22Å
850	F	94.9	Very high	93	Very high	49 Å²	49	77 Å²	77	22%	0.215	40%	0.395	C	S	.	.	H	α-helix	trans	-69.9	-29.1	179.3	-75.3	-57	0	0	0	113.7	F824 F827 Q846 I847 F854	F824-F850 AromaticContact CD1-CD1 3.51Å; F824-F850 HydrophobicContact CD1-CD1 3.51Å; F824-F850 AromaticContact CD1-CE1 3.88Å; F824-F850 HydrophobicContact CD1-CE1 3.88Å; F824-F850 HydrophobicContact CE1-CD1 4.01Å; F824-F850 AromaticContact CE1-CE1 3.99Å; F824-F850 HydrophobicContact CE1-CE1 3.99Å; F827-F850 HydrophobicContact CB-CB 4.11Å; F827-F850 HydrophobicContact CB-CD2 3.5Å; F827-F850 VanDerWaalsContact CB-CD2 3.5Å; F827-F850 HydrophobicContact CB-CE2 4.07Å; F827-F850 HydrophobicContact CB-CG 3.89Å; F827-F850 HydrophobicContact CD1-CD2 4.37Å; F827-F850 HydrophobicContact CD1-CE2 4.15Å; F827-F850 HydrophobicContact CD2-CD2 4.43Å; F827-F850 HydrophobicContact CD2-CE2 4.26Å; F827-F850 HydrophobicContact CD2-CZ 4.45Å; F827-F850 AromaticContact CG-CD2 3.88Å; F827-F850 HydrophobicContact CG-CD2 3.88Å; F827-F850 AromaticContact CG-CE2 3.91Å; F827-F850 HydrophobicContact CG-CE2 3.91Å; F827-F850 HydrophobicContact CG-CG 4.48Å; Q846-F850 HydrophobicContact CG-CD2 3.72Å; Q846-F850 HydrophobicContact CG-CE2 3.65Å; Q846-F850 VanDerWaalsContact O-CD2 3.24Å; Q846-F850 WeakPolarHBondContact O-CD2 3.35Å; Q846-F850 PolarHBondContact O-N 3.31Å; I847-F850 PolarHBondContact O-N 2.95Å; F850-F854 PolarHBondContact O-N 2.93Å
851	L	95.1	Very high	93.5	Very high	74 Å²	74	74.2 Å²	74.2	39%	0.387	38%	0.381	S	S	.	.	H	α-helix	trans	-67.3	-43	171.4	-175	63.6	0	0	0	111.5	A828 I847 I848 V849 F854 V855	A828-L851 HydrophobicContact CB-CB 4.49Å; I847-L851 VanDerWaalsContact O-CB 3.3Å; I847-L851 WeakPolarHBondContact O-CB 3.34Å; I847-L851 PolarHBondContact O-N 3.45Å; I848-L851 PolarHBondContact O-N 2.65Å; V849-L851 VanDerWaalsContact C-N 3.34Å; V849-L851 PolarHBondContact O-N 2.88Å; L851-F854 PolarHBondContact O-N 3.23Å; L851-V855 WeakPolarHBondContact O-CG2 2.99Å; L851-V855 PolarHBondContact O-N 3.05Å
852	L	96.4	Very high	93.7	Very high	116 Å²	116	69 Å²	69	61%	0.607	37%	0.365	S	S	*	.	H	α-helix	trans	-63.9	-41.8	174.9	-71.1	170.8	0	0	0	112.1	I848 V849 V855 G856	I848-L852 HydrophobicContact CG2-CD1 3.97Å; I848-L852 HydrophobicContact CG2-CG 4.47Å; I848-L852 WeakPolarHBondContact O-CG 3.43Å; I848-L852 PolarHBondContact O-N 3.4Å; V849-L852 PolarHBondContact O-N 3.23Å; L852-V855 PolarHBondContact O-N 3.04Å; L852-G856 PolarHBondContact O-N 3.22Å
853	V	96.7	Very high	94	Very high	63 Å²	63	64.2 Å²	64.2	38%	0.382	36%	0.356	S	S	.	.	H	α-helix	trans	-61.7	-43.1	174.4	169.1	0	0	0	0	111.3	F824 V849 G856 L857	F824-V853 HydrophobicContact CD1-CG1 4.24Å; F824-V853 HydrophobicContact CD2-CG1 4.1Å; F824-V853 HydrophobicContact CE1-CG1 4.02Å; F824-V853 HydrophobicContact CE2-CG1 3.87Å; F824-V853 HydrophobicContact CG-CG1 4.28Å; F824-V853 HydrophobicContact CZ-CG1 3.82Å; V849-V853 WeakPolarHBondContact O-CG2 3.37Å; V849-V853 PolarHBondContact O-N 3.22Å; V853-G856 PolarHBondContact O-N 3.04Å; V853-L857 WeakPolarHBondContact O-CB 3.45Å; V853-L857 PolarHBondContact O-N 3.03Å
854	F	96.6	Very high	94.2	Very high	15 Å²	15	63.8 Å²	63.8	7%	0.066	36%	0.356	C	S	.	.	H	α-helix	trans	-63.2	-46.8	174.4	169.4	-108.8	0	0	0	112.3	L741 T745 F824 L825 F850 L851 G856 L857 F858	L741-F854 HydrophobicContact CB-CZ 4.37Å; L741-F854 HydrophobicContact CD1-CE1 4.46Å; T745-F854 HydrophobicContact CG2-CE2 4.46Å; F824-F854 HydrophobicContact CB-CB 4.22Å; L825-F854 HydrophobicContact CD1-CB 4.19Å; L825-F854 HydrophobicContact CD1-CD1 3.67Å; L825-F854 HydrophobicContact CD1-CD2 3.27Å; L825-F854 HydrophobicContact CD1-CE1 3.85Å; L825-F854 HydrophobicContact CD1-CE2 3.47Å; L825-F854 VanDerWaalsContact CD1-CE2 3.47Å; L825-F854 HydrophobicContact CD1-CG 3.37Å; L825-F854 HydrophobicContact CD1-CZ 3.76Å; L825-F854 HydrophobicContact CG-CD1 4.48Å; L825-F854 HydrophobicContact CG-CG 4.48Å; F850-F854 PolarHBondContact O-N 2.93Å; L851-F854 PolarHBondContact O-N 3.23Å; F854-G856 VanDerWaalsContact C-N 3.31Å; F854-G856 PolarHBondContact O-N 3.21Å; F854-L857 PolarHBondContact O-N 3.07Å; F854-F858 HydrophobicContact CE2-CB 4.12Å; F854-F858 HydrophobicContact CZ-CB 4.02Å; F854-F858 HydrophobicContact CZ-CD2 4.21Å; F854-F858 HydrophobicContact CZ-CG 4.24Å; F854-F858 WeakPolarHBondContact O-CB 3.37Å; F854-F858 PolarHBondContact O-N 2.9Å
855	V	96.5	Very high	94.2	Very high	80 Å²	80	55.8 Å²	55.8	49%	0.485	33%	0.326	S	S	.	.	H	α-helix	trans	-61	-42	179.4	170	0	0	0	0	110.8	L851 L852 F858 S859	L851-V855 WeakPolarHBondContact O-CG2 2.99Å; L851-V855 PolarHBondContact O-N 3.05Å; L852-V855 PolarHBondContact O-N 3.04Å; V855-F858 PolarHBondContact O-N 3.13Å; V855-S859 WeakPolarHBondContact O-CB 3.38Å; V855-S859 PolarHBondContact O-N 2.79Å; V855-S859 PolarHBondContact O-OG 3.31Å
856	G	96.8	Very high	94	Very high	39 Å²	39	59.9 Å²	59.9	40%	0.402	34%	0.336	S	S	.	.	H	α-helix	trans	-63.6	-41.7	175.2	0	0	0	0	0	113.6	L852 V853 F854 S859 G860	L852-G856 PolarHBondContact O-N 3.22Å; V853-G856 PolarHBondContact O-N 3.04Å; F854-G856 VanDerWaalsContact C-N 3.31Å; F854-G856 PolarHBondContact O-N 3.21Å; G856-S859 WeakPolarHBondContact CA-OG 3.03Å; G856-S859 PolarHBondContact O-OG 2.92Å; G856-G860 PolarHBondContact O-N 2.87Å
857	L	95.6	Very high	93.8	Very high	53 Å²	53	61.7 Å²	61.7	28%	0.277	35%	0.35	S	S	.	.	H	α-helix	trans	-64.1	-45	174.6	-179.1	151.7	0	0	0	111.3	T745 I820 F824 V853 F854 G860 L861	T745-L857 HydrophobicContact CG2-CD2 3.78Å; I820-L857 HydrophobicContact CG2-CD1 3.83Å; F824-L857 HydrophobicContact CD2-CD1 4.46Å; F824-L857 HydrophobicContact CE2-CD1 4.09Å; V853-L857 WeakPolarHBondContact O-CB 3.45Å; V853-L857 PolarHBondContact O-N 3.03Å; F854-L857 PolarHBondContact O-N 3.07Å; L857-G860 PolarHBondContact O-N 3.21Å; L857-L861 HydrophobicContact CD2-CD1 3.79Å; L857-L861 WeakPolarHBondContact O-CG 3.38Å; L857-L861 PolarHBondContact O-N 2.97Å
858	F	95.8	Very high	93.2	Very high	65 Å²	65	66.8 Å²	66.8	29%	0.285	37%	0.367	S	S	.	.	H	α-helix	trans	-66	-47.1	179.1	-175.2	-99.3	0	0	0	111.7	I744 T745 L748 F854 V855 G860 L861 V862	I744-F858 HydrophobicContact CG2-CE2 4.11Å; I744-F858 HydrophobicContact CG2-CZ 4.4Å; T745-F858 HydrophobicContact CG2-CD2 4.31Å; L748-F858 HydrophobicContact CD2-CD2 4.44Å; L748-F858 HydrophobicContact CD2-CE2 4.07Å; F854-F858 HydrophobicContact CE2-CB 4.12Å; F854-F858 HydrophobicContact CZ-CB 4.02Å; F854-F858 HydrophobicContact CZ-CD2 4.21Å; F854-F858 HydrophobicContact CZ-CG 4.24Å; F854-F858 WeakPolarHBondContact O-CB 3.37Å; F854-F858 PolarHBondContact O-N 2.9Å; V855-F858 PolarHBondContact O-N 3.13Å; F858-G860 VanDerWaalsContact C-N 3.3Å; F858-G860 PolarHBondContact O-N 3.43Å; F858-L861 PolarHBondContact O-N 2.72Å; F858-V862 HydrophobicContact CD1-CG2 4.26Å; F858-V862 HydrophobicContact CE1-CG2 3.89Å; F858-V862 HydrophobicContact CZ-CG2 4.13Å; F858-V862 WeakPolarHBondContact O-CG2 3.47Å; F858-V862 PolarHBondContact O-N 3.21Å
859	S	95.2	Very high	92.1	Very high	58 Å²	58	65.2 Å²	65.2	41%	0.406	36%	0.363	S	S	.	.	H	α-helix	trans	-64.3	-35.5	175.8	60.7	0	0	0	0	112.3	V855 G856 V862 V863	V855-S859 WeakPolarHBondContact O-CB 3.38Å; V855-S859 PolarHBondContact O-N 2.79Å; V855-S859 PolarHBondContact O-OG 3.31Å; G856-S859 WeakPolarHBondContact CA-OG 3.03Å; G856-S859 PolarHBondContact O-OG 2.92Å; S859-V862 PolarHBondContact O-N 3.3Å; S859-V863 WeakPolarHBondContact O-CG2 3.22Å; S859-V863 PolarHBondContact O-N 2.03Å
860	G	94.4	Very high	91	Very high	39 Å²	39	64.9 Å²	64.9	40%	0.402	36%	0.358	S	S	.	.	H	α-helix	trans	-60.7	-46.4	173.9	0	0	0	0	0	112.2	G856 L857 F858 V863 L864	G856-G860 PolarHBondContact O-N 2.87Å; L857-G860 PolarHBondContact O-N 3.21Å; F858-G860 VanDerWaalsContact C-N 3.3Å; F858-G860 PolarHBondContact O-N 3.43Å; G860-V863 PolarHBondContact O-N 3.05Å; G860-L864 VanDerWaalsContact O-CB 3.31Å; G860-L864 WeakPolarHBondContact O-CB 3.02Å; G860-L864 PolarHBondContact O-N 2.84Å
861	L	93.4	Very high	89.6	Confident	21 Å²	21	69.3 Å²	69.3	11%	0.11	38%	0.377	C	S	.	.	H	α-helix	trans	-64.1	-39	174.3	-70.8	171.1	0	0	0	112.4	T745 L748 A749 I752 L857 F858 L864 F865	T745-L861 HydrophobicContact CG2-CD1 3.68Å; L748-L861 HydrophobicContact CD2-CB 3.68Å; L748-L861 HydrophobicContact CG-CB 4.11Å; A749-L861 HydrophobicContact CB-CD1 4.49Å; A749-L861 HydrophobicContact CB-CD2 4.4Å; I752-L861 HydrophobicContact CD1-CB 4.3Å; I752-L861 HydrophobicContact CD1-CD2 3.91Å; I752-L861 WeakPolarHBondContact CD1-O 3.21Å; L857-L861 HydrophobicContact CD2-CD1 3.79Å; L857-L861 WeakPolarHBondContact O-CG 3.38Å; L857-L861 PolarHBondContact O-N 2.97Å; F858-L861 PolarHBondContact O-N 2.72Å; L861-L864 PolarHBondContact O-N 3.15Å; L861-F865 WeakPolarHBondContact O-CB 3.3Å; L861-F865 PolarHBondContact O-N 2.84Å
862	V	93.3	Very high	88.4	Confident	47 Å²	47	67.8 Å²	67.8	29%	0.285	37%	0.372	S	S	.	.	H	α-helix	trans	-63	-48.2	175.6	172.1	0	0	0	0	111	L748 F858 S859 L864 F865 Y866	L748-V862 HydrophobicContact CD2-CG2 3.68Å; F858-V862 HydrophobicContact CD1-CG2 4.26Å; F858-V862 HydrophobicContact CE1-CG2 3.89Å; F858-V862 HydrophobicContact CZ-CG2 4.13Å; F858-V862 WeakPolarHBondContact O-CG2 3.47Å; F858-V862 PolarHBondContact O-N 3.21Å; S859-V862 PolarHBondContact O-N 3.3Å; V862-L864 VanDerWaalsContact C-N 3.29Å; V862-L864 PolarHBondContact O-N 2.94Å; V862-F865 PolarHBondContact O-N 3.34Å; V862-Y866 HydrophobicContact CG1-CD2 3.93Å; V862-Y866 HydrophobicContact CG1-CE2 3.88Å; V862-Y866 WeakPolarHBondContact O-CD2 3.49Å; V862-Y866 PolarHBondContact O-N 3.17Å
863	V	93.1	Very high	87	Confident	82 Å²	82	68.6 Å²	68.6	50%	0.497	38%	0.377	S	S	.	.	H	α-helix	trans	-60	-40.8	176	170.8	0	0	0	0	111.1	S859 G860 V867	S859-V863 WeakPolarHBondContact O-CG2 3.22Å; S859-V863 PolarHBondContact O-N 2.03Å; G860-V863 PolarHBondContact O-N 3.05Å; V863-V867 HydrophobicContact CG1-CG2 4.21Å; V863-V867 VanDerWaalsContact O-CB 3.32Å; V863-V867 WeakPolarHBondContact O-CB 3.47Å; V863-V867 WeakPolarHBondContact O-CG2 3.41Å; V863-V867 PolarHBondContact O-N 3.23Å
864	L	91	Very high	85.9	Confident	40 Å²	40	75.2 Å²	75.2	21%	0.209	40%	0.395	C	S	.	.	H	α-helix	trans	-61.7	-45.3	177.8	-168.5	66.3	0	0	0	112	I752 G860 L861 V862 Y866 Y868 I870	I752-L864 HydrophobicContact CD1-CB 4.27Å; I752-L864 HydrophobicContact CD1-CD2 4.18Å; I752-L864 HydrophobicContact CD1-CG 4.38Å; I752-L864 HydrophobicContact CG2-CD2 4Å; I752-L864 HydrophobicContact CG2-CG 4.14Å; G860-L864 VanDerWaalsContact O-CB 3.31Å; G860-L864 WeakPolarHBondContact O-CB 3.02Å; G860-L864 PolarHBondContact O-N 2.84Å; L861-L864 PolarHBondContact O-N 3.15Å; V862-L864 VanDerWaalsContact C-N 3.29Å; V862-L864 PolarHBondContact O-N 2.94Å; L864-Y866 PolarHBondContact O-N 2.91Å; L864-Y868 WeakPolarHBondContact CD1-O 3.29Å; L864-Y868 CarbonylContact O-C 3.58Å; L864-Y868 VanDerWaalsContact O-C 3.28Å; L864-Y868 PolarHBondContact O-N 3.21Å; L864-Y868 VanDerWaalsContact O-N 3.11Å; L864-Y868 VanDerWaalsContact O-O 3.12Å; L864-I870 HydrophobicContact CD1-CD1 3.9Å; L864-I870 HydrophobicContact CD1-CG1 3.91Å; L864-I870 HydrophobicContact CD2-CD1 3.89Å; L864-I870 HydrophobicContact CD2-CG1 4.46Å; L864-I870 HydrophobicContact CG-CD1 4.33Å; L864-I870 HydrophobicContact CG-CG1 4.41Å
865	F	90.3	Very high	84.7	Confident	4 Å²	4	75 Å²	75	2%	0.018	40%	0.395	C	S	.	.	H	α-helix	trans	-59.7	-43.4	179.6	-179.7	-95.2	0	0	0	113.7	M518 R519 F696 L748 A751 I752 L861 V862	M518-F865 HydrophobicContact CB-CE1 4.48Å; M518-F865 HydrophobicContact CB-CZ 3.86Å; M518-F865 HydrophobicContact CE-CE2 4.37Å; M518-F865 HydrophobicContact CE-CZ 4.3Å; R519-F865 HydrophobicContact CB-CE1 3.77Å; R519-F865 HydrophobicContact CB-CZ 3.93Å; R519-F865 VanDerWaalsContact CD-CZ 3.5Å; R519-F865 WeakPolarHBondContact CD-O 3.49Å; R519-F865 HydrophobicContact CG-CE1 3.87Å; R519-F865 HydrophobicContact CG-CE2 4.21Å; R519-F865 HydrophobicContact CG-CZ 3.56Å; R519-F865 PolarHBondContact NH1-O 2.74Å; R519-F865 VanDerWaalsContact NH1-O 3.09Å; F696-F865 HydrophobicContact CE1-CD1 4.33Å; F696-F865 AromaticContact CE1-CE1 3.7Å; F696-F865 HydrophobicContact CE1-CE1 3.7Å; F696-F865 HydrophobicContact CZ-CE1 4.33Å; L748-F865 HydrophobicContact CD1-CB 3.92Å; L748-F865 HydrophobicContact CD1-CD2 4.09Å; L748-F865 HydrophobicContact CD1-CG 3.95Å; A751-F865 HydrophobicContact CB-CD2 4.21Å; A751-F865 HydrophobicContact CB-CE2 3.77Å; I752-F865 HydrophobicContact CD1-CB 4.14Å; I752-F865 HydrophobicContact CG1-CB 3.89Å; I752-F865 HydrophobicContact CG1-CD2 3.91Å; I752-F865 HydrophobicContact CG1-CG 4.42Å; L861-F865 WeakPolarHBondContact O-CB 3.3Å; L861-F865 PolarHBondContact O-N 2.84Å; V862-F865 PolarHBondContact O-N 3.34Å
866	Y	87.8	Confident	83.4	Confident	132 Å²	132	75.3 Å²	75.3	52%	0.518	39%	0.392	S	S	.	.	H	α-helix	trans	-82.9	-41.1	-178.7	-76.6	-78.7	0	0	0	113.8	F696 V862 L864	F696-Y866 AromaticContact CE1-CE1 3.98Å; F696-Y866 HydrophobicContact CE1-CE1 3.98Å; F696-Y866 HydrophobicContact CE1-CE2 4.22Å; F696-Y866 AromaticContact CE1-CZ 3.53Å; F696-Y866 WeakPolarHBondContact CE1-OH 3.47Å; F696-Y866 HydrophobicContact CE2-CE1 4.29Å; F696-Y866 WeakPolarHBondContact CE2-OH 3.16Å; F696-Y866 AromaticContact CZ-CE1 3.43Å; F696-Y866 HydrophobicContact CZ-CE1 3.43Å; F696-Y866 VanDerWaalsContact CZ-CE1 3.43Å; F696-Y866 HydrophobicContact CZ-CE2 4.43Å; F696-Y866 AromaticContact CZ-CZ 3.36Å; F696-Y866 WeakPolarHBondContact CZ-OH 3.29Å; V862-Y866 HydrophobicContact CG1-CD2 3.93Å; V862-Y866 HydrophobicContact CG1-CE2 3.88Å; V862-Y866 WeakPolarHBondContact O-CD2 3.49Å; V862-Y866 PolarHBondContact O-N 3.17Å; L864-Y866 PolarHBondContact O-N 2.91Å
867	V	85.8	Confident	82.2	Confident	86 Å²	86	77.4 Å²	77.4	52%	0.521	39%	0.393	S	S	.	.	H	α-helix	trans	-101.5	-35.7	-165.3	-172.1	0	0	0	0	113.1	V863	V863-V867 HydrophobicContact CG1-CG2 4.21Å; V863-V867 VanDerWaalsContact O-CB 3.32Å; V863-V867 WeakPolarHBondContact O-CB 3.47Å; V863-V867 WeakPolarHBondContact O-CG2 3.41Å; V863-V867 PolarHBondContact O-N 3.23Å
868	Y	79.7	Confident	81.2	Confident	156 Å²	156	78.6 Å²	78.6	61%	0.612	40%	0.399	S	S	*	.			trans	-134.6	78.7	-168.4	-68.3	-68.9	0	0	0	111.7	L864 I870	L864-Y868 WeakPolarHBondContact CD1-O 3.29Å; L864-Y868 CarbonylContact O-C 3.58Å; L864-Y868 VanDerWaalsContact O-C 3.28Å; L864-Y868 PolarHBondContact O-N 3.21Å; L864-Y868 VanDerWaalsContact O-N 3.11Å; L864-Y868 VanDerWaalsContact O-O 3.12Å; Y868-I870 PolarHBondContact O-N 3.43Å
869	P	71.1	Confident	80.1	Confident	67 Å²	67	75.5 Å²	75.5	44%	0.435	39%	0.385	S	S	.	.			trans	-59.9	107.4	171.1	22.7	-31.3	0	0	0	111.2	K871	P869-K871 PolarHBondContact O-N 2.58Å
870	I	70.7	Confident	79.1	Confident	77 Å²	77	73.1 Å²	73.1	40%	0.395	37%	0.368	S	S	.	.			trans	-75.1	108.8	174.3	-49	-176.2	0	0	0	108.9	F753 L864 Y868 C872	F753-I870 HydrophobicContact CE1-CD1 4.17Å; L864-I870 HydrophobicContact CD1-CD1 3.9Å; L864-I870 HydrophobicContact CD1-CG1 3.91Å; L864-I870 HydrophobicContact CD2-CD1 3.89Å; L864-I870 HydrophobicContact CD2-CG1 4.46Å; L864-I870 HydrophobicContact CG-CD1 4.33Å; L864-I870 HydrophobicContact CG-CG1 4.41Å; Y868-I870 PolarHBondContact O-N 3.43Å; I870-C872 HydrophobicContact CG2-CB 3.91Å; I870-C872 PolarHBondContact O-N 3.33Å
871	K	67.5	Low	78.2	Confident	141 Å²	141	74.5 Å²	74.5	61%	0.613	37%	0.366	S	S	*	.			trans	-77.1	113.4	161.3	-64.8	171.2	-175.1	169.9	0	106.7	E522 P869	E522-K871 IonicContact OE2-NZ 2.78Å; E522-K871 PolarHBondContact OE2-NZ 3.43Å; P869-K871 PolarHBondContact O-N 2.58Å
872	C	68.7	Low	77.2	Confident	43 Å²	43	77.3 Å²	77.3	29%	0.291	39%	0.386	S	S	.	.			trans	-133.7	89.4	-168.7	179.5	0	0	0	0	110.8	I870 W874 C875	I870-C872 HydrophobicContact CG2-CB 3.91Å; I870-C872 PolarHBondContact O-N 3.33Å; C872-W874 VanDerWaalsContact C-N 3.25Å; C872-W874 PolarHBondContact O-N 2.99Å; C872-C875 HydrophobicContact CB-CB 3.66Å; C872-C875 WeakPolarHBondContact CB-SG 3.45Å; C872-C875 VanDerWaalsContact O-CB 3.31Å; C872-C875 WeakPolarHBondContact O-CB 3.45Å; C872-C875 PolarHBondContact O-N 3.45Å; C872-C875 WeakPolarHBondContact SG-CB 3.44Å; C872-C875 PolarHBondContact SG-N 2.9Å; C872-C875 CovalentContact SG-SG 2.04Å; C872-C875 PolarHBondContact SG-SG 3.41Å
873	D	68	Low	76	Confident	132 Å²	132	81.7 Å²	81.7	71%	0.706	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-63.7	-33.2	-174	-46.7	-58.3	0	0	0	112.3	C875	D873-C875 VanDerWaalsContact C-N 3.31Å; D873-C875 PolarHBondContact O-N 3.29Å
874	W	72.8	Confident	74.8	Confident	203 Å²	203	81.7 Å²	81.7	77%	0.769	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-74.5	-15.4	175.7	-61.7	98.2	0	0	0	114.3	C872 E876 L877	C872-W874 VanDerWaalsContact C-N 3.25Å; C872-W874 PolarHBondContact O-N 2.99Å; W874-E876 VanDerWaalsContact C-N 3.3Å; W874-E876 PolarHBondContact O-N 3.46Å; W874-L877 HydrophobicContact CE3-CD1 4.26Å; W874-L877 PolarHBondContact O-N 3.01Å
875	C	72.1	Confident	73.4	Confident	10 Å²	10	87.3 Å²	87.3	7%	0.068	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-69.9	-28.6	-178.2	-74.2	0	0	0	0	112.1	F813 C872 D873 L877 I878	F813-C875 HydrophobicContact CE1-CB 4.48Å; F813-C875 HydrophobicContact CE2-CB 4.15Å; F813-C875 WeakPolarHBondContact CE2-O 3.39Å; F813-C875 HydrophobicContact CZ-CB 3.59Å; F813-C875 WeakPolarHBondContact CZ-O 3.46Å; C872-C875 HydrophobicContact CB-CB 3.66Å; C872-C875 WeakPolarHBondContact CB-SG 3.45Å; C872-C875 VanDerWaalsContact O-CB 3.31Å; C872-C875 WeakPolarHBondContact O-CB 3.45Å; C872-C875 PolarHBondContact O-N 3.45Å; C872-C875 WeakPolarHBondContact SG-CB 3.44Å; C872-C875 PolarHBondContact SG-N 2.9Å; C872-C875 CovalentContact SG-SG 2.04Å; C872-C875 PolarHBondContact SG-SG 3.41Å; D873-C875 VanDerWaalsContact C-N 3.31Å; D873-C875 PolarHBondContact O-N 3.29Å; C875-L877 VanDerWaalsContact C-N 3.26Å; C875-L877 PolarHBondContact O-N 2.9Å; C875-I878 WeakPolarHBondContact O-CB 3.45Å; C875-I878 PolarHBondContact O-N 3.43Å; C875-I878 VanDerWaalsContact O-N 3.14Å
876	E	67.9	Low	72	Confident	87 Å²	87	94.8 Å²	94.8	41%	0.407	46%	0.464	S	S	.	.	H	α-helix	trans	-59.8	-36.8	176.4	-67	-176.5	158.8	0	0	112.1	W874 I878 T879 C880 K890	W874-E876 VanDerWaalsContact C-N 3.3Å; W874-E876 PolarHBondContact O-N 3.46Å; E876-I878 VanDerWaalsContact C-N 3.26Å; E876-I878 PolarHBondContact O-N 3.19Å; E876-T879 PolarHBondContact O-N 2.71Å; E876-T879 VanDerWaalsContact O-N 3.07Å; E876-C880 PolarHBondContact O-N 3.12Å; E876-K890 IonicContact OE1-NZ 3.61Å; E876-K890 PolarHBondContact OE1-NZ 2.84Å; E876-K890 IonicContact OE2-NZ 3.76Å; E876-K890 PolarHBondContact OE2-NZ 3.26Å
877	L	71.7	Confident	70.7	Confident	82 Å²	82	91.6 Å²	91.6	43%	0.429	45%	0.453	S	S	.	.	H	α-helix	trans	-69.1	-20.3	179.3	-68.3	91.3	0	0	0	113.6	W874 C875 T879	W874-L877 HydrophobicContact CE3-CD1 4.26Å; W874-L877 PolarHBondContact O-N 3.01Å; C875-L877 VanDerWaalsContact C-N 3.26Å; C875-L877 PolarHBondContact O-N 2.9Å; L877-T879 VanDerWaalsContact C-N 3.29Å
878	I	75.8	Confident	69.8	Low	78 Å²	78	88.8 Å²	88.8	40%	0.4	44%	0.437	S	S	.	.	H	α-helix	trans	-74	-26.5	173.8	-62.5	175.3	0	0	0	110.5	N812 F813 I816 C875 E876	N812-I878 HydrophobicContact CB-CG2 4.48Å; N812-I878 PolarHBondContact ND2-O 3.36Å; F813-I878 HydrophobicContact CE1-CD1 4.31Å; F813-I878 HydrophobicContact CE1-CG2 4.32Å; F813-I878 HydrophobicContact CE2-CB 4.24Å; F813-I878 HydrophobicContact CE2-CG2 4.35Å; F813-I878 HydrophobicContact CZ-CB 3.85Å; F813-I878 HydrophobicContact CZ-CD1 4.05Å; F813-I878 HydrophobicContact CZ-CG1 4.48Å; F813-I878 HydrophobicContact CZ-CG2 3.97Å; I816-I878 HydrophobicContact CD1-CG2 4.28Å; C875-I878 WeakPolarHBondContact O-CB 3.45Å; C875-I878 PolarHBondContact O-N 3.43Å; C875-I878 VanDerWaalsContact O-N 3.14Å; E876-I878 VanDerWaalsContact C-N 3.26Å; E876-I878 PolarHBondContact O-N 3.19Å
879	T	72.9	Confident	68.8	Low	1 Å²	1	85.4 Å²	85.4	1%	0.006	43%	0.427	C	S	.	.	H	α-helix	trans	-95.9	-38	179.4	-63.8	0	0	0	0	112.5	L754 I810 D811 F813 E876 L877	L754-T879 HydrophobicContact CD1-CG2 4Å; I810-T879 WeakPolarHBondContact O-CG2 3.35Å; D811-T879 PolarHBondContact OD1-OG1 3.22Å; F813-T879 WeakPolarHBondContact CD2-OG1 3.22Å; F813-T879 VanDerWaalsContact CE2-OG1 3.32Å; F813-T879 WeakPolarHBondContact CE2-OG1 3.03Å; E876-T879 PolarHBondContact O-N 2.71Å; E876-T879 VanDerWaalsContact O-N 3.07Å; L877-T879 VanDerWaalsContact C-N 3.29Å
880	C	73.3	Confident	68	Low	7 Å²	7	88 Å²	88	5%	0.047	43%	0.431	C	S	.	.			trans	-144.5	120.2	-175.9	-161.6	0	0	0	0	111	E876 C888	E876-C880 PolarHBondContact O-N 3.12Å; C880-C888 HydrophobicContact CB-CB 3.78Å; C880-C888 WeakPolarHBondContact CB-SG 3.4Å; C880-C888 VanDerWaalsContact SG-CA 3.53Å; C880-C888 WeakPolarHBondContact SG-CB 3.27Å; C880-C888 CovalentContact SG-SG 2.03Å; C880-C888 PolarHBondContact SG-SG 3.46Å
881	I	75.5	Confident	67.1	Low	68 Å²	68	86.9 Å²	86.9	35%	0.349	42%	0.422	S	S	.	.			trans	-90	122.9	172.8	-62.4	-178.5	0	0	0	108.5	L806 F883 C888	L806-I881 HydrophobicContact CD1-CD1 3.92Å; L806-I881 HydrophobicContact CD2-CD1 4.35Å; L806-I881 HydrophobicContact CD2-CG1 4.33Å; I881-F883 VanDerWaalsContact C-N 3.31Å; I881-F883 HydrophobicContact CB-CD2 4.29Å; I881-F883 HydrophobicContact CB-CE2 3.8Å; I881-F883 HydrophobicContact CB-CZ 3.98Å; I881-F883 HydrophobicContact CD1-CZ 4.47Å; I881-F883 HydrophobicContact CG2-CD1 4.38Å; I881-F883 HydrophobicContact CG2-CD2 4.41Å; I881-F883 HydrophobicContact CG2-CE1 4.06Å; I881-F883 HydrophobicContact CG2-CE2 4.1Å; I881-F883 HydrophobicContact CG2-CZ 3.91Å; I881-F883 WeakPolarHBondContact O-CD2 3.26Å; I881-F883 PolarHBondContact O-N 3.23Å; I881-C888 PolarHBondContact O-SG 3.33Å
882	P	71.3	Confident	65.9	Low	81 Å²	81	85 Å²	85	53%	0.526	42%	0.419	S	S	.	.			trans	-71.3	83.7	-179.1	29.2	-35	0	0	0	111.1	T884 C888	P882-T884 VanDerWaalsContact C-N 3.3Å; P882-C888 HydrophobicContact CB-CB 4.19Å
883	F	69.1	Low	65	Low	139 Å²	139	86.2 Å²	86.2	61%	0.61	42%	0.422	S	S	*	.	S	Bend	trans	-71.8	-24.8	174.1	-67.5	-71.6	0	0	0	112.8	I881 F887	I881-F883 VanDerWaalsContact C-N 3.31Å; I881-F883 HydrophobicContact CB-CD2 4.29Å; I881-F883 HydrophobicContact CB-CE2 3.8Å; I881-F883 HydrophobicContact CB-CZ 3.98Å; I881-F883 HydrophobicContact CD1-CZ 4.47Å; I881-F883 HydrophobicContact CG2-CD1 4.38Å; I881-F883 HydrophobicContact CG2-CD2 4.41Å; I881-F883 HydrophobicContact CG2-CE1 4.06Å; I881-F883 HydrophobicContact CG2-CE2 4.1Å; I881-F883 HydrophobicContact CG2-CZ 3.91Å; I881-F883 WeakPolarHBondContact O-CD2 3.26Å; I881-F883 PolarHBondContact O-N 3.23Å; F883-F887 HydrophobicContact CB-CD1 4.4Å; F883-F887 HydrophobicContact CD2-CD1 4.11Å; F883-F887 HydrophobicContact CD2-CE1 4.07Å
884	T	68.5	Low	63.6	Low	82 Å²	82	84.7 Å²	84.7	50%	0.503	41%	0.414	S	S	.	.	S	Bend	trans	-143.3	160.2	162.9	72.2	0	0	0	0	108.6	P882 K886 F887	P882-T884 VanDerWaalsContact C-N 3.3Å; T884-K886 PolarHBondContact O-N 3.29Å; T884-K886 VanDerWaalsContact O-N 3.11Å; T884-F887 WeakPolarHBondContact O-CB 3.42Å; T884-F887 PolarHBondContact O-N 3.3Å
885	D	61.8	Low	62.1	Low	157 Å²	157	76.7 Å²	76.7	84%	0.84	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-30.6	-173	-47.8	-62.6	0	0	0	113.3
886	K	61.1	Low	60.7	Low	161 Å²	161	80.7 Å²	80.7	70%	0.7	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-8.9	178.2	-59	-162	175	-158.3	0	114.5	T884	T884-K886 PolarHBondContact O-N 3.29Å; T884-K886 VanDerWaalsContact O-N 3.11Å
887	F	60.1	Low	59	Low	66 Å²	66	81.2 Å²	81.2	29%	0.289	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-32.1	-171.6	-158.6	-112.2	0	0	0	113.5	L807 P808 F883 T884	L807-F887 HydrophobicContact CD2-CE1 4.19Å; L807-F887 HydrophobicContact CD2-CZ 3.86Å; P808-F887 VanDerWaalsContact CD-CZ 3.49Å; P808-F887 HydrophobicContact CG-CD1 4.42Å; P808-F887 HydrophobicContact CG-CE1 4.13Å; P808-F887 HydrophobicContact CG-CE2 4.21Å; P808-F887 HydrophobicContact CG-CZ 4.02Å; F883-F887 HydrophobicContact CB-CD1 4.4Å; F883-F887 HydrophobicContact CD2-CD1 4.11Å; F883-F887 HydrophobicContact CD2-CE1 4.07Å; T884-F887 WeakPolarHBondContact O-CB 3.42Å; T884-F887 PolarHBondContact O-N 3.3Å
888	C	66.3	Low	56.9	Low	27 Å²	27	88.2 Å²	88.2	18%	0.182	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	29.5	174.9	-59.8	0	0	0	0	111.1	C880 I881 P882 K890	C880-C888 HydrophobicContact CB-CB 3.78Å; C880-C888 WeakPolarHBondContact CB-SG 3.4Å; C880-C888 VanDerWaalsContact SG-CA 3.53Å; C880-C888 WeakPolarHBondContact SG-CB 3.27Å; C880-C888 CovalentContact SG-SG 2.03Å; C880-C888 PolarHBondContact SG-SG 3.46Å; I881-C888 PolarHBondContact O-SG 3.33Å; P882-C888 HydrophobicContact CB-CB 4.19Å; C888-K890 PolarHBondContact O-N 2.91Å
889	E	58.4	Low	55.9	Low	84 Å²	84	88.7 Å²	88.7	39%	0.393	45%	0.446	S	S	.	.			trans	-48.9	134.2	173.5	-163.1	164.5	-129.8	0	0	108.9	Q473	Q473-E889 PolarHBondContact NE2-OE2 2.91Å
890	K	53.9	Low	55.1	Low	121 Å²	121	93.3 Å²	93.3	53%	0.526	47%	0.469	S	S	.	.			trans	-61.5	156.1	-177.1	-74.1	174.2	178.8	-80.1	0	108.9	E876 C888 D892	E876-K890 IonicContact OE1-NZ 3.61Å; E876-K890 PolarHBondContact OE1-NZ 2.84Å; E876-K890 IonicContact OE2-NZ 3.76Å; E876-K890 PolarHBondContact OE2-NZ 3.26Å; C888-K890 PolarHBondContact O-N 2.91Å; K890-D892 PolarHBondContact O-N 2.62Å
891	Y	53	Low	54	Low	54 Å²	54	98.1 Å²	98.1	21%	0.212	49%	0.492	C	S	.	.			trans	-67	80.6	155.9	-85.9	-116.2	0	0	0	105.7	Q495 R757 W809 L893	Q495-Y891 VanDerWaalsContact OE1-CE1 3.3Å; R757-Y891 HydrophobicContact CG-CD2 3.99Å; R757-Y891 HydrophobicContact CG-CE2 3.76Å; W809-Y891 WeakPolarHBondContact CZ3-OH 3.09Å; Y891-L893 WeakPolarHBondContact O-CD1 3.45Å; Y891-L893 PolarHBondContact O-N 3.16Å
892	D	42.5	Very low	52.8	Low	101 Å²	101	99.9 Å²	99.9	54%	0.54	50%	0.501	S	S	.	.			trans	-66.5	112.2	-170.5	-173.6	-15.5	0	0	0	108.2	K890 N894 A895	K890-D892 PolarHBondContact O-N 2.62Å; D892-N894 PolarHBondContact O-N 2.88Å; D892-N894 PolarHBondContact OD1-N 2.94Å; D892-A895 HydrophobicContact CB-CB 4.2Å; D892-A895 PolarHBondContact O-N 3.47Å
893	L	48.6	Very low	51.6	Low	70 Å²	70	101.1 Å²	101.1	37%	0.366	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-17.2	-175.8	-82.3	92	0	0	0	111.7	K647 Y756 Y891	K647-L893 HydrophobicContact CD-CD2 4.46Å; K647-L893 PolarHBondContact NZ-O 3.29Å; Y756-L893 HydrophobicContact CD2-CD1 4.37Å; Y756-L893 HydrophobicContact CE2-CD2 4.31Å; Y891-L893 WeakPolarHBondContact O-CD1 3.45Å; Y891-L893 PolarHBondContact O-N 3.16Å
894	N	39.7	Very low	50.5	Low	99 Å²	99	98.5 Å²	98.5	53%	0.529	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	10.4	-174.4	-63	-15.7	0	0	0	114.7	D892 H896 L897	D892-N894 PolarHBondContact O-N 2.88Å; D892-N894 PolarHBondContact OD1-N 2.94Å; N894-H896 PolarHBondContact O-N 3.32Å; N894-L897 WeakPolarHBondContact O-CB 3.31Å; N894-L897 PolarHBondContact O-N 3.27Å
895	A	41.3	Very low	49.2	Very low	35 Å²	35	99.7 Å²	99.7	29%	0.289	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-15.9	-175.8	0	0	0	0	0	116.2	D892 L897	D892-A895 HydrophobicContact CB-CB 4.2Å; D892-A895 PolarHBondContact O-N 3.47Å; A895-L897 VanDerWaalsContact C-N 3.33Å
896	H	41.4	Very low	48.2	Very low	95 Å²	95	95.3 Å²	95.3	44%	0.44	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	14.4	172.2	-54.4	-68.9	0	0	0	113.9	N894	N894-H896 PolarHBondContact O-N 3.32Å
897	L	33.3	Very low	47.1	Very low	97 Å²	97	89.8 Å²	89.8	51%	0.508	45%	0.445	S	S	.	.			trans	-133	48	-175.5	-82.8	169.1	0	0	0	113.2	N894 A895	N894-L897 WeakPolarHBondContact O-CB 3.31Å; N894-L897 PolarHBondContact O-N 3.27Å; A895-L897 VanDerWaalsContact C-N 3.33Å
898	H	27	Very low	45.9	Very low	229 Å²	229	92 Å²	92	100%	1.06	46%	0.459	S	S	*	.			trans	-151.8	0	157	-84.9	-50	0	0	0	110.2	K491	K491-H898 WeakPolarHBondContact CE-O 3.4Å; K491-H898 PolarHBondContact NZ-O 2.72Å

Retrieved 898 of 898 residues in 290.1 ms (Link to these results)

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