A0A087YCY8_POEFO Loading...

RAB GTPase activating protein 1 like

AlphaFold DB , UniProt , Accession A0A087YCY8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,081 aa.

						>A0A087YCY8_POEFO|A0A087YCY8
MDDSSSLGKVSSSTESVATVTSEEFVLVQSSSASSPQGSEGRPRLKMSWNGSDQLEKAMEEVLDDDEVKVEKSCVEQMEKQKKLESQVSETQPADATCSEPPMPVINLMLPELPSPVKPELGKTEACPAPSSPSVIEEDSVQFNKLSYLGCTWVKAPRNEAEAQRAMATLRAESAIPIPITLHVPCGPDGSVRIVDQASGTEIASFPIYKVLFCARGREGSVESDCFSFTESYRSSEDFQIHVFSCHIKEAVSRILYSFSTAFRRSSQRADIRDTALSGPPDGDLYTFTVSLEIREDDGKGNYNPVPKDRDKFYFKLRQGVQKKVLVSVQQMCNKELGIERCFGMLLSPGQKVCNSDMHLLDMESMGKSSDGKAYIITGTWNPNMAAFQPLNEDTPKDKQVYMTVAVDLVVTEVVEPVRFLLETLVRVYPSNERFWYFSRKTFSETFYLRLRQLYQQAPDRVSQSDAVYEVVSLQREAERNVEEREQVTSHNEEEDVDEGMPSDMNFFPPECDDKTDSDSEISSGTGDVSKDCPEKILESWGGILTRWHGNLSTRPKGLPSLVHSGIPEPLRAEVWQLLAGCHDNHDLLEQYRILITKDSAQESVITRDIHRTFPAHDYFKESDGDGQDSLYKICKAYSVYDEEIGYCQGQSFLAAVLLLHMPEEQAFCVLVKIMYEYGLRGLYKNNFEDLHCKFYQLEKLMQEQLPDLWAHFQELNLEAHMYASQWFLTLFTAKFPLCMVFHITDLLLCEGLSIIFNVALALLKTSKEDLLQADFEGALKFFRVQLPKRYRAAENARRLMEQACNIKVPTKKLKKFEKEYQTLRESQLQQEDPIDRYQRENRRLQEASMRLEQENDDLAHELVTSKIALRNDLDQAEDKADVLNKELLSTKQRLVETEEEKRRHEEETAQLKEVFRRELEKAEMEIKKTTAIIAEYKQICSQLSTRLEKQQAATKEELDIVRNKVMSCEHCRDLFSPVGSLQASSPGGDGMSSEPLDEEKDGLKEQLRQLELELAQTKLQLVEAKCRIQELEHQRGVLMTEIQAAKNSWFSKTLGSLKSSASSSSSSVSQTPSSPKDGPA
					

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	33.4	Very low	31.1	Very low	243 Å²	243	139.1 Å²	139.1	100%	1.197	82%	0.822	S	S	*	*				0	116.9	0	-80.1	172.7	168.4	0	0	105.8
2	D	32.4	Very low	30.7	Very low	159 Å²	159	135.8 Å²	135.8	85%	0.85	81%	0.812	S	S	*	*			trans	-70.9	150.4	174.9	-42.8	-95.3	0	0	0	109.3
3	D	34.9	Very low	30.4	Very low	154 Å²	154	133.4 Å²	133.4	82%	0.824	81%	0.805	S	S	*	*				-156.8	-177.9	107.4	-137.3	-38.8	0	0	0	111.2
4	S	32.6	Very low	30.3	Very low	94 Å²	94	132.2 Å²	132.2	66%	0.657	80%	0.799	S	S	*	*			trans	-148.9	172.9	-150.2	63.7	0	0	0	0	114.8
5	S	32.9	Very low	30.1	Very low	111 Å²	111	135.1 Å²	135.1	78%	0.776	80%	0.801	S	S	*	*			trans	75.4	154.6	168.2	88.3	0	0	0	0	117.5
6	S	30.7	Very low	30	Very low	102 Å²	102	133.1 Å²	133.1	71%	0.713	80%	0.796	S	S	*	*			cis	-159.1	142.3	-26.9	46	0	0	0	0	114.4
7	L	30.3	Very low	29.8	Very low	165 Å²	165	134.1 Å²	134.1	86%	0.864	80%	0.802	S	S	*	*			trans	37.8	118.2	142	-65.8	165	0	0	0	122.3
8	G	28.1	Very low	30	Very low	79 Å²	79	131.2 Å²	131.2	81%	0.814	80%	0.796	S	S	*	*			trans	-150.9	141.4	154.6	0	0	0	0	0	111.3
9	K	29.8	Very low	29.8	Very low	189 Å²	189	131.5 Å²	131.5	82%	0.822	80%	0.798	S	S	*	*			trans	-130.8	156	-169.7	-80.6	-167.7	176.8	-177.5	0	110.2
10	V	29.4	Very low	29.7	Very low	119 Å²	119	131 Å²	131	72%	0.721	80%	0.795	S	S	*	*			cis	-166.6	168.3	-3.8	120.2	0	0	0	0	110.6
11	S	27.7	Very low	29.7	Very low	115 Å²	115	130.5 Å²	130.5	80%	0.804	79%	0.792	S	S	*	*			trans	84.7	145.9	161.9	74.8	0	0	0	0	118.2
12	S	25.9	Very low	29.6	Very low	100 Å²	100	124 Å²	124	70%	0.699	77%	0.77	S	S	*	*			cis	-144	137.6	10	59	0	0	0	0	116.3
13	S	26.8	Very low	29.4	Very low	104 Å²	104	125.3 Å²	125.3	73%	0.727	77%	0.772	S	S	*	*			trans	68.2	115.3	141.6	-52.1	0	0	0	0	123.3
14	T	28.9	Very low	28.9	Very low	117 Å²	117	126.3 Å²	126.3	72%	0.718	77%	0.771	S	S	*	*				53.9	136.1	129.9	58.7	0	0	0	0	121.9
15	E	27.5	Very low	28.8	Very low	176 Å²	176	131.7 Å²	131.7	82%	0.822	78%	0.783	S	S	*	*			cis	-160.8	158.8	-6.5	-127.5	161.7	177.6	0	0	113.5
16	S	28.3	Very low	28.4	Very low	103 Å²	103	132.7 Å²	132.7	72%	0.72	78%	0.784	S	S	*	*			trans	-32.5	135.9	174.2	-46.5	0	0	0	0	117
17	V	26.4	Very low	28.3	Very low	149 Å²	149	135.4 Å²	135.4	90%	0.903	79%	0.79	S	S	*	*				73.2	128.1	54.1	-178.5	0	0	0	0	113.8
18	A	33.6	Very low	28	Very low	83 Å²	83	133.8 Å²	133.8	69%	0.686	79%	0.786	S	S	*	*			trans	-98.1	176.9	-172.4	0	0	0	0	0	114.4
19	T	26.8	Very low	27.9	Very low	137 Å²	137	138.8 Å²	138.8	84%	0.84	79%	0.789	S	S	*	*				162.1	170.7	129.8	40.3	0	0	0	0	114.5
20	V	28.3	Very low	27.7	Very low	121 Å²	121	135.9 Å²	135.9	73%	0.733	79%	0.792	S	S	*	*			trans	90.5	91.5	155.7	-163.7	0	0	0	0	121.1
21	T	28.6	Very low	27.5	Very low	120 Å²	120	135.2 Å²	135.2	74%	0.736	79%	0.793	S	S	*	*				18.7	152.3	129.8	69.1	0	0	0	0	125.7
22	S	30.7	Very low	27.5	Very low	106 Å²	106	134.8 Å²	134.8	74%	0.741	79%	0.79	S	S	*	*			trans	106.5	165.5	137.3	-64.5	0	0	0	0	120.9
23	E	28.4	Very low	27.6	Very low	188 Å²	188	134.3 Å²	134.3	88%	0.879	79%	0.792	S	S	*	*			trans	78.2	149.4	174.4	-61.2	178.5	-171.8	0	0	117.8
24	E	26.1	Very low	27.7	Very low	174 Å²	174	134.9 Å²	134.9	81%	0.813	80%	0.796	S	S	*	*			cis	-159.5	164.8	-34.7	-162.7	175.7	-151	0	0	108.7
25	F	29.8	Very low	27.7	Very low	207 Å²	207	134.8 Å²	134.8	91%	0.908	80%	0.8	S	S	*	*			trans	-88.2	134.2	174	-98.6	-91.9	0	0	0	112.8
26	V	24.7	Very low	28.2	Very low	133 Å²	133	132.4 Å²	132.4	81%	0.806	80%	0.8	S	S	*	*			trans	-130.5	137.6	166.4	180	0	0	0	0	110.6
27	L	27.6	Very low	28.2	Very low	158 Å²	158	136.9 Å²	136.9	83%	0.827	81%	0.81	S	S	*	*			trans	-121.4	129.7	-173	-149.2	168.5	0	0	0	109.5
28	V	25.5	Very low	28.2	Very low	131 Å²	131	133 Å²	133	79%	0.794	80%	0.799	S	S	*	*			trans	-121.2	131.2	178.2	179.9	0	0	0	0	110.2
29	Q	25.9	Very low	27.9	Very low	184 Å²	184	135.2 Å²	135.2	86%	0.86	81%	0.81	S	S	*	*			trans	-90.5	146.1	178	-67.2	-179.4	-22.4	0	0	112.4
30	S	24.2	Very low	28.6	Very low	128 Å²	128	138.2 Å²	138.2	90%	0.895	81%	0.814	S	S	*	*			trans	-142.1	164.6	149.4	64.1	0	0	0	0	109.8
31	S	26.1	Very low	28.6	Very low	106 Å²	106	135.7 Å²	135.7	74%	0.741	81%	0.813	S	S	*	*			trans	-116.9	164	-147.1	60.4	0	0	0	0	117.4
32	S	27.1	Very low	28.7	Very low	106 Å²	106	141.9 Å²	141.9	74%	0.741	82%	0.823	S	S	*	*			trans	74.5	112.6	142.8	56.6	0	0	0	0	121.6
33	A	28.5	Very low	28.6	Very low	90 Å²	90	142.5 Å²	142.5	74%	0.744	83%	0.825	S	S	*	*				104.8	134.3	121.5	0	0	0	0	0	121.5
34	S	28.6	Very low	28.7	Very low	115 Å²	115	145.6 Å²	145.6	80%	0.804	83%	0.828	S	S	*	*			trans	59.2	113.2	155.4	51.3	0	0	0	0	120.7
35	S	28.8	Very low	28.6	Very low	116 Å²	116	145.1 Å²	145.1	81%	0.811	83%	0.831	S	S	*	*			trans	-65.7	158.7	155.3	-34	0	0	0	0	111.6
36	P	38.2	Very low	28.7	Very low	125 Å²	125	144.9 Å²	144.9	81%	0.812	83%	0.829	S	S	*	*				-140.3	-170.7	97.2	39.7	-26.9	0	0	0	114.5
37	Q	28.3	Very low	28.8	Very low	198 Å²	198	146.9 Å²	146.9	93%	0.925	83%	0.832	S	S	*	*			trans	-69.5	154.4	-172.8	-55.3	154.5	-64	0	0	114.1
38	G	27.3	Very low	28.7	Very low	67 Å²	67	144.7 Å²	144.7	69%	0.691	83%	0.83	S	S	*	*			trans	153	121.4	146.2	0	0	0	0	0	119.1
39	S	26.6	Very low	28.8	Very low	130 Å²	130	150.2 Å²	150.2	91%	0.909	84%	0.837	S	S	*	*			trans	67.8	164.5	157	70.9	0	0	0	0	120.2
40	E	40.9	Very low	29.4	Very low	199 Å²	199	149 Å²	149	93%	0.93	84%	0.836	S	S	*	*			trans	-84.8	147.9	-167.7	-54.4	176.6	118.9	0	0	113.8
41	G	28.7	Very low	30.2	Very low	69 Å²	69	146.5 Å²	146.5	71%	0.711	83%	0.83	S	S	*	*			trans	-175.1	108.9	168.9	0	0	0	0	0	112.4	P43	G41-P43 VanDerWaalsContact O-CD 3.28Å; G41-P43 WeakPolarHBondContact O-CD 3.48Å
42	R	30.5	Very low	30.9	Very low	250 Å²	250	144.3 Å²	144.3	94%	0.943	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-67.7	117.9	171.9	-76.3	177.7	169.9	174.7	-5.3	110	R44	R42-R44 PolarHBondContact O-N 3.4Å
43	P	28.3	Very low	31.5	Very low	119 Å²	119	145.5 Å²	145.5	77%	0.773	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-74.7	117.8	168.4	30.3	-31.3	0	0	0	109.7	G41 L45	G41-P43 VanDerWaalsContact O-CD 3.28Å; G41-P43 WeakPolarHBondContact O-CD 3.48Å; P43-L45 PolarHBondContact O-N 3.3Å
44	R	31.5	Very low	31.9	Very low	252 Å²	252	150 Å²	150	95%	0.951	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-73	118.8	163.7	-89.6	176.6	154.9	175.2	-7.9	108.6	R42	R42-R44 PolarHBondContact O-N 3.4Å
45	L	24	Very low	32.5	Very low	165 Å²	165	150.7 Å²	150.7	86%	0.864	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-90.3	131	160	-81.8	166.5	0	0	0	109.4	P43	P43-L45 PolarHBondContact O-N 3.3Å
46	K	31.8	Very low	33.2	Very low	202 Å²	202	151 Å²	151	88%	0.878	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-80.3	134.5	163.4	-74.8	-177.6	172.1	-173.8	0	107.9
47	M	25.6	Very low	33.2	Very low	174 Å²	174	150.9 Å²	150.9	86%	0.857	79%	0.788	S	S	*	*			trans	-108.7	132.4	150.6	-70.4	-174.8	68.8	0	0	107.8
48	S	26.7	Very low	33.9	Very low	113 Å²	113	144 Å²	144	79%	0.79	77%	0.765	S	S	*	*			trans	-82.9	113	178.8	46.4	0	0	0	0	109.7
49	W	26.7	Very low	34.5	Very low	247 Å²	247	146.7 Å²	146.7	94%	0.936	76%	0.761	S	S	*	*			trans	-67.6	134.9	162.6	-71.7	66.8	0	0	0	108.6
50	N	39.8	Very low	35.2	Very low	159 Å²	159	146.8 Å²	146.8	85%	0.85	75%	0.747	S	S	*	*			trans	-152.7	78.3	-179.7	-162.2	95.1	0	0	0	109.5
51	G	39.7	Very low	35.1	Very low	75 Å²	75	144.7 Å²	144.7	77%	0.773	74%	0.737	S	S	*	*			trans	161.6	49.7	-172.1	0	0	0	0	0	114.3
52	S	41.6	Very low	36	Very low	60 Å²	60	147 Å²	147	42%	0.42	74%	0.738	S	S	.	*			trans	-113.7	-32.8	173	-170.5	0	0	0	0	111.9	Q54 L55 E56	S52-Q54 PolarHBondContact O-N 2.83Å; S52-L55 PolarHBondContact O-N 3.44Å; S52-E56 PolarHBondContact O-N 3.06Å; S52-E56 PolarHBondContact OG-OE2 3.11Å
53	D	39.3	Very low	36.4	Very low	131 Å²	131	142.1 Å²	142.1	70%	0.701	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-9.1	-163.9	-46.7	39.2	0	0	0	115.7
54	Q	37.9	Very low	36.7	Very low	183 Å²	183	143.3 Å²	143.3	86%	0.855	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	-22.4	-177.8	-163.3	165	53.7	0	0	113.4	S52	S52-Q54 PolarHBondContact O-N 2.83Å
55	L	40.5	Very low	36.8	Very low	130 Å²	130	139 Å²	139	68%	0.681	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-43.7	174.1	-177.2	63.5	0	0	0	110.9	S52 K57 A58 M59	S52-L55 PolarHBondContact O-N 3.44Å; L55-K57 PolarHBondContact O-N 2.85Å; L55-A58 PolarHBondContact O-N 3.06Å; L55-M59 PolarHBondContact O-N 2.72Å; L55-M59 VanDerWaalsContact O-N 3.13Å
56	E	43.7	Very low	37.2	Very low	123 Å²	123	138 Å²	138	58%	0.575	72%	0.72	S	S	*	*	H	α-helix	trans	-56.8	-40.8	176.7	-165.3	162.3	-165.2	0	0	111.1	S52 A58 M59 E60	S52-E56 PolarHBondContact O-N 3.06Å; S52-E56 PolarHBondContact OG-OE2 3.11Å; E56-A58 PolarHBondContact O-N 3.14Å; E56-M59 WeakPolarHBondContact O-CB 3.36Å; E56-M59 PolarHBondContact O-N 3.21Å; E56-E60 PolarHBondContact O-N 3.02Å
57	K	38.1	Very low	37.3	Very low	122 Å²	122	136.8 Å²	136.8	53%	0.53	72%	0.718	S	S	.	*	H	α-helix	trans	-67.9	-31.2	175.9	-167.1	171.6	-176.3	179.8	0	114.2	L55 M59 E60 E61	L55-K57 PolarHBondContact O-N 2.85Å; K57-M59 VanDerWaalsContact C-N 3.3Å; K57-E60 PolarHBondContact O-N 3.36Å; K57-E61 PolarHBondContact O-N 3.49Å; K57-E61 VanDerWaalsContact O-N 3.15Å
58	A	42.9	Very low	37.5	Very low	53 Å²	53	134.1 Å²	134.1	44%	0.438	71%	0.711	S	S	.	*	H	α-helix	trans	-76.9	-18	174.8	0	0	0	0	0	112.6	L55 E56 V62	L55-A58 PolarHBondContact O-N 3.06Å; E56-A58 PolarHBondContact O-N 3.14Å; A58-V62 WeakPolarHBondContact O-CG2 3.46Å
59	M	39.8	Very low	37.7	Very low	124 Å²	124	136.8 Å²	136.8	61%	0.611	71%	0.709	S	S	*	*	H	α-helix	trans	-82.8	-33.1	168.3	-68.7	175.1	56.3	0	0	111.9	L55 E56 K57 V62	L55-M59 PolarHBondContact O-N 2.72Å; L55-M59 VanDerWaalsContact O-N 3.13Å; E56-M59 WeakPolarHBondContact O-CB 3.36Å; E56-M59 PolarHBondContact O-N 3.21Å; K57-M59 VanDerWaalsContact C-N 3.3Å; M59-V62 PolarHBondContact O-N 3.38Å
60	E	41	Very low	37.6	Very low	133 Å²	133	132.1 Å²	132.1	62%	0.621	71%	0.707	S	S	*	*	H	α-helix	trans	-69.5	-43	178.4	-153.6	165.5	-139.3	0	0	111.7	E56 K57 V62 L63	E56-E60 PolarHBondContact O-N 3.02Å; K57-E60 PolarHBondContact O-N 3.36Å; E60-V62 PolarHBondContact O-N 3.33Å; E60-L63 PolarHBondContact O-N 3.4Å; E60-L63 VanDerWaalsContact O-N 3.09Å
61	E	39.5	Very low	37.2	Very low	154 Å²	154	131.4 Å²	131.4	72%	0.72	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-2.9	174	-75.1	-177.7	172	0	0	114.8	K57	K57-E61 PolarHBondContact O-N 3.49Å; K57-E61 VanDerWaalsContact O-N 3.15Å
62	V	46.1	Very low	36.7	Very low	119 Å²	119	136.3 Å²	136.3	72%	0.721	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	-0.8	176.4	176.8	0	0	0	0	112.1	A58 M59 E60	A58-V62 WeakPolarHBondContact O-CG2 3.46Å; M59-V62 PolarHBondContact O-N 3.38Å; E60-V62 PolarHBondContact O-N 3.33Å
63	L	39.4	Very low	35.8	Very low	147 Å²	147	139 Å²	139	77%	0.77	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113	-15	-178.6	-67.4	172.7	0	0	0	114.4	E60	E60-L63 PolarHBondContact O-N 3.4Å; E60-L63 VanDerWaalsContact O-N 3.09Å
64	D	35.7	Very low	35.1	Very low	144 Å²	144	137 Å²	137	77%	0.77	71%	0.713	S	S	*	*			trans	-99.9	76.6	175.8	-92.7	-32.9	0	0	0	112
65	D	32.7	Very low	34.7	Very low	160 Å²	160	136 Å²	136	86%	0.856	72%	0.718	S	S	*	*	S	Bend	trans	-150.7	128.2	146.6	-118.2	-22.6	0	0	0	111.7
66	D	33.2	Very low	34.2	Very low	144 Å²	144	137.1 Å²	137.1	77%	0.77	72%	0.72	S	S	*	*			trans	58.9	75.6	175.8	-83.6	-33	0	0	0	121.6
67	E	32.9	Very low	33.5	Very low	177 Å²	177	140.4 Å²	140.4	83%	0.827	74%	0.736	S	S	*	*			trans	-73.8	108.8	140.9	-108.6	-144.1	151.6	0	0	111
68	V	29.6	Very low	33	Very low	119 Å²	119	143.7 Å²	143.7	72%	0.721	76%	0.755	S	S	*	*			trans	-137.7	77.2	158.7	-165	0	0	0	0	114.2
69	K	30.8	Very low	32.3	Very low	169 Å²	169	150.9 Å²	150.9	74%	0.735	78%	0.78	S	S	*	*			trans	20.6	121.2	145.8	-66.7	169.2	-178.4	157	0	120.6
70	V	25	Very low	31.6	Very low	149 Å²	149	154 Å²	154	90%	0.903	79%	0.79	S	S	*	*				-134.2	141.7	129.9	-178.7	0	0	0	0	108.9
71	E	31	Very low	30.8	Very low	143 Å²	143	154.9 Å²	154.9	67%	0.668	79%	0.794	S	S	*	*			trans	-92.1	144.6	-178.1	-73.7	-165.3	90.4	0	0	114.7
72	K	30.4	Very low	30.2	Very low	179 Å²	179	157.5 Å²	157.5	78%	0.778	80%	0.803	S	S	*	*			trans	39.6	111.7	140.8	-60.9	165.8	-177.7	150.3	0	119.2
73	S	23.4	Very low	29.2	Very low	116 Å²	116	159.3 Å²	159.3	81%	0.811	80%	0.801	S	S	*	*				-160	158.2	121.7	-158	0	0	0	0	113.2
74	C	24.5	Very low	28.5	Very low	90 Å²	90	159.8 Å²	159.8	61%	0.608	80%	0.803	S	S	*	*			trans	34.9	97.8	167.8	-68	0	0	0	0	119.7	E76	C74-E76 VanDerWaalsContact C-N 3.28Å; C74-E76 HydrophobicContact CB-CB 4.41Å; C74-E76 HydrophobicContact CB-CG 4.35Å; C74-E76 PolarHBondContact O-N 3.48Å; C74-E76 VanDerWaalsContact O-N 3.16Å
75	V	28.1	Very low	28	Very low	160 Å²	160	158.8 Å²	158.8	97%	0.97	79%	0.794	S	S	*	*			trans	-69.7	92	134.8	176.9	0	0	0	0	107.8
76	E	30.7	Very low	27.6	Very low	155 Å²	155	155.9 Å²	155.9	72%	0.724	79%	0.787	S	S	*	*			trans	-135.3	150.7	161.5	-73	-160.5	120.2	0	0	109.1	C74	C74-E76 VanDerWaalsContact C-N 3.28Å; C74-E76 HydrophobicContact CB-CB 4.41Å; C74-E76 HydrophobicContact CB-CG 4.35Å; C74-E76 PolarHBondContact O-N 3.48Å; C74-E76 VanDerWaalsContact O-N 3.16Å
77	Q	28.3	Very low	27.2	Very low	192 Å²	192	157.7 Å²	157.7	90%	0.897	79%	0.79	S	S	*	*	S	Bend	trans	63.5	69	-179.4	-51.2	-173.3	16.1	0	0	116.9
78	M	27.8	Very low	26.8	Very low	191 Å²	191	155.5 Å²	155.5	94%	0.941	79%	0.789	S	S	*	*	S	Bend		-160.5	-8.8	127.5	-114.9	176.3	-179.1	0	0	117.1
79	E	29.2	Very low	26.6	Very low	204 Å²	204	154.1 Å²	154.1	95%	0.953	78%	0.784	S	S	*	*	S	Bend	trans	-111	47.8	-179.2	-122.3	176.9	-160.6	0	0	115.7
80	K	23.5	Very low	26.3	Very low	189 Å²	189	154.9 Å²	154.9	82%	0.822	79%	0.791	S	S	*	*			trans	-142.7	135.5	157	-78.4	-176.8	-175.7	168.2	0	106.4
81	Q	24.6	Very low	26.3	Very low	152 Å²	152	154.3 Å²	154.3	71%	0.71	79%	0.787	S	S	*	*			cis	-157.3	118	11.8	-166.5	165.8	-51.3	0	0	110
82	K	28.4	Very low	25.8	Very low	209 Å²	209	155.9 Å²	155.9	91%	0.909	80%	0.795	S	S	*	*	S	Bend	trans	-100	123.5	173.6	-160.2	173	-172	174.9	0	109.6
83	K	24.1	Very low	26.2	Very low	157 Å²	157	152.7 Å²	152.7	68%	0.683	79%	0.792	S	S	*	*			trans	57.4	113.8	-170.2	-70.3	-163.4	176	-161.4	0	115.8	E85	K83-E85 HydrophobicContact CD-CG 4.39Å; K83-E85 WeakPolarHBondContact CD-OE1 3.44Å; K83-E85 WeakPolarHBondContact CE-OE1 3.49Å; K83-E85 IonicContact NZ-OE1 3.39Å; K83-E85 PolarHBondContact NZ-OE1 2.81Å
84	L	24.1	Very low	26.3	Very low	156 Å²	156	151.8 Å²	151.8	82%	0.817	79%	0.792	S	S	*	*				-122.4	134.6	123.4	-164.5	73	0	0	0	106.6
85	E	25.1	Very low	26.3	Very low	124 Å²	124	154.9 Å²	154.9	58%	0.579	80%	0.803	S	S	*	*			trans	-98.4	168.6	-179.5	-72.7	175.4	174.1	0	0	111.4	K83	K83-E85 HydrophobicContact CD-CG 4.39Å; K83-E85 WeakPolarHBondContact CD-OE1 3.44Å; K83-E85 WeakPolarHBondContact CE-OE1 3.49Å; K83-E85 IonicContact NZ-OE1 3.39Å; K83-E85 PolarHBondContact NZ-OE1 2.81Å
86	S	24.7	Very low	26.2	Very low	99 Å²	99	151.5 Å²	151.5	69%	0.692	79%	0.791	S	S	*	*			trans	80.3	110.2	157.2	68.6	0	0	0	0	121
87	Q	24.5	Very low	25.9	Very low	181 Å²	181	150.5 Å²	150.5	85%	0.846	80%	0.796	S	S	*	*				83.4	149.2	121.8	-66.9	179	1.1	0	0	122.8
88	V	25.5	Very low	25.8	Very low	132 Å²	132	147.6 Å²	147.6	80%	0.8	80%	0.795	S	S	*	*			trans	73.9	143.4	163	-158.7	0	0	0	0	116.8
89	S	24.5	Very low	25.7	Very low	89 Å²	89	143.1 Å²	143.1	62%	0.622	78%	0.783	S	S	*	*			cis	-179.9	145.9	-48.2	-89.8	0	0	0	0	108.1
90	E	25.1	Very low	25.6	Very low	186 Å²	186	142 Å²	142	87%	0.869	78%	0.778	S	S	*	*			trans	63.6	153.5	162.4	-62.3	166.9	159.7	0	0	115.8
91	T	24.2	Very low	26	Very low	136 Å²	136	138.4 Å²	138.4	83%	0.834	77%	0.774	S	S	*	*			cis	-143.4	164.3	20.5	-39.9	0	0	0	0	111.6
92	Q	22.1	Very low	26.5	Very low	177 Å²	177	136.6 Å²	136.6	83%	0.827	78%	0.775	S	S	*	*			trans	-80.6	-172	176.4	-47.7	-179.3	-33.2	0	0	112.2
93	P	38.6	Very low	26.4	Very low	111 Å²	111	134.8 Å²	134.8	72%	0.721	77%	0.772	S	S	*	*			cis	-140.8	178.6	-1.8	42.4	-24	0	0	0	117.8
94	A	24.3	Very low	26.7	Very low	98 Å²	98	132.2 Å²	132.2	81%	0.81	77%	0.771	S	S	*	*			trans	70.7	147.5	149.7	0	0	0	0	0	120.4
95	D	24.5	Very low	26.7	Very low	155 Å²	155	131.1 Å²	131.1	83%	0.829	77%	0.771	S	S	*	*			cis	-164.5	131.1	-23.7	-179.7	20.6	0	0	0	109
96	A	25.9	Very low	26.7	Very low	88 Å²	88	132.2 Å²	132.2	73%	0.727	78%	0.779	S	S	*	*			trans	-176.4	100.7	166.4	0	0	0	0	0	112.5
97	T	25.8	Very low	26.6	Very low	134 Å²	134	134.3 Å²	134.3	82%	0.822	78%	0.782	S	S	*	*			trans	10.6	120.7	152.4	55	0	0	0	0	120.3
98	C	25.5	Very low	26.6	Very low	131 Å²	131	132.5 Å²	132.5	89%	0.885	78%	0.778	S	S	*	*				157.2	113.9	104	-172.6	0	0	0	0	112.7
99	S	26.1	Very low	26.5	Very low	98 Å²	98	134.6 Å²	134.6	69%	0.685	78%	0.781	S	S	*	*			trans	-162.3	131.3	170.4	49.3	0	0	0	0	114
100	E	26.9	Very low	26.8	Very low	180 Å²	180	137.8 Å²	137.8	84%	0.841	79%	0.79	S	S	*	*				66.4	171.1	125.4	-67.8	-166.2	161.3	0	0	121.7
101	P	32.3	Very low	27.1	Very low	114 Å²	114	134.1 Å²	134.1	74%	0.74	78%	0.782	S	S	*	*			cis	-119.8	-119.5	-0.4	24.6	1.7	0	0	0	114.6
102	P	35.3	Very low	26.9	Very low	113 Å²	113	136.3 Å²	136.3	73%	0.734	78%	0.783	S	S	*	*				-123.6	179.8	-124.9	39.6	-20	0	0	0	115
103	M	25	Very low	26.9	Very low	172 Å²	172	134.5 Å²	134.5	85%	0.847	78%	0.778	S	S	*	*			trans	-142.9	139.7	171.3	-88.5	-58.2	-63.2	0	0	115
104	P	30.6	Very low	26.6	Very low	102 Å²	102	135.1 Å²	135.1	66%	0.662	78%	0.783	S	S	*	*			trans	-106.8	177.5	167.6	16.3	5.3	0	0	0	114.7
105	V	24.8	Very low	26.6	Very low	133 Å²	133	135.1 Å²	135.1	81%	0.806	78%	0.777	S	S	*	*			trans	-16.7	152.3	166.6	-150.8	0	0	0	0	120.4
106	I	24.5	Very low	27.1	Very low	148 Å²	148	133.2 Å²	133.2	76%	0.759	77%	0.773	S	S	*	*			trans	117.4	115.8	148.7	-61.1	-178.9	0	0	0	118.5
107	N	22.8	Very low	27	Very low	142 Å²	142	135.2 Å²	135.2	76%	0.759	78%	0.776	S	S	*	*			trans	32.8	145.9	145.5	-82	-10.7	0	0	0	126.9
108	L	24.3	Very low	27	Very low	143 Å²	143	138 Å²	138	75%	0.749	78%	0.776	S	S	*	*			trans	92.8	119	132.6	-84.6	165.5	0	0	0	124.1
109	M	23.3	Very low	27.3	Very low	176 Å²	176	137.6 Å²	137.6	87%	0.867	77%	0.772	S	S	*	*			trans	83.2	162.1	135.2	-106.2	178.4	170.5	0	0	124.1
110	L	30	Very low	27.2	Very low	157 Å²	157	141.2 Å²	141.2	82%	0.822	78%	0.778	S	S	*	*			trans	-92.1	163	-169.2	-76.4	140.3	0	0	0	113.7
111	P	32.5	Very low	27.1	Very low	108 Å²	108	139.8 Å²	139.8	70%	0.701	78%	0.776	S	S	*	*				-132	-167.6	104.2	43.5	-35.5	0	0	0	111.2
112	E	20.6	Very low	26.6	Very low	183 Å²	183	136.8 Å²	136.8	86%	0.855	77%	0.765	S	S	*	*			cis	-147.8	-143.3	4.1	-152.7	166.2	-114.5	0	0	111.8
113	L	22.3	Very low	26	Very low	138 Å²	138	140.9 Å²	140.9	72%	0.723	77%	0.772	S	S	*	*			trans	-158.6	161.9	-172.8	-115.3	164.1	0	0	0	109.3
114	P	30.7	Very low	25.8	Very low	125 Å²	125	138.1 Å²	138.1	81%	0.812	76%	0.764	S	S	*	*				-149.5	172	79.2	37.6	-16.9	0	0	0	117.4
115	S	24.5	Very low	25.5	Very low	98 Å²	98	142.1 Å²	142.1	69%	0.685	77%	0.774	S	S	*	*			trans	-100.2	-177.7	175.9	71	0	0	0	0	111.7
116	P	36.4	Very low	25.4	Very low	115 Å²	115	140.5 Å²	140.5	75%	0.747	78%	0.775	S	S	*	*				-127.5	-157.2	57.9	24.6	0.7	0	0	0	111.3
117	V	22.1	Very low	25.5	Very low	130 Å²	130	139.8 Å²	139.8	79%	0.788	78%	0.781	S	S	*	*			cis	-146.1	165.3	14.1	-173.8	0	0	0	0	109.7
118	K	26.9	Very low	25.6	Very low	192 Å²	192	139.1 Å²	139.1	84%	0.835	79%	0.785	S	S	*	*			trans	-138.2	158.8	169.3	-95.6	-167.4	-179.5	-176.9	0	112.1
119	P	31.4	Very low	25.6	Very low	122 Å²	122	137 Å²	137	79%	0.792	79%	0.788	S	S	*	*			trans	-112.7	-156.9	130	-15.4	34.4	0	0	0	115.9
120	E	24.3	Very low	26	Very low	175 Å²	175	134.7 Å²	134.7	82%	0.818	79%	0.786	S	S	*	*			trans	-128.2	-164.5	-167.6	-55.8	168.9	89.1	0	0	110.4
121	L	23.6	Very low	25.8	Very low	150 Å²	150	132.9 Å²	132.9	79%	0.785	79%	0.786	S	S	*	*			cis	-162.7	161.2	6.3	-166.5	63.1	0	0	0	107.4
122	G	22.1	Very low	25.5	Very low	51 Å²	51	132.7 Å²	132.7	53%	0.526	79%	0.788	S	S	.	*			cis	145.2	132.9	-10.4	0	0	0	0	0	113
123	K	22.9	Very low	26	Very low	199 Å²	199	130 Å²	130	87%	0.865	79%	0.786	S	S	*	*			trans	72	157.6	-175.1	-41.2	179	-175.8	179	0	114
124	T	21.1	Very low	26.2	Very low	113 Å²	113	128.5 Å²	128.5	69%	0.693	79%	0.787	S	S	*	*			cis	-155	155.8	8	-24.7	0	0	0	0	110.9
125	E	24.3	Very low	26.2	Very low	187 Å²	187	129.2 Å²	129.2	87%	0.874	79%	0.789	S	S	*	*			trans	58.8	158.3	150	-89.9	167.2	-157.9	0	0	124.1
126	A	22.7	Very low	26.7	Very low	99 Å²	99	131.3 Å²	131.3	82%	0.818	79%	0.791	S	S	*	*			trans	98.1	139.6	167.2	0	0	0	0	0	119.5
127	C	25.9	Very low	27	Very low	132 Å²	132	134.8 Å²	134.8	89%	0.892	80%	0.797	S	S	*	*			trans	-93.9	148.9	-176.9	-52.8	0	0	0	0	112.7
128	P	26	Very low	28.5	Very low	128 Å²	128	131.7 Å²	131.7	83%	0.831	77%	0.774	S	S	*	*			trans	-106.3	136.7	162.3	35.6	-27.7	0	0	0	112.7
129	A	24.7	Very low	30.3	Very low	99 Å²	99	129 Å²	129	82%	0.818	77%	0.769	S	S	*	*			trans	-152	156.7	161.6	0	0	0	0	0	109
130	P	31.2	Very low	32.5	Very low	128 Å²	128	124.5 Å²	124.5	83%	0.831	74%	0.741	S	S	*	*			cis	-119.9	136	-32.7	34.7	-22	0	0	0	111
131	S	26.4	Very low	35.4	Very low	118 Å²	118	118.8 Å²	118.8	83%	0.825	72%	0.718	S	S	*	*			trans	-87.8	120.5	175.5	53.5	0	0	0	0	111.6
132	S	25.8	Very low	38.4	Very low	104 Å²	104	116.5 Å²	116.5	73%	0.727	70%	0.703	S	S	*	*			trans	-0.7	125.3	161.3	54.2	0	0	0	0	117.9	S134	S132-S134 PolarHBondContact O-N 3.07Å
133	P	30.2	Very low	41.6	Very low	127 Å²	127	115.1 Å²	115.1	83%	0.825	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-65.3	131.8	171.8	29.3	-33.9	0	0	0	110.7
134	S	27.1	Very low	44.5	Very low	107 Å²	107	109.5 Å²	109.5	75%	0.748	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-62.6	133.8	161.6	49.1	0	0	0	0	109.3	S132 I136	S132-S134 PolarHBondContact O-N 3.07Å; S134-I136 PolarHBondContact O-N 3.14Å
135	V	31.6	Very low	47.6	Very low	139 Å²	139	110.3 Å²	110.3	84%	0.842	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-58.5	121.5	178.4	178.5	0	0	0	0	109.5
136	I	34.2	Very low	50.7	Low	143 Å²	143	101.5 Å²	101.5	73%	0.733	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-76.3	125.8	167.1	-59.5	171.7	0	0	0	106.2	S134 E138	S134-I136 PolarHBondContact O-N 3.14Å; I136-E138 PolarHBondContact O-N 3.09Å
137	E	43.2	Very low	53.9	Low	188 Å²	188	97.2 Å²	97.2	88%	0.879	58%	0.578	S	S	*	*			trans	-67.9	104.4	170.5	-69.6	-173.5	127.9	0	0	108.5	D139	E137-D139 PolarHBondContact O-N 2.75Å
138	E	53.6	Low	57.1	Low	65 Å²	65	92 Å²	92	30%	0.304	54%	0.54	S	S	.	.			trans	-67.7	116.7	176.5	-75.3	-177	144.6	0	0	110.5	I136 S140 G190 S191 R193	I136-E138 PolarHBondContact O-N 3.09Å; E138-S140 WeakPolarHBondContact O-CB 3.27Å; E138-S140 PolarHBondContact O-N 2.87Å; E138-S140 PolarHBondContact O-OG 3.09Å; E138-G190 WeakPolarHBondContact OE1-CA 3.47Å; E138-S191 PolarHBondContact OE1-N 3.38Å; E138-R193 IonicContact OE2-CZ 3.51Å; E138-R193 VanDerWaalsContact OE2-CZ 3.23Å; E138-R193 IonicContact OE2-NH1 3Å; E138-R193 PolarHBondContact OE2-NH1 3.25Å; E138-R193 IonicContact OE2-NH2 3.72Å; E138-R193 PolarHBondContact OE2-NH2 3.4Å
139	D	64.3	Low	60.1	Low	134 Å²	134	86.6 Å²	86.6	72%	0.717	50%	0.504	S	S	*	.			trans	-56.8	105.4	174.3	-157.6	-10.3	0	0	0	110	E137 C186	E137-D139 PolarHBondContact O-N 2.75Å; D139-C186 HydrophobicContact CB-CB 4.44Å; D139-C186 WeakPolarHBondContact O-CB 3.44Å; D139-C186 PolarHBondContact O-N 3.17Å; D139-C186 PolarHBondContact O-SG 3.1Å
140	S	77	Confident	63.1	Low	29 Å²	29	82.9 Å²	82.9	20%	0.203	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	133.4	-166.4	54.4	0	0	0	0	112.8	E138 Q142 V184	E138-S140 WeakPolarHBondContact O-CB 3.27Å; E138-S140 PolarHBondContact O-N 2.87Å; E138-S140 PolarHBondContact O-OG 3.09Å; S140-Q142 PolarHBondContact O-N 3.27Å; S140-V184 CarbonylContact C-O 3.55Å; S140-V184 WeakPolarHBondContact CA-O 3.18Å
141	V	84.9	Confident	65.9	Low	55 Å²	55	79 Å²	79	33%	0.333	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	115.8	179.9	-171.5	0	0	0	0	109.6	F143 H183 V184	V141-F143 HydrophobicContact CB-CE2 4.01Å; V141-F143 HydrophobicContact CB-CZ 4.42Å; V141-F143 HydrophobicContact CG1-CD2 4.3Å; V141-F143 HydrophobicContact CG1-CE1 4.29Å; V141-F143 HydrophobicContact CG1-CE2 3.57Å; V141-F143 HydrophobicContact CG1-CZ 3.56Å; V141-H183 WeakPolarHBondContact O-CA 3.47Å; V141-V184 PolarHBondContact N-O 2.98Å; V141-V184 PolarHBondContact O-N 3.34Å
142	Q	87.9	Confident	69	Low	101 Å²	101	76.1 Å²	76.1	47%	0.472	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	125.2	-180	-173.2	-177.6	-23.6	0	0	112	S140 N144 T181	S140-Q142 PolarHBondContact O-N 3.27Å; Q142-N144 PolarHBondContact NE2-ND2 3.19Å; Q142-N144 VanDerWaalsContact NE2-ND2 3.17Å; Q142-N144 PolarHBondContact NE2-OD1 2.66Å; Q142-T181 HydrophobicContact CG-CG2 3.34Å
143	F	88.6	Confident	72	Confident	22 Å²	22	78 Å²	78	10%	0.096	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	116.9	174.2	-63.5	-82.6	0	0	0	110.9	V141 L146 T181 L182 V184 R254 I255 S258	V141-F143 HydrophobicContact CB-CE2 4.01Å; V141-F143 HydrophobicContact CB-CZ 4.42Å; V141-F143 HydrophobicContact CG1-CD2 4.3Å; V141-F143 HydrophobicContact CG1-CE1 4.29Å; V141-F143 HydrophobicContact CG1-CE2 3.57Å; V141-F143 HydrophobicContact CG1-CZ 3.56Å; F143-L146 HydrophobicContact CB-CD1 3.9Å; F143-T181 WeakPolarHBondContact O-CA 3.48Å; F143-L182 HydrophobicContact CB-CB 4.42Å; F143-L182 PolarHBondContact N-O 3.1Å; F143-L182 PolarHBondContact O-N 2.87Å; F143-V184 HydrophobicContact CD2-CG2 4.16Å; F143-V184 HydrophobicContact CE2-CB 4.39Å; F143-V184 HydrophobicContact CE2-CG2 4Å; F143-R254 HydrophobicContact CE1-CB 4.17Å; F143-I255 HydrophobicContact CB-CD1 4.4Å; F143-I255 HydrophobicContact CB-CG1 4.19Å; F143-I255 HydrophobicContact CD1-CD1 4.19Å; F143-I255 HydrophobicContact CD1-CG1 3.38Å; F143-I255 HydrophobicContact CD2-CG1 3.94Å; F143-I255 HydrophobicContact CE1-CB 4.42Å; F143-I255 HydrophobicContact CE1-CG1 3.57Å; F143-I255 HydrophobicContact CE2-CG1 4.11Å; F143-I255 HydrophobicContact CG-CD1 4.28Å; F143-I255 HydrophobicContact CG-CG1 3.57Å; F143-I255 HydrophobicContact CZ-CB 4.37Å; F143-I255 HydrophobicContact CZ-CG1 3.93Å; F143-S258 WeakPolarHBondContact CZ-OG 3.39Å
144	N	84.8	Confident	74.7	Confident	81 Å²	81	72.9 Å²	72.9	43%	0.433	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	164.2	179.4	-64.8	-57.8	0	0	0	110.9	Q142 T181 Q197	Q142-N144 PolarHBondContact NE2-ND2 3.19Å; Q142-N144 VanDerWaalsContact NE2-ND2 3.17Å; Q142-N144 PolarHBondContact NE2-OD1 2.66Å; N144-T181 WeakPolarHBondContact OD1-CG2 3.32Å; N144-T181 PolarHBondContact OD1-OG1 3.03Å; N144-T181 VanDerWaalsContact OD1-OG1 3.08Å; N144-Q197 PolarHBondContact OD1-NE2 3.25Å
145	K	84.7	Confident	77.2	Confident	131 Å²	131	77.1 Å²	77.1	57%	0.57	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	63.5	41.8	-176.9	-49.6	-180	-179.6	179.5	0	113	H247	K145-H247 HydrophobicContact CB-CB 4.22Å; K145-H247 PolarHBondContact O-N 2.68Å; K145-H247 PolarHBondContact O-ND1 3.48Å
146	L	90.1	Very high	79.5	Confident	2 Å²	2	72.1 Å²	72.1	1%	0.01	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	157.3	167.3	-56.1	-177.3	0	0	0	109.3	F143 P179 I180 L182 F227 C246 I255	F143-L146 HydrophobicContact CB-CD1 3.9Å; L146-P179 WeakPolarHBondContact O-CA 3.46Å; L146-I180 HydrophobicContact CB-CD1 3.61Å; L146-I180 HydrophobicContact CB-CG1 3.94Å; L146-I180 HydrophobicContact CD1-CD1 3.87Å; L146-I180 HydrophobicContact CG-CD1 4.33Å; L146-I180 PolarHBondContact N-O 2.88Å; L146-I180 PolarHBondContact O-N 3.1Å; L146-L182 HydrophobicContact CD1-CB 3.65Å; L146-L182 HydrophobicContact CD1-CD2 4.23Å; L146-F227 HydrophobicContact CD1-CE1 4.36Å; L146-F227 HydrophobicContact CD1-CZ 4.32Å; L146-F227 HydrophobicContact CD2-CE1 4.43Å; L146-C246 HydrophobicContact CD2-CB 4.04Å; L146-C246 WeakPolarHBondContact CD2-SG 3.49Å; L146-I255 HydrophobicContact CD1-CD1 4.01Å; L146-I255 HydrophobicContact CD2-CD1 3.77Å
147	S	90.6	Very high	81.7	Confident	8 Å²	8	66.6 Å²	66.6	6%	0.056	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	135.2	163.1	-47.9	0	0	0	0	110.2	P177 I178 F244 S245 H247	S147-P177 VanDerWaalsContact CB-CB 3.48Å; S147-I178 CarbonylContact C-O 3.48Å; S147-I178 WeakPolarHBondContact CA-O 3.48Å; S147-F244 CarbonylContact O-C 3.6Å; S147-F244 VanDerWaalsContact O-CA 3.27Å; S147-F244 WeakPolarHBondContact O-CA 3.49Å; S147-S245 PolarHBondContact N-O 3.41Å; S147-S245 PolarHBondContact O-N 3.06Å; S147-H247 PolarHBondContact OG-CE1 3.17Å
148	Y	92.6	Very high	83.8	Confident	24 Å²	24	66.2 Å²	66.2	9%	0.094	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	126.2	171.1	-173.5	-136.8	0	0	0	109.3	G150 C151 I178 I194 I203 H242 V243 F244	Y148-G150 WeakPolarHBondContact CE2-O 3.49Å; Y148-C151 WeakPolarHBondContact OH-CB 3.47Å; Y148-C151 PolarHBondContact OH-SG 2.72Å; Y148-C151 VanDerWaalsContact OH-SG 3.42Å; Y148-I178 PolarHBondContact N-O 2.95Å; Y148-I178 PolarHBondContact O-N 2.88Å; Y148-I194 HydrophobicContact CE2-CD1 4.45Å; Y148-I203 HydrophobicContact CE1-CG2 4.34Å; Y148-H242 HydrophobicContact CE2-CB 4.06Å; Y148-H242 AromaticContact CZ-ND1 3.93Å; Y148-H242 PolarHBondContact OH-ND1 2.75Å; Y148-V243 VanDerWaalsContact CD2-O 3.29Å; Y148-V243 WeakPolarHBondContact CD2-O 3.26Å; Y148-F244 AromaticContact CD2-CD1 3.8Å; Y148-F244 HydrophobicContact CD2-CD1 3.8Å; Y148-F244 AromaticContact CD2-CE1 3.44Å; Y148-F244 HydrophobicContact CD2-CE1 3.44Å; Y148-F244 VanDerWaalsContact CD2-CE1 3.44Å; Y148-F244 HydrophobicContact CD2-CG 4.48Å; Y148-F244 AromaticContact CD2-CZ 3.83Å; Y148-F244 HydrophobicContact CD2-CZ 3.83Å; Y148-F244 HydrophobicContact CE2-CE1 4.01Å; Y148-F244 AromaticContact CE2-CZ 3.92Å; Y148-F244 HydrophobicContact CE2-CZ 3.92Å; Y148-F244 HydrophobicContact CG-CE1 4.25Å
149	L	89	Confident	85.4	Confident	14 Å²	14	65.8 Å²	65.8	7%	0.073	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	1.3	177.5	-52	-170.3	0	0	0	112.1	L170 R171 P177 V243	L149-L170 HydrophobicContact CB-CB 4.41Å; L149-R171 HydrophobicContact CD1-CB 4.05Å; L149-R171 HydrophobicContact CD1-CG 4.23Å; L149-P177 HydrophobicContact CD2-CB 3.76Å; L149-P177 HydrophobicContact CD2-CG 3.93Å; L149-V243 HydrophobicContact CB-CB 4.31Å; L149-V243 HydrophobicContact CB-CG1 4Å; L149-V243 HydrophobicContact CD1-CG1 3.91Å; L149-V243 HydrophobicContact CG-CG1 4.24Å; L149-V243 PolarHBondContact N-O 2.71Å
150	G	88.4	Confident	86.5	Confident	20 Å²	20	64.2 Å²	64.2	21%	0.206	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	100.3	-164.1	-178.4	0	0	0	0	0	113.4	Y148 V243	Y148-G150 WeakPolarHBondContact CE2-O 3.49Å; G150-V243 PolarHBondContact O-N 3.44Å
151	C	90.1	Very high	86.9	Confident	48 Å²	48	65.1 Å²	65.1	32%	0.324	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	159.4	-177.1	57.4	0	0	0	0	112.7	Y148 Q240 I241	Y148-C151 WeakPolarHBondContact OH-CB 3.47Å; Y148-C151 PolarHBondContact OH-SG 2.72Å; Y148-C151 VanDerWaalsContact OH-SG 3.42Å; C151-Q240 HydrophobicContact CB-CG 3.73Å; C151-Q240 VanDerWaalsContact SG-CD 3.51Å; C151-Q240 PolarHBondContact SG-OE1 3.46Å; C151-I241 CarbonylContact C-O 3.46Å; C151-I241 WeakPolarHBondContact CA-O 3.32Å; C151-I241 WeakPolarHBondContact CB-O 3.42Å
152	T	90.9	Very high	87	Confident	56 Å²	56	64.3 Å²	64.3	34%	0.344	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	159.3	178.8	-166.5	0	0	0	0	112	A166 L170 Q240 I241	T152-A166 HydrophobicContact CG2-CB 3.79Å; T152-L170 HydrophobicContact CG2-CD1 4.06Å; T152-Q240 CarbonylContact O-C 3.58Å; T152-Q240 WeakPolarHBondContact O-CA 3.43Å; T152-I241 PolarHBondContact N-O 2.75Å; T152-I241 PolarHBondContact O-N 3.35Å
153	W	89.2	Confident	87.1	Confident	145 Å²	145	59.5 Å²	59.5	55%	0.549	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	139.3	-177.8	-61.1	100.2	0	0	0	111.9	Y233 D238 F239 Q240	W153-Y233 AromaticContact CH2-CD1 3.49Å; W153-Y233 HydrophobicContact CH2-CD1 3.49Å; W153-Y233 VanDerWaalsContact CH2-CD1 3.49Å; W153-Y233 AromaticContact CH2-CE1 3.98Å; W153-Y233 HydrophobicContact CH2-CE1 3.98Å; W153-Y233 AromaticContact CH2-CG 3.87Å; W153-Y233 HydrophobicContact CH2-CG 3.87Å; W153-Y233 HydrophobicContact CZ3-CD1 4.05Å; W153-Y233 HydrophobicContact CZ3-CG 4.12Å; W153-D238 HydrophobicContact CZ3-CB 4.05Å; W153-F239 WeakPolarHBondContact CA-O 3.44Å; W153-Q240 HydrophobicContact CE3-CB 4.36Å; W153-Q240 HydrophobicContact CZ3-CB 4.4Å
154	V	86.8	Confident	87.1	Confident	19 Å²	19	59.9 Å²	59.9	12%	0.115	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	161.8	176.8	-64.9	0	0	0	0	112.2	E162 T230 F239 I241	V154-E162 HydrophobicContact CG1-CB 4.4Å; V154-T230 HydrophobicContact CG2-CG2 3.99Å; V154-F239 HydrophobicContact CG2-CB 3.91Å; V154-F239 PolarHBondContact N-O 2.82Å; V154-I241 HydrophobicContact CB-CD1 4.3Å; V154-I241 HydrophobicContact CB-CG1 4.27Å; V154-I241 HydrophobicContact CG1-CB 4.45Å; V154-I241 HydrophobicContact CG1-CD1 3.54Å; V154-I241 HydrophobicContact CG1-CG1 3.65Å; V154-I241 HydrophobicContact CG2-CD1 4Å; V154-I241 HydrophobicContact CG2-CG1 3.65Å
155	K	78.1	Confident	87.3	Confident	196 Å²	196	62.7 Å²	62.7	85%	0.852	30%	0.302	S	S	*	.	S	Bend	trans	-106.9	-25.8	-178.6	-66.8	-172.1	176.7	-173.6	0	113	E162	K155-E162 PolarHBondContact N-OE2 3.06Å
156	A	80.9	Confident	87.5	Confident	34 Å²	34	56.8 Å²	56.8	28%	0.281	28%	0.278	S	S	.	.			trans	-116.2	94.5	175.7	0	0	0	0	0	110.2	R158 N159 E162	A156-R158 PolarHBondContact O-N 2.78Å; A156-N159 HydrophobicContact CB-CB 3.54Å; A156-N159 WeakPolarHBondContact O-CB 3.5Å; A156-N159 PolarHBondContact O-N 3.07Å; A156-E162 WeakPolarHBondContact CB-OE1 3.19Å; A156-E162 PolarHBondContact N-OE2 3.05Å; A156-E162 VanDerWaalsContact N-OE2 3.08Å
157	P	81.2	Confident	87.6	Confident	27 Å²	27	56.7 Å²	56.7	18%	0.175	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-7.2	-168.1	26.2	-36.3	0	0	0	115.6	L212 F213 T230 F239	P157-L212 HydrophobicContact CB-CB 4.46Å; P157-L212 HydrophobicContact CB-CD1 3.81Å; P157-L212 HydrophobicContact CG-CD1 4.17Å; P157-F213 WeakPolarHBondContact O-CB 3.43Å; P157-T230 HydrophobicContact CB-CG2 3.9Å; P157-T230 PolarHBondContact O-OG1 3.31Å; P157-F239 HydrophobicContact CB-CB 4.01Å; P157-F239 HydrophobicContact CB-CD1 3.72Å; P157-F239 HydrophobicContact CB-CD2 3.98Å; P157-F239 HydrophobicContact CB-CE1 4.18Å; P157-F239 HydrophobicContact CB-CE2 4.4Å; P157-F239 HydrophobicContact CB-CG 3.61Å; P157-F239 HydrophobicContact CB-CZ 4.49Å; P157-F239 HydrophobicContact CG-CD1 3.96Å; P157-F239 HydrophobicContact CG-CD2 3.78Å; P157-F239 HydrophobicContact CG-CE1 3.93Å; P157-F239 HydrophobicContact CG-CE2 3.74Å; P157-F239 HydrophobicContact CG-CG 3.89Å; P157-F239 HydrophobicContact CG-CZ 3.82Å
158	R	85.8	Confident	87.5	Confident	179 Å²	179	58 Å²	58	68%	0.675	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.8	16.2	176.9	-68.1	-179.1	170.9	164.7	2.1	112.7	A156 E160 L212 F213	A156-R158 PolarHBondContact O-N 2.78Å; R158-E160 PolarHBondContact O-N 2.83Å; R158-L212 PolarHBondContact NE-O 2.9Å; R158-F213 HydrophobicContact CB-CD2 4.39Å; R158-F213 HydrophobicContact CB-CG 4.48Å; R158-F213 HydrophobicContact CG-CB 4.08Å; R158-F213 HydrophobicContact CG-CD2 4.45Å; R158-F213 HydrophobicContact CG-CG 4.45Å
159	N	87.3	Confident	87.3	Confident	57 Å²	57	60.1 Å²	60.1	31%	0.305	30%	0.304	S	S	.	.			trans	-90.6	103.7	-179	-176.3	-0.1	0	0	0	110.8	A156 A161 E162 A163	A156-N159 HydrophobicContact CB-CB 3.54Å; A156-N159 WeakPolarHBondContact O-CB 3.5Å; A156-N159 PolarHBondContact O-N 3.07Å; N159-A161 PolarHBondContact O-N 3.35Å; N159-A161 WeakPolarHBondContact OD1-CB 3.44Å; N159-A161 PolarHBondContact OD1-N 3.05Å; N159-A161 VanDerWaalsContact OD1-N 3.07Å; N159-E162 HydrophobicContact CB-CB 4.15Å; N159-E162 HydrophobicContact CB-CG 4.36Å; N159-E162 PolarHBondContact ND2-OE1 2.89Å; N159-E162 PolarHBondContact O-N 3.42Å; N159-A163 PolarHBondContact O-N 3.3Å; N159-A163 VanDerWaalsContact O-N 3.13Å
160	E	87.9	Confident	87.3	Confident	101 Å²	101	60.4 Å²	60.4	47%	0.472	31%	0.306	S	S	.	.	H	α-helix	trans	-55	-36.8	177.5	-156.3	-151.3	135.4	0	0	112.2	R158 E162 A163 Q164 F213 A215	R158-E160 PolarHBondContact O-N 2.83Å; E160-E162 VanDerWaalsContact C-N 3.28Å; E160-E162 PolarHBondContact O-N 3.1Å; E160-A163 PolarHBondContact O-N 2.89Å; E160-A163 VanDerWaalsContact O-N 3.14Å; E160-Q164 HydrophobicContact CG-CG 4.33Å; E160-Q164 VanDerWaalsContact O-CG 3.28Å; E160-Q164 WeakPolarHBondContact O-CG 3.31Å; E160-Q164 PolarHBondContact O-N 3.34Å; E160-Q164 PolarHBondContact OE1-NE2 3.22Å; E160-F213 HydrophobicContact CB-CE1 4.3Å; E160-F213 HydrophobicContact CB-CZ 3.96Å; E160-F213 HydrophobicContact CG-CE1 4.49Å; E160-F213 HydrophobicContact CG-CZ 4.17Å; E160-A215 HydrophobicContact CG-CB 4.44Å
161	A	85.9	Confident	87.2	Confident	48 Å²	48	63 Å²	63	40%	0.397	31%	0.309	S	S	.	.	H	α-helix	trans	-68.9	-24.1	178.9	0	0	0	0	0	113.3	N159 R165	N159-A161 PolarHBondContact O-N 3.35Å; N159-A161 WeakPolarHBondContact OD1-CB 3.44Å; N159-A161 PolarHBondContact OD1-N 3.05Å; N159-A161 VanDerWaalsContact OD1-N 3.07Å; A161-R165 WeakPolarHBondContact O-CG 3.47Å; A161-R165 PolarHBondContact O-N 3.12Å; A161-R165 PolarHBondContact O-NH1 3.24Å
162	E	87.3	Confident	86.9	Confident	38 Å²	38	65 Å²	65	18%	0.178	33%	0.329	C	S	.	.	H	α-helix	trans	-75.3	-42.9	168.2	-82.5	167.8	-126.4	0	0	110.9	V154 K155 A156 N159 E160 R165 A166	V154-E162 HydrophobicContact CG1-CB 4.4Å; K155-E162 PolarHBondContact N-OE2 3.06Å; A156-E162 WeakPolarHBondContact CB-OE1 3.19Å; A156-E162 PolarHBondContact N-OE2 3.05Å; A156-E162 VanDerWaalsContact N-OE2 3.08Å; N159-E162 HydrophobicContact CB-CB 4.15Å; N159-E162 HydrophobicContact CB-CG 4.36Å; N159-E162 PolarHBondContact ND2-OE1 2.89Å; N159-E162 PolarHBondContact O-N 3.42Å; E160-E162 VanDerWaalsContact C-N 3.28Å; E160-E162 PolarHBondContact O-N 3.1Å; E162-R165 PolarHBondContact O-N 2.86Å; E162-A166 WeakPolarHBondContact O-CB 3.4Å; E162-A166 PolarHBondContact O-N 3.49Å
163	A	88.4	Confident	86.5	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-61.6	-45	176.6	0	0	0	0	0	113	N159 E160 R165 A166 M167 F213 A215 I241	N159-A163 PolarHBondContact O-N 3.3Å; N159-A163 VanDerWaalsContact O-N 3.13Å; E160-A163 PolarHBondContact O-N 2.89Å; E160-A163 VanDerWaalsContact O-N 3.14Å; A163-R165 VanDerWaalsContact C-N 3.31Å; A163-R165 PolarHBondContact O-N 3.17Å; A163-A166 PolarHBondContact O-N 3.35Å; A163-M167 WeakPolarHBondContact O-CG 3.45Å; A163-M167 PolarHBondContact O-N 3.11Å; A163-F213 HydrophobicContact CB-CE1 4.24Å; A163-A215 HydrophobicContact CB-CB 3.69Å; A163-I241 HydrophobicContact CB-CD1 3.92Å
164	Q	90.3	Very high	85.8	Confident	30 Å²	30	63.4 Å²	63.4	14%	0.14	33%	0.327	C	S	.	.	H	α-helix	trans	-60.5	-38.7	175.5	-63.6	-69.7	-3.6	0	0	111.8	E160 A168 R216	E160-Q164 HydrophobicContact CG-CG 4.33Å; E160-Q164 VanDerWaalsContact O-CG 3.28Å; E160-Q164 WeakPolarHBondContact O-CG 3.31Å; E160-Q164 PolarHBondContact O-N 3.34Å; E160-Q164 PolarHBondContact OE1-NE2 3.22Å; Q164-A168 PolarHBondContact O-N 2.91Å; Q164-A168 VanDerWaalsContact O-N 3.14Å; Q164-R216 PolarHBondContact NE2-O 2.95Å
165	R	88.2	Confident	84.4	Confident	139 Å²	139	67.1 Å²	67.1	53%	0.525	36%	0.36	S	S	.	.	H	α-helix	trans	-68.5	-43.9	174.8	-73.9	-170.9	-57.9	-92.4	9.6	112	A161 E162 A163 M167 A168 T169	A161-R165 WeakPolarHBondContact O-CG 3.47Å; A161-R165 PolarHBondContact O-N 3.12Å; A161-R165 PolarHBondContact O-NH1 3.24Å; E162-R165 PolarHBondContact O-N 2.86Å; A163-R165 VanDerWaalsContact C-N 3.31Å; A163-R165 PolarHBondContact O-N 3.17Å; R165-M167 VanDerWaalsContact C-N 3.31Å; R165-M167 PolarHBondContact O-N 3.05Å; R165-A168 PolarHBondContact O-N 3.21Å; R165-T169 WeakPolarHBondContact O-CB 3.45Å; R165-T169 PolarHBondContact O-N 3.31Å; R165-T169 PolarHBondContact O-OG1 3.45Å
166	A	88.7	Confident	84	Confident	8 Å²	8	64.9 Å²	64.9	7%	0.066	36%	0.356	C	S	.	.	H	α-helix	trans	-59.6	-41.5	176.3	0	0	0	0	0	111.8	T152 E162 A163 L170 I241 V243	T152-A166 HydrophobicContact CG2-CB 3.79Å; E162-A166 WeakPolarHBondContact O-CB 3.4Å; E162-A166 PolarHBondContact O-N 3.49Å; A163-A166 PolarHBondContact O-N 3.35Å; A166-L170 WeakPolarHBondContact O-CB 3.43Å; A166-L170 WeakPolarHBondContact O-CG 3.32Å; A166-L170 PolarHBondContact O-N 3.06Å; A166-I241 HydrophobicContact CB-CB 4.37Å; A166-I241 HydrophobicContact CB-CD1 4.38Å; A166-I241 HydrophobicContact CB-CG2 4.12Å; A166-V243 HydrophobicContact CB-CG2 4.5Å
167	M	91.8	Very high	83.9	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-62.6	-46.2	175.6	-71.6	-172.9	-75.3	0	0	112.4	A163 R165 R171 A215 C226 S228 V243	A163-M167 WeakPolarHBondContact O-CG 3.45Å; A163-M167 PolarHBondContact O-N 3.11Å; R165-M167 VanDerWaalsContact C-N 3.31Å; R165-M167 PolarHBondContact O-N 3.05Å; M167-R171 VanDerWaalsContact O-CB 3.25Å; M167-R171 WeakPolarHBondContact O-CB 3.49Å; M167-R171 PolarHBondContact O-N 3.49Å; M167-R171 VanDerWaalsContact O-N 3.12Å; M167-A215 HydrophobicContact CE-CB 4.16Å; M167-C226 HydrophobicContact SD-CB 4.22Å; M167-S228 PolarHBondContact SD-OG 3.03Å; M167-S228 VanDerWaalsContact SD-OG 3.35Å; M167-V243 HydrophobicContact CB-CG1 4.35Å; M167-V243 HydrophobicContact CG-CG1 3.97Å; M167-V243 HydrophobicContact CG-CG2 3.97Å
168	A	88.4	Confident	84.1	Confident	35 Å²	35	68.2 Å²	68.2	29%	0.289	37%	0.369	S	S	.	.	H	α-helix	trans	-64.7	-46.2	177.8	0	0	0	0	0	112.7	Q164 R165 A172 E223	Q164-A168 PolarHBondContact O-N 2.91Å; Q164-A168 VanDerWaalsContact O-N 3.14Å; R165-A168 PolarHBondContact O-N 3.21Å; A168-A172 PolarHBondContact O-N 2.86Å; A168-A172 VanDerWaalsContact O-N 3.12Å; A168-E223 HydrophobicContact CB-CG 4.31Å; A168-E223 WeakPolarHBondContact CB-OE1 3.47Å
169	T	89.1	Confident	84.2	Confident	69 Å²	69	62.6 Å²	62.6	42%	0.423	36%	0.356	S	S	.	.	H	α-helix	trans	-63.9	-52.7	179.6	-66.1	0	0	0	0	111.9	R165 R171 A172 E173	R165-T169 WeakPolarHBondContact O-CB 3.45Å; R165-T169 PolarHBondContact O-N 3.31Å; R165-T169 PolarHBondContact O-OG1 3.45Å; T169-R171 VanDerWaalsContact C-N 3.27Å; T169-R171 PolarHBondContact O-N 2.92Å; T169-A172 PolarHBondContact O-N 3.24Å; T169-E173 HydrophobicContact CG2-CG 4.38Å; T169-E173 WeakPolarHBondContact CG2-OE1 3.41Å; T169-E173 WeakPolarHBondContact O-CG 3.44Å; T169-E173 PolarHBondContact O-N 3.35Å
170	L	88.6	Confident	84.5	Confident	19 Å²	19	59.9 Å²	59.9	10%	0.099	34%	0.341	C	S	.	.	H	α-helix	trans	-66.7	-28.8	-177.7	-71.4	168.4	0	0	0	112.2	L149 T152 A166 S174 V243	L149-L170 HydrophobicContact CB-CB 4.41Å; T152-L170 HydrophobicContact CG2-CD1 4.06Å; A166-L170 WeakPolarHBondContact O-CB 3.43Å; A166-L170 WeakPolarHBondContact O-CG 3.32Å; A166-L170 PolarHBondContact O-N 3.06Å; L170-S174 WeakPolarHBondContact O-CB 3.41Å; L170-S174 PolarHBondContact O-N 3.36Å; L170-V243 HydrophobicContact CB-CB 4.39Å; L170-V243 HydrophobicContact CB-CG2 4.45Å; L170-V243 HydrophobicContact CD1-CB 4.01Å; L170-V243 HydrophobicContact CD1-CG2 3.59Å
171	R	85.8	Confident	84.6	Confident	76 Å²	76	55.7 Å²	55.7	29%	0.287	32%	0.323	S	S	.	.	H	α-helix	trans	-66.1	-39.8	169.9	-166.2	-161.7	-165.3	90.9	-1.3	112.8	L149 M167 T169 V222 D225 C226	L149-R171 HydrophobicContact CD1-CB 4.05Å; L149-R171 HydrophobicContact CD1-CG 4.23Å; M167-R171 VanDerWaalsContact O-CB 3.25Å; M167-R171 WeakPolarHBondContact O-CB 3.49Å; M167-R171 PolarHBondContact O-N 3.49Å; M167-R171 VanDerWaalsContact O-N 3.12Å; T169-R171 VanDerWaalsContact C-N 3.27Å; T169-R171 PolarHBondContact O-N 2.92Å; R171-V222 PolarHBondContact NH1-O 3.26Å; R171-V222 PolarHBondContact NH2-O 3.08Å; R171-V222 VanDerWaalsContact NH2-O 3.07Å; R171-D225 IonicContact CZ-OD1 3.76Å; R171-D225 VanDerWaalsContact CZ-OD1 3.29Å; R171-D225 IonicContact CZ-OD2 2.63Å; R171-D225 IonicContact NH1-OD1 2.86Å; R171-D225 PolarHBondContact NH1-OD1 3.45Å; R171-D225 IonicContact NH1-OD2 3.23Å; R171-D225 VanDerWaalsContact NH2-CG 3.33Å; R171-D225 IonicContact NH2-OD1 2.73Å; R171-D225 PolarHBondContact NH2-OD1 3.06Å; R171-D225 IonicContact NH2-OD2 2.84Å; R171-D225 PolarHBondContact NH2-OD2 3.44Å; R171-C226 PolarHBondContact NH1-SG 2.99Å
172	A	84.3	Confident	84.8	Confident	90 Å²	90	53.4 Å²	53.4	74%	0.744	30%	0.304	S	S	*	.	H	α-helix	trans	-73.6	-30.1	179.2	0	0	0	0	0	113.1	A168 T169	A168-A172 PolarHBondContact O-N 2.86Å; A168-A172 VanDerWaalsContact O-N 3.12Å; T169-A172 PolarHBondContact O-N 3.24Å
173	E	82.6	Confident	85	Confident	138 Å²	138	53.1 Å²	53.1	65%	0.645	30%	0.303	S	S	*	.	H	α-helix	trans	-90.7	-24	-178	-67.4	175.2	174.1	0	0	113.5	T169 A175	T169-E173 HydrophobicContact CG2-CG 4.38Å; T169-E173 WeakPolarHBondContact CG2-OE1 3.41Å; T169-E173 WeakPolarHBondContact O-CG 3.44Å; T169-E173 PolarHBondContact O-N 3.35Å; E173-A175 PolarHBondContact O-N 3.32Å
174	S	73.7	Confident	85	Confident	29 Å²	29	53.2 Å²	53.2	20%	0.203	30%	0.303	C	S	.	.			trans	-73.4	80.4	-178.5	171.8	0	0	0	0	113.4	L170 I176	L170-S174 WeakPolarHBondContact O-CB 3.41Å; L170-S174 PolarHBondContact O-N 3.36Å; S174-I176 VanDerWaalsContact C-N 3.26Å; S174-I176 PolarHBondContact O-N 3.19Å
175	A	57.6	Low	84.7	Confident	97 Å²	97	52 Å²	52	80%	0.802	30%	0.297	S	S	*	.	S	Bend	trans	-61.9	-25.9	176.6	0	0	0	0	0	114.8	E173	E173-A175 PolarHBondContact O-N 3.32Å
176	I	70.6	Confident	83.9	Confident	149 Å²	149	47 Å²	47	76%	0.764	28%	0.284	S	S	*	.	S	Bend	trans	-140.5	96.6	175.2	-52.5	178.6	0	0	0	109.1	S174	S174-I176 VanDerWaalsContact C-N 3.26Å; S174-I176 PolarHBondContact O-N 3.19Å
177	P	78.9	Confident	82.8	Confident	52 Å²	52	47.8 Å²	47.8	34%	0.338	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-63	134.5	173.5	-23.6	35.1	0	0	0	112.1	S147 L149 P179	S147-P177 VanDerWaalsContact CB-CB 3.48Å; L149-P177 HydrophobicContact CD2-CB 3.76Å; L149-P177 HydrophobicContact CD2-CG 3.93Å; P177-P179 WeakPolarHBondContact O-CD 3.4Å
178	I	85.3	Confident	81.4	Confident	78 Å²	78	49.3 Å²	49.3	40%	0.4	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	122.3	178.5	-58.1	173.7	0	0	0	109	S147 Y148 I180 I203	S147-I178 CarbonylContact C-O 3.48Å; S147-I178 WeakPolarHBondContact CA-O 3.48Å; Y148-I178 PolarHBondContact N-O 2.95Å; Y148-I178 PolarHBondContact O-N 2.88Å; I178-I180 HydrophobicContact CG2-CG2 4.08Å; I178-I180 PolarHBondContact O-N 3.11Å; I178-I203 HydrophobicContact CG2-CD1 4.07Å
179	P	88.4	Confident	80.3	Confident	61 Å²	61	53.4 Å²	53.4	40%	0.396	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	123	175.7	-18.9	33	0	0	0	111.1	L146 P177 Q197	L146-P179 WeakPolarHBondContact O-CA 3.46Å; P177-P179 WeakPolarHBondContact O-CD 3.4Å; P179-Q197 HydrophobicContact CB-CB 4.33Å; P179-Q197 PolarHBondContact O-N 2.96Å
180	I	92	Very high	79.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	152.6	-177.7	67.5	91.3	0	0	0	113.5	L146 I178 L182 I194 V195 Q197 I203 F244	L146-I180 HydrophobicContact CB-CD1 3.61Å; L146-I180 HydrophobicContact CB-CG1 3.94Å; L146-I180 HydrophobicContact CD1-CD1 3.87Å; L146-I180 HydrophobicContact CG-CD1 4.33Å; L146-I180 PolarHBondContact N-O 2.88Å; L146-I180 PolarHBondContact O-N 3.1Å; I178-I180 HydrophobicContact CG2-CG2 4.08Å; I178-I180 PolarHBondContact O-N 3.11Å; I180-L182 HydrophobicContact CD1-CB 3.82Å; I180-I194 HydrophobicContact CB-CG2 4.01Å; I180-I194 HydrophobicContact CD1-CG2 4.22Å; I180-I194 HydrophobicContact CG1-CG2 4.18Å; I180-I194 HydrophobicContact CG2-CG2 3.89Å; I180-V195 CarbonylContact C-O 3.54Å; I180-V195 VanDerWaalsContact CA-O 3.24Å; I180-V195 WeakPolarHBondContact CA-O 3.24Å; I180-V195 WeakPolarHBondContact CB-O 3.19Å; I180-Q197 VanDerWaalsContact C-CG 3.44Å; I180-I203 HydrophobicContact CG2-CD1 3.54Å; I180-F244 HydrophobicContact CD1-CD1 3.99Å; I180-F244 HydrophobicContact CD1-CE1 4.16Å; I180-F244 HydrophobicContact CG1-CD1 4.24Å; I180-F244 HydrophobicContact CG1-CE1 4.49Å
181	T	90.3	Very high	79.6	Confident	13 Å²	13	50.8 Å²	50.8	8%	0.08	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.9	158.3	-62.1	0	0	0	0	108.1	Q142 F143 N144 H183 V195 Q197	Q142-T181 HydrophobicContact CG-CG2 3.34Å; F143-T181 WeakPolarHBondContact O-CA 3.48Å; N144-T181 WeakPolarHBondContact OD1-CG2 3.32Å; N144-T181 PolarHBondContact OD1-OG1 3.03Å; N144-T181 VanDerWaalsContact OD1-OG1 3.08Å; T181-H183 WeakPolarHBondContact CG2-NE2 3.44Å; T181-V195 PolarHBondContact N-O 3.48Å; T181-V195 PolarHBondContact O-N 3.09Å; T181-Q197 PolarHBondContact OG1-NE2 3.31Å
182	L	91.6	Very high	79.8	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	125.8	173.7	-178.8	69.9	0	0	0	109.5	F143 L146 I180 V184 V192 R193 I194 F227 I255 F259	F143-L182 HydrophobicContact CB-CB 4.42Å; F143-L182 PolarHBondContact N-O 3.1Å; F143-L182 PolarHBondContact O-N 2.87Å; L146-L182 HydrophobicContact CD1-CB 3.65Å; L146-L182 HydrophobicContact CD1-CD2 4.23Å; I180-L182 HydrophobicContact CD1-CB 3.82Å; L182-V184 HydrophobicContact CD2-CG2 4.12Å; L182-V184 HydrophobicContact CG-CG2 4.15Å; L182-V192 HydrophobicContact CD1-CG1 3.81Å; L182-R193 WeakPolarHBondContact CA-O 3.12Å; L182-I194 HydrophobicContact CD1-CG1 4.04Å; L182-F227 HydrophobicContact CD2-CE2 4.19Å; L182-F227 HydrophobicContact CD2-CZ 3.85Å; L182-I255 HydrophobicContact CD2-CG2 4.04Å; L182-F259 HydrophobicContact CD2-CE2 4.05Å; L182-F259 HydrophobicContact CD2-CZ 4.31Å
183	H	90.5	Very high	80.1	Confident	33 Å²	33	45.5 Å²	45.5	15%	0.153	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	128.2	169.3	-62.7	-104	0	0	0	109.3	V141 T181 V192 R193	V141-H183 WeakPolarHBondContact O-CA 3.47Å; T181-H183 WeakPolarHBondContact CG2-NE2 3.44Å; H183-V192 WeakPolarHBondContact O-CA 3.37Å; H183-R193 HydrophobicContact CB-CB 4.19Å; H183-R193 PolarHBondContact N-O 3.11Å; H183-R193 PolarHBondContact O-N 2.91Å; H183-R193 VanDerWaalsContact O-N 3.11Å
184	V	88.5	Confident	80.5	Confident	1 Å²	1	39 Å²	39	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	120.1	173.7	-175.5	0	0	0	0	108	S140 V141 F143 L182 I208 F259	S140-V184 CarbonylContact C-O 3.55Å; S140-V184 WeakPolarHBondContact CA-O 3.18Å; V141-V184 PolarHBondContact N-O 2.98Å; V141-V184 PolarHBondContact O-N 3.34Å; F143-V184 HydrophobicContact CD2-CG2 4.16Å; F143-V184 HydrophobicContact CE2-CB 4.39Å; F143-V184 HydrophobicContact CE2-CG2 4Å; L182-V184 HydrophobicContact CD2-CG2 4.12Å; L182-V184 HydrophobicContact CG-CG2 4.15Å; V184-I208 HydrophobicContact CG1-CD1 4.42Å; V184-F259 HydrophobicContact CG1-CD1 4.1Å; V184-F259 HydrophobicContact CG1-CD2 4.42Å; V184-F259 HydrophobicContact CG1-CE1 4.3Å; V184-F259 HydrophobicContact CG1-CG 4.16Å; V184-F259 HydrophobicContact CG2-CD2 4.15Å; V184-F259 HydrophobicContact CG2-CE1 4.41Å; V184-F259 HydrophobicContact CG2-CE2 3.72Å; V184-F259 HydrophobicContact CG2-CZ 3.86Å
185	P	84.5	Confident	81.3	Confident	4 Å²	4	38.7 Å²	38.7	3%	0.026	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	146.7	-173.5	28.9	-35.8	0	0	0	112.2	G187 V192 I208 A262	P185-G187 PolarHBondContact O-N 3.08Å; P185-V192 HydrophobicContact CG-CG2 4.4Å; P185-I208 HydrophobicContact CG-CB 3.96Å; P185-I208 HydrophobicContact CG-CD1 4.02Å; P185-I208 HydrophobicContact CG-CG2 4.14Å; P185-A262 WeakPolarHBondContact O-CB 3.25Å
186	C	71.9	Confident	82.8	Confident	36 Å²	36	35.3 Å²	35.3	24%	0.243	20%	0.203	C	C	.	.	S	Bend	trans	-78.1	-6.5	179.7	-66	0	0	0	0	113.9	D139 R265	D139-C186 HydrophobicContact CB-CB 4.44Å; D139-C186 WeakPolarHBondContact O-CB 3.44Å; D139-C186 PolarHBondContact O-N 3.17Å; D139-C186 PolarHBondContact O-SG 3.1Å; C186-R265 WeakPolarHBondContact O-CD 3.44Å; C186-R265 PolarHBondContact O-NH1 3.49Å
187	G	65.4	Low	83.4	Confident	24 Å²	24	32.3 Å²	32.3	25%	0.247	19%	0.186	C	C	.	.	S	Bend	trans	-149.9	173.5	-176.8	0	0	0	0	0	112.9	P185	P185-G187 PolarHBondContact O-N 3.08Å
188	P	61.3	Low	83.4	Confident	32 Å²	32	34.2 Å²	34.2	21%	0.208	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-22.5	-162.4	34.2	-39.6	0	0	0	115.2	G190 R265 S266	P188-G190 VanDerWaalsContact C-N 3.28Å; P188-R265 WeakPolarHBondContact CG-O 3.48Å; P188-S266 VanDerWaalsContact CB-CA 3.48Å
189	D	66.3	Low	83.2	Confident	121 Å²	121	34 Å²	34	65%	0.647	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-6.4	-177.4	-57.4	-39	0	0	0	112.2	R269	D189-R269 VanDerWaalsContact CG-NH1 3.26Å; D189-R269 IonicContact OD1-NH1 3.75Å; D189-R269 PolarHBondContact OD1-NH1 2.94Å; D189-R269 IonicContact OD2-CZ 3.23Å; D189-R269 IonicContact OD2-NH1 2.68Å; D189-R269 PolarHBondContact OD2-NH1 2.94Å; D189-R269 IonicContact OD2-NH2 3.72Å
190	G	77.2	Confident	82.7	Confident	10 Å²	10	33.8 Å²	33.8	10%	0.103	22%	0.22	C	C	.	.	S	Bend	trans	-92.6	166.9	-176.4	0	0	0	0	0	115.2	E138 P188 I208	E138-G190 WeakPolarHBondContact OE1-CA 3.47Å; P188-G190 VanDerWaalsContact C-N 3.28Å; G190-I208 PolarHBondContact O-N 3.22Å
191	S	85.4	Confident	82.2	Confident	23 Å²	23	37.9 Å²	37.9	16%	0.161	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	144	-179.1	-59.2	0	0	0	0	113.9	E138 S205 F206	E138-S191 PolarHBondContact OE1-N 3.38Å; S191-S205 WeakPolarHBondContact CB-OG 3.2Å; S191-F206 WeakPolarHBondContact CA-O 3.29Å
192	V	89.2	Confident	82	Confident	0 Å²	0	42 Å²	42	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	122	170.6	177.2	0	0	0	0	107.8	L182 H183 P185 S205 F206 I208 F259	L182-V192 HydrophobicContact CD1-CG1 3.81Å; H183-V192 WeakPolarHBondContact O-CA 3.37Å; P185-V192 HydrophobicContact CG-CG2 4.4Å; V192-S205 WeakPolarHBondContact O-CA 3.47Å; V192-F206 HydrophobicContact CB-CD2 4.03Å; V192-F206 HydrophobicContact CB-CE2 3.45Å; V192-F206 VanDerWaalsContact CB-CE2 3.45Å; V192-F206 HydrophobicContact CB-CZ 3.83Å; V192-F206 HydrophobicContact CG1-CE2 3.61Å; V192-F206 HydrophobicContact CG1-CZ 3.56Å; V192-F206 HydrophobicContact CG2-CE2 4.11Å; V192-F206 PolarHBondContact N-O 2.89Å; V192-F206 PolarHBondContact O-N 3.09Å; V192-I208 HydrophobicContact CG2-CB 4.06Å; V192-I208 HydrophobicContact CG2-CD1 4.27Å; V192-I208 HydrophobicContact CG2-CG1 4.06Å; V192-F259 HydrophobicContact CG1-CE1 4.21Å; V192-F259 HydrophobicContact CG1-CZ 4.05Å; V192-F259 HydrophobicContact CG2-CE1 3.86Å; V192-F259 HydrophobicContact CG2-CZ 4.49Å
193	R	90.8	Very high	81.6	Confident	55 Å²	55	45.2 Å²	45.2	21%	0.208	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132.7	179.9	-71.8	-176.1	-82.7	-79.5	-9.5	112.1	E138 L182 H183 V195 E202	E138-R193 IonicContact OE2-CZ 3.51Å; E138-R193 VanDerWaalsContact OE2-CZ 3.23Å; E138-R193 IonicContact OE2-NH1 3Å; E138-R193 PolarHBondContact OE2-NH1 3.25Å; E138-R193 IonicContact OE2-NH2 3.72Å; E138-R193 PolarHBondContact OE2-NH2 3.4Å; L182-R193 WeakPolarHBondContact CA-O 3.12Å; H183-R193 HydrophobicContact CB-CB 4.19Å; H183-R193 PolarHBondContact N-O 3.11Å; H183-R193 PolarHBondContact O-N 2.91Å; H183-R193 VanDerWaalsContact O-N 3.11Å; R193-V195 HydrophobicContact CB-CG2 4.22Å; R193-E202 WeakPolarHBondContact CD-OE2 3.18Å; R193-E202 VanDerWaalsContact CG-OE2 3.31Å; R193-E202 WeakPolarHBondContact CG-OE2 3.28Å
194	I	91.7	Very high	81.3	Confident	0 Å²	0	45 Å²	45	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	117.6	167.4	-49.9	175	0	0	0	107.2	Y148 I180 L182 I203 A204 F206 F229 F244	Y148-I194 HydrophobicContact CE2-CD1 4.45Å; I180-I194 HydrophobicContact CB-CG2 4.01Å; I180-I194 HydrophobicContact CD1-CG2 4.22Å; I180-I194 HydrophobicContact CG1-CG2 4.18Å; I180-I194 HydrophobicContact CG2-CG2 3.89Å; L182-I194 HydrophobicContact CD1-CG1 4.04Å; I194-I203 HydrophobicContact CB-CB 4.33Å; I194-I203 HydrophobicContact CG2-CB 4.15Å; I194-I203 HydrophobicContact CG2-CD1 4.12Å; I194-I203 PolarHBondContact O-N 2.89Å; I194-A204 HydrophobicContact CD1-CB 4.25Å; I194-A204 PolarHBondContact N-O 3.17Å; I194-A204 PolarHBondContact O-N 3.05Å; I194-F206 HydrophobicContact CD1-CE1 4.24Å; I194-F206 HydrophobicContact CG1-CE1 4.45Å; I194-F229 HydrophobicContact CD1-CZ 4.45Å; I194-F244 HydrophobicContact CD1-CE1 3.91Å; I194-F244 HydrophobicContact CD1-CZ 3.67Å; I194-F244 HydrophobicContact CG1-CE1 4.26Å; I194-F244 HydrophobicContact CG1-CZ 4.28Å; I194-F244 HydrophobicContact CG2-CE1 4.32Å
195	V	89.5	Confident	81.3	Confident	24 Å²	24	47.3 Å²	47.3	15%	0.145	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.1	-176.8	-175.3	0	0	0	0	109.9	I180 T181 R193 Q197 G200	I180-V195 CarbonylContact C-O 3.54Å; I180-V195 VanDerWaalsContact CA-O 3.24Å; I180-V195 WeakPolarHBondContact CA-O 3.24Å; I180-V195 WeakPolarHBondContact CB-O 3.19Å; T181-V195 PolarHBondContact N-O 3.48Å; T181-V195 PolarHBondContact O-N 3.09Å; R193-V195 HydrophobicContact CB-CG2 4.22Å; V195-Q197 PolarHBondContact O-N 2.92Å; V195-G200 WeakPolarHBondContact CG1-O 3.49Å
196	D	89	Confident	81.3	Confident	26 Å²	26	47.2 Å²	47.2	14%	0.139	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	126.8	173.9	170	30.1	0	0	0	111	A198 S199 G200 T201 I203	D196-A198 VanDerWaalsContact C-N 3.29Å; D196-A198 PolarHBondContact O-N 3.46Å; D196-A198 WeakPolarHBondContact OD1-CB 3.38Å; D196-A198 PolarHBondContact OD1-N 3.08Å; D196-S199 WeakPolarHBondContact OD2-CB 3.34Å; D196-S199 PolarHBondContact OD2-N 3.37Å; D196-S199 PolarHBondContact OD2-OG 3.12Å; D196-G200 VanDerWaalsContact O-CA 3.25Å; D196-G200 WeakPolarHBondContact O-CA 3.46Å; D196-G200 PolarHBondContact O-N 2.85Å; D196-T201 PolarHBondContact N-O 3.27Å; D196-I203 HydrophobicContact CB-CD1 3.98Å; D196-I203 HydrophobicContact CB-CG1 4.21Å
197	Q	84.6	Confident	82	Confident	86 Å²	86	47.2 Å²	47.2	40%	0.402	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-19.9	178.3	-57.5	-155.9	-42.3	0	0	113.5	N144 P179 I180 T181 V195	N144-Q197 PolarHBondContact OD1-NE2 3.25Å; P179-Q197 HydrophobicContact CB-CB 4.33Å; P179-Q197 PolarHBondContact O-N 2.96Å; I180-Q197 VanDerWaalsContact C-CG 3.44Å; T181-Q197 PolarHBondContact OG1-NE2 3.31Å; V195-Q197 PolarHBondContact O-N 2.92Å
198	A	78.6	Confident	82.9	Confident	92 Å²	92	46.1 Å²	46.1	76%	0.76	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-40.3	-177.4	0	0	0	0	0	113.2	D196	D196-A198 VanDerWaalsContact C-N 3.29Å; D196-A198 PolarHBondContact O-N 3.46Å; D196-A198 WeakPolarHBondContact OD1-CB 3.38Å; D196-A198 PolarHBondContact OD1-N 3.08Å
199	S	80.2	Confident	83.8	Confident	73 Å²	73	52 Å²	52	51%	0.51	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-16.1	179.9	66.8	0	0	0	0	115	D196 T201	D196-S199 WeakPolarHBondContact OD2-CB 3.34Å; D196-S199 PolarHBondContact OD2-N 3.37Å; D196-S199 PolarHBondContact OD2-OG 3.12Å; S199-T201 WeakPolarHBondContact CB-OG1 3.46Å; S199-T201 PolarHBondContact O-N 3.41Å; S199-T201 VanDerWaalsContact OG-CB 3.29Å; S199-T201 WeakPolarHBondContact OG-CB 3.43Å; S199-T201 PolarHBondContact OG-N 3.37Å; S199-T201 PolarHBondContact OG-OG1 3.19Å
200	G	77.9	Confident	84.7	Confident	56 Å²	56	48.7 Å²	48.7	58%	0.577	29%	0.286	S	S	*	.			trans	72.2	8.2	-169.5	0	0	0	0	0	114.1	V195 D196	V195-G200 WeakPolarHBondContact CG1-O 3.49Å; D196-G200 VanDerWaalsContact O-CA 3.25Å; D196-G200 WeakPolarHBondContact O-CA 3.46Å; D196-G200 PolarHBondContact O-N 2.85Å
201	T	81.9	Confident	85.2	Confident	86 Å²	86	48.5 Å²	48.5	53%	0.528	28%	0.283	S	S	.	.			trans	-79.2	136.2	-178.3	-46.9	0	0	0	0	110.9	D196 S199 I203	D196-T201 PolarHBondContact N-O 3.27Å; S199-T201 WeakPolarHBondContact CB-OG1 3.46Å; S199-T201 PolarHBondContact O-N 3.41Å; S199-T201 VanDerWaalsContact OG-CB 3.29Å; S199-T201 WeakPolarHBondContact OG-CB 3.43Å; S199-T201 PolarHBondContact OG-N 3.37Å; S199-T201 PolarHBondContact OG-OG1 3.19Å; T201-I203 PolarHBondContact O-N 3.37Å
202	E	86.5	Confident	85.2	Confident	99 Å²	99	49.6 Å²	49.6	46%	0.463	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	120.6	169.6	-169.1	-179.8	95.3	0	0	110.4	R193 S205	R193-E202 WeakPolarHBondContact CD-OE2 3.18Å; R193-E202 VanDerWaalsContact CG-OE2 3.31Å; R193-E202 WeakPolarHBondContact CG-OE2 3.28Å; E202-S205 VanDerWaalsContact CD-CB 3.41Å; E202-S205 WeakPolarHBondContact OE1-CB 3.41Å
203	I	83.5	Confident	85.2	Confident	68 Å²	68	52.1 Å²	52.1	35%	0.349	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	-40.9	176.9	-64.5	166.3	0	0	0	110	Y148 I178 I180 I194 D196 T201	Y148-I203 HydrophobicContact CE1-CG2 4.34Å; I178-I203 HydrophobicContact CG2-CD1 4.07Å; I180-I203 HydrophobicContact CG2-CD1 3.54Å; I194-I203 HydrophobicContact CB-CB 4.33Å; I194-I203 HydrophobicContact CG2-CB 4.15Å; I194-I203 HydrophobicContact CG2-CD1 4.12Å; I194-I203 PolarHBondContact O-N 2.89Å; D196-I203 HydrophobicContact CB-CD1 3.98Å; D196-I203 HydrophobicContact CB-CG1 4.21Å; T201-I203 PolarHBondContact O-N 3.37Å
204	A	83.7	Confident	85.2	Confident	30 Å²	30	51 Å²	51	25%	0.248	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	148.6	174.3	0	0	0	0	0	111.2	I194 F206	I194-A204 HydrophobicContact CD1-CB 4.25Å; I194-A204 PolarHBondContact N-O 3.17Å; I194-A204 PolarHBondContact O-N 3.05Å; A204-F206 HydrophobicContact CB-CD1 4.43Å; A204-F206 HydrophobicContact CB-CE1 4.3Å
205	S	87.4	Confident	85.1	Confident	49 Å²	49	51.2 Å²	51.2	34%	0.343	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	135.3	168.4	179.5	0	0	0	0	110.1	S191 V192 E202	S191-S205 WeakPolarHBondContact CB-OG 3.2Å; V192-S205 WeakPolarHBondContact O-CA 3.47Å; E202-S205 VanDerWaalsContact CD-CB 3.41Å; E202-S205 WeakPolarHBondContact OE1-CB 3.41Å
206	F	86.3	Confident	85.2	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.009	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	139.2	178.6	41.7	-86.5	0	0	0	110.1	S191 V192 I194 A204 K210 V211 F229 E231	S191-F206 WeakPolarHBondContact CA-O 3.29Å; V192-F206 HydrophobicContact CB-CD2 4.03Å; V192-F206 HydrophobicContact CB-CE2 3.45Å; V192-F206 VanDerWaalsContact CB-CE2 3.45Å; V192-F206 HydrophobicContact CB-CZ 3.83Å; V192-F206 HydrophobicContact CG1-CE2 3.61Å; V192-F206 HydrophobicContact CG1-CZ 3.56Å; V192-F206 HydrophobicContact CG2-CE2 4.11Å; V192-F206 PolarHBondContact N-O 2.89Å; V192-F206 PolarHBondContact O-N 3.09Å; I194-F206 HydrophobicContact CD1-CE1 4.24Å; I194-F206 HydrophobicContact CG1-CE1 4.45Å; A204-F206 HydrophobicContact CB-CD1 4.43Å; A204-F206 HydrophobicContact CB-CE1 4.3Å; F206-K210 HydrophobicContact CB-CD 4.34Å; F206-V211 HydrophobicContact CD2-CG2 3.73Å; F206-V211 HydrophobicContact CE2-CG2 3.54Å; F206-F229 HydrophobicContact CE1-CE2 4.24Å; F206-F229 HydrophobicContact CE1-CZ 4.16Å; F206-F229 HydrophobicContact CE2-CD2 4.42Å; F206-F229 AromaticContact CE2-CE2 3.63Å; F206-F229 HydrophobicContact CE2-CE2 3.63Å; F206-F229 AromaticContact CE2-CZ 3.88Å; F206-F229 HydrophobicContact CE2-CZ 3.88Å; F206-F229 HydrophobicContact CZ-CE1 4.3Å; F206-F229 AromaticContact CZ-CE2 3.39Å; F206-F229 HydrophobicContact CZ-CE2 3.39Å; F206-F229 AromaticContact CZ-CZ 3.28Å; F206-F229 HydrophobicContact CZ-CZ 3.28Å; F206-E231 HydrophobicContact CB-CG 4.26Å; F206-E231 WeakPolarHBondContact CB-OE1 3.38Å; F206-E231 HydrophobicContact CD2-CG 4.25Å; F206-E231 HydrophobicContact CG-CG 4.16Å
207	P	85.1	Confident	85.1	Confident	36 Å²	36	52.5 Å²	52.5	23%	0.234	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	138.7	175	-25.7	35.3	0	0	0	111.6	Y209 K210	P207-Y209 HydrophobicContact CB-CD1 3.68Å; P207-Y209 HydrophobicContact CB-CE1 3.23Å; P207-Y209 HydrophobicContact CB-CE2 4.3Å; P207-Y209 HydrophobicContact CB-CG 4.39Å; P207-Y209 HydrophobicContact CG-CE1 4.03Å; P207-Y209 PolarHBondContact O-N 2.75Å; P207-Y209 VanDerWaalsContact O-N 3.12Å; P207-K210 WeakPolarHBondContact O-CB 3.3Å; P207-K210 PolarHBondContact O-N 3.32Å
208	I	84.7	Confident	85	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-60.4	-31.2	-170.2	-171.3	163.7	0	0	0	113.9	V184 P185 G190 V192 K210 V211 F259 A262 F263	V184-I208 HydrophobicContact CG1-CD1 4.42Å; P185-I208 HydrophobicContact CG-CB 3.96Å; P185-I208 HydrophobicContact CG-CD1 4.02Å; P185-I208 HydrophobicContact CG-CG2 4.14Å; G190-I208 PolarHBondContact O-N 3.22Å; V192-I208 HydrophobicContact CG2-CB 4.06Å; V192-I208 HydrophobicContact CG2-CD1 4.27Å; V192-I208 HydrophobicContact CG2-CG1 4.06Å; I208-K210 PolarHBondContact O-N 2.86Å; I208-V211 WeakPolarHBondContact O-CB 3.34Å; I208-V211 PolarHBondContact O-N 3.49Å; I208-F259 HydrophobicContact CD1-CD1 4.35Å; I208-A262 HydrophobicContact CD1-CB 3.38Å; I208-F263 HydrophobicContact CD1-CD1 4.49Å; I208-F263 HydrophobicContact CD1-CE1 4.39Å; I208-F263 HydrophobicContact CG1-CD1 4.16Å; I208-F263 HydrophobicContact CG1-CE1 3.81Å
209	Y	80.6	Confident	84.8	Confident	155 Å²	155	60.1 Å²	60.1	61%	0.608	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-60.5	-16.2	177.4	64.9	-106.5	0	0	0	114.4	P207 V211	P207-Y209 HydrophobicContact CB-CD1 3.68Å; P207-Y209 HydrophobicContact CB-CE1 3.23Å; P207-Y209 HydrophobicContact CB-CE2 4.3Å; P207-Y209 HydrophobicContact CB-CG 4.39Å; P207-Y209 HydrophobicContact CG-CE1 4.03Å; P207-Y209 PolarHBondContact O-N 2.75Å; P207-Y209 VanDerWaalsContact O-N 3.12Å; Y209-V211 VanDerWaalsContact C-N 3.34Å
210	K	84.6	Confident	84.3	Confident	52 Å²	52	60.4 Å²	60.4	23%	0.226	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-78.9	-15.8	173.8	-68.3	-165.2	-179.9	-172	0	114.2	F206 P207 I208 L212 E231 S232	F206-K210 HydrophobicContact CB-CD 4.34Å; P207-K210 WeakPolarHBondContact O-CB 3.3Å; P207-K210 PolarHBondContact O-N 3.32Å; I208-K210 PolarHBondContact O-N 2.86Å; K210-L212 WeakPolarHBondContact O-CG 3.49Å; K210-L212 PolarHBondContact O-N 3.15Å; K210-E231 HydrophobicContact CB-CG 3.81Å; K210-E231 HydrophobicContact CD-CG 4.04Å; K210-E231 WeakPolarHBondContact CD-OE1 3.16Å; K210-E231 IonicContact NZ-OE1 3.17Å; K210-E231 PolarHBondContact NZ-OE1 3.32Å; K210-E231 WeakPolarHBondContact O-CA 3.07Å; K210-S232 PolarHBondContact O-N 3.39Å; K210-S232 VanDerWaalsContact O-N 3.11Å; K210-S232 PolarHBondContact O-OG 2.94Å
211	V	87.5	Confident	84.4	Confident	7 Å²	7	59.2 Å²	59.2	4%	0.042	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	110.2	-179.6	-172.6	0	0	0	0	108.4	F206 I208 Y209 F229 T230 F263	F206-V211 HydrophobicContact CD2-CG2 3.73Å; F206-V211 HydrophobicContact CE2-CG2 3.54Å; I208-V211 WeakPolarHBondContact O-CB 3.34Å; I208-V211 PolarHBondContact O-N 3.49Å; Y209-V211 VanDerWaalsContact C-N 3.34Å; V211-F229 HydrophobicContact CG1-CB 3.62Å; V211-F229 HydrophobicContact CG1-CD2 3.8Å; V211-F229 HydrophobicContact CG1-CG 3.89Å; V211-F229 HydrophobicContact CG2-CD2 4.25Å; V211-T230 CarbonylContact C-O 3.53Å; V211-T230 WeakPolarHBondContact CA-O 3.33Å; V211-F263 HydrophobicContact CB-CE1 3.93Å; V211-F263 HydrophobicContact CB-CZ 3.75Å; V211-F263 HydrophobicContact CG1-CE1 4.44Å; V211-F263 HydrophobicContact CG1-CZ 3.75Å; V211-F263 VanDerWaalsContact O-CE1 3.25Å; V211-F263 WeakPolarHBondContact O-CE1 3.12Å; V211-F263 WeakPolarHBondContact O-CZ 3.24Å
212	L	85.4	Confident	84.2	Confident	46 Å²	46	59.8 Å²	59.8	24%	0.241	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-19.6	-166.7	-58	-178.3	0	0	0	114.4	P157 R158 K210 T230 F239	P157-L212 HydrophobicContact CB-CB 4.46Å; P157-L212 HydrophobicContact CB-CD1 3.81Å; P157-L212 HydrophobicContact CG-CD1 4.17Å; R158-L212 PolarHBondContact NE-O 2.9Å; K210-L212 WeakPolarHBondContact O-CG 3.49Å; K210-L212 PolarHBondContact O-N 3.15Å; L212-T230 PolarHBondContact N-O 3.38Å; L212-F239 HydrophobicContact CD1-CD1 3.54Å; L212-F239 HydrophobicContact CD1-CE1 3.46Å; L212-F239 VanDerWaalsContact CD1-CE1 3.46Å
213	F	88.9	Confident	84	Confident	52 Å²	52	56.7 Å²	56.7	23%	0.228	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.1	141.5	-172.5	-173	-120.5	0	0	0	110.6	P157 R158 E160 A163 A215 F229 T230	P157-F213 WeakPolarHBondContact O-CB 3.43Å; R158-F213 HydrophobicContact CB-CD2 4.39Å; R158-F213 HydrophobicContact CB-CG 4.48Å; R158-F213 HydrophobicContact CG-CB 4.08Å; R158-F213 HydrophobicContact CG-CD2 4.45Å; R158-F213 HydrophobicContact CG-CG 4.45Å; E160-F213 HydrophobicContact CB-CE1 4.3Å; E160-F213 HydrophobicContact CB-CZ 3.96Å; E160-F213 HydrophobicContact CG-CE1 4.49Å; E160-F213 HydrophobicContact CG-CZ 4.17Å; A163-F213 HydrophobicContact CB-CE1 4.24Å; F213-A215 HydrophobicContact CE1-CB 3.85Å; F213-A215 HydrophobicContact CZ-CB 4.36Å; F213-F229 CarbonylContact O-C 3.52Å; F213-F229 WeakPolarHBondContact O-CA 3.34Å; F213-T230 PolarHBondContact O-N 2.84Å
214	C	91.4	Very high	84	Confident	31 Å²	31	54.1 Å²	54.1	21%	0.209	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	140.1	171.5	-55.6	0	0	0	0	109.7	S228 F229 L256	C214-S228 CarbonylContact C-O 3.51Å; C214-S228 VanDerWaalsContact CA-O 3.31Å; C214-S228 WeakPolarHBondContact CA-O 3.38Å; C214-F229 HydrophobicContact CB-CB 4.24Å; C214-F229 VanDerWaalsContact SG-CB 3.52Å; C214-L256 HydrophobicContact CB-CD2 3.6Å
215	A	89.4	Confident	84.1	Confident	5 Å²	5	54 Å²	54	4%	0.041	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	146.5	-177.1	0	0	0	0	0	112.4	E160 A163 M167 F213 F227 S228	E160-A215 HydrophobicContact CG-CB 4.44Å; A163-A215 HydrophobicContact CB-CB 3.69Å; M167-A215 HydrophobicContact CE-CB 4.16Å; F213-A215 HydrophobicContact CE1-CB 3.85Å; F213-A215 HydrophobicContact CZ-CB 4.36Å; A215-F227 CarbonylContact O-C 3.55Å; A215-F227 VanDerWaalsContact O-CA 3.31Å; A215-F227 WeakPolarHBondContact O-CA 3.47Å; A215-S228 PolarHBondContact N-O 3.06Å; A215-S228 PolarHBondContact O-N 3.16Å
216	R	91.8	Very high	84.2	Confident	77 Å²	77	51.6 Å²	51.6	29%	0.291	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	137.6	174.8	174.9	167.2	-169.6	150.3	11.1	110.5	Q164 K249 V252 S253 L256	Q164-R216 PolarHBondContact NE2-O 2.95Å; R216-K249 PolarHBondContact NH2-O 2.95Å; R216-V252 HydrophobicContact CB-CG1 4.32Å; R216-V252 HydrophobicContact CG-CG1 3.79Å; R216-S253 PolarHBondContact NH1-OG 3.36Å; R216-L256 HydrophobicContact CB-CD1 3.74Å
217	G	86.6	Confident	84.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-64.9	137.7	172	0	0	0	0	0	112.1	E219 E223 C226	G217-E219 PolarHBondContact O-N 3.39Å; G217-E223 VanDerWaalsContact CA-O 3.31Å; G217-E223 WeakPolarHBondContact CA-O 3.47Å; G217-C226 PolarHBondContact N-O 2.97Å
218	R	82.8	Confident	85	Confident	170 Å²	170	49.9 Å²	49.9	64%	0.642	26%	0.255	S	S	*	.	P	Polyproline II helix	trans	-52.8	135.3	-167.5	-178.7	173.9	-70.4	-175.6	-3	113.8	S221	R218-S221 VanDerWaalsContact O-CB 3.32Å; R218-S221 WeakPolarHBondContact O-CB 3.37Å; R218-S221 PolarHBondContact O-N 3.46Å; R218-S221 PolarHBondContact O-OG 3.15Å
219	E	74.9	Confident	85.4	Confident	168 Å²	168	49.9 Å²	49.9	79%	0.785	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	142.2	176.4	-165.6	151.9	-124	0	0	112	G217 S221	G217-E219 PolarHBondContact O-N 3.39Å; E219-S221 PolarHBondContact O-N 3.05Å
220	G	69.9	Low	86	Confident	80 Å²	80	42.5 Å²	42.5	83%	0.825	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.6	-7.1	-172.5	0	0	0	0	0	116.2
221	S	80.3	Confident	86.2	Confident	30 Å²	30	40.7 Å²	40.7	21%	0.21	22%	0.218	C	C	.	.	S	Bend	trans	-87.3	172.9	174.7	76.9	0	0	0	0	112.8	R218 E219 E223 S224	R218-S221 VanDerWaalsContact O-CB 3.32Å; R218-S221 WeakPolarHBondContact O-CB 3.37Å; R218-S221 PolarHBondContact O-N 3.46Å; R218-S221 PolarHBondContact O-OG 3.15Å; E219-S221 PolarHBondContact O-N 3.05Å; S221-E223 VanDerWaalsContact CB-OE2 3.28Å; S221-E223 WeakPolarHBondContact CB-OE2 3.43Å; S221-E223 PolarHBondContact O-N 2.7Å; S221-E223 PolarHBondContact OG-N 2.74Å; S221-E223 PolarHBondContact OG-OE2 3.45Å; S221-S224 VanDerWaalsContact O-CB 3.24Å; S221-S224 WeakPolarHBondContact O-CB 3.08Å; S221-S224 PolarHBondContact O-N 2.87Å; S221-S224 PolarHBondContact O-OG 3.39Å; S221-S224 PolarHBondContact OG-N 3.19Å
222	V	76.8	Confident	86.2	Confident	98 Å²	98	41.5 Å²	41.5	59%	0.594	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-68.6	-27.6	171.4	-62.2	0	0	0	0	111.2	R171 S224	R171-V222 PolarHBondContact NH1-O 3.26Å; R171-V222 PolarHBondContact NH2-O 3.08Å; R171-V222 VanDerWaalsContact NH2-O 3.07Å; V222-S224 PolarHBondContact O-N 3.23Å
223	E	81.9	Confident	85.7	Confident	35 Å²	35	42.7 Å²	42.7	16%	0.164	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-73.9	0.6	174.6	-58.4	76.8	-173.1	0	0	113.5	A168 G217 S221 D225 C226	A168-E223 HydrophobicContact CB-CG 4.31Å; A168-E223 WeakPolarHBondContact CB-OE1 3.47Å; G217-E223 VanDerWaalsContact CA-O 3.31Å; G217-E223 WeakPolarHBondContact CA-O 3.47Å; S221-E223 VanDerWaalsContact CB-OE2 3.28Å; S221-E223 WeakPolarHBondContact CB-OE2 3.43Å; S221-E223 PolarHBondContact O-N 2.7Å; S221-E223 PolarHBondContact OG-N 2.74Å; S221-E223 PolarHBondContact OG-OE2 3.45Å; E223-D225 PolarHBondContact O-N 2.84Å; E223-C226 WeakPolarHBondContact O-CB 3.48Å; E223-C226 PolarHBondContact O-N 3.4Å
224	S	83.5	Confident	84.5	Confident	13 Å²	13	50.3 Å²	50.3	9%	0.091	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-61.8	-11.7	-177	52.6	0	0	0	0	116	S221 V222 K249	S221-S224 VanDerWaalsContact O-CB 3.24Å; S221-S224 WeakPolarHBondContact O-CB 3.08Å; S221-S224 PolarHBondContact O-N 2.87Å; S221-S224 PolarHBondContact O-OG 3.39Å; S221-S224 PolarHBondContact OG-N 3.19Å; V222-S224 PolarHBondContact O-N 3.23Å; S224-K249 PolarHBondContact OG-NZ 2.92Å
225	D	86.1	Confident	82.9	Confident	27 Å²	27	51.1 Å²	51.1	14%	0.144	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-101.3	-0.4	173.2	60.9	23.5	0	0	0	113.6	R171 E223 C246 K249 V252	R171-D225 IonicContact CZ-OD1 3.76Å; R171-D225 VanDerWaalsContact CZ-OD1 3.29Å; R171-D225 IonicContact CZ-OD2 2.63Å; R171-D225 IonicContact NH1-OD1 2.86Å; R171-D225 PolarHBondContact NH1-OD1 3.45Å; R171-D225 IonicContact NH1-OD2 3.23Å; R171-D225 VanDerWaalsContact NH2-CG 3.33Å; R171-D225 IonicContact NH2-OD1 2.73Å; R171-D225 PolarHBondContact NH2-OD1 3.06Å; R171-D225 IonicContact NH2-OD2 2.84Å; R171-D225 PolarHBondContact NH2-OD2 3.44Å; E223-D225 PolarHBondContact O-N 2.84Å; D225-C246 WeakPolarHBondContact O-CB 3.46Å; D225-C246 PolarHBondContact O-N 3.28Å; D225-K249 HydrophobicContact CB-CD 4.31Å; D225-K249 HydrophobicContact CB-CG 3.98Å; D225-V252 WeakPolarHBondContact O-CG2 3.34Å
226	C	90.6	Very high	81.6	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	155.1	-179.2	-85.5	0	0	0	0	113.4	M167 R171 G217 E223 F244	M167-C226 HydrophobicContact SD-CB 4.22Å; R171-C226 PolarHBondContact NH1-SG 2.99Å; G217-C226 PolarHBondContact N-O 2.97Å; E223-C226 WeakPolarHBondContact O-CB 3.48Å; E223-C226 PolarHBondContact O-N 3.4Å; C226-F244 WeakPolarHBondContact CA-O 3.3Å; C226-F244 WeakPolarHBondContact CB-O 3.36Å; C226-F244 PolarHBondContact SG-O 3.3Å
227	F	93.9	Very high	80.4	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	167.1	161.2	73.2	-82.7	0	0	0	110.4	L146 L182 A215 F229 F244 V252 I255 L256 F259	L146-F227 HydrophobicContact CD1-CE1 4.36Å; L146-F227 HydrophobicContact CD1-CZ 4.32Å; L146-F227 HydrophobicContact CD2-CE1 4.43Å; L182-F227 HydrophobicContact CD2-CE2 4.19Å; L182-F227 HydrophobicContact CD2-CZ 3.85Å; A215-F227 CarbonylContact O-C 3.55Å; A215-F227 VanDerWaalsContact O-CA 3.31Å; A215-F227 WeakPolarHBondContact O-CA 3.47Å; F227-F229 HydrophobicContact CE2-CD1 4.44Å; F227-F244 HydrophobicContact CD1-CB 4.04Å; F227-F244 HydrophobicContact CD2-CD2 4.16Å; F227-F244 HydrophobicContact CE1-CB 3.5Å; F227-F244 HydrophobicContact CE1-CD2 4.43Å; F227-F244 HydrophobicContact CE1-CG 4.12Å; F227-F244 HydrophobicContact CE2-CB 4.2Å; F227-F244 AromaticContact CE2-CD2 3.57Å; F227-F244 HydrophobicContact CE2-CD2 3.57Å; F227-F244 HydrophobicContact CE2-CE2 4.23Å; F227-F244 HydrophobicContact CE2-CG 4.02Å; F227-F244 HydrophobicContact CZ-CB 3.58Å; F227-F244 HydrophobicContact CZ-CD1 4.41Å; F227-F244 AromaticContact CZ-CD2 3.72Å; F227-F244 HydrophobicContact CZ-CD2 3.72Å; F227-F244 AromaticContact CZ-CG 3.64Å; F227-F244 HydrophobicContact CZ-CG 3.64Å; F227-F244 PolarHBondContact N-O 3.39Å; F227-F244 PolarHBondContact O-N 3.41Å; F227-V252 HydrophobicContact CB-CG1 3.99Å; F227-I255 HydrophobicContact CD1-CD1 4.29Å; F227-I255 HydrophobicContact CD2-CG2 4.29Å; F227-I255 HydrophobicContact CE1-CD1 3.64Å; F227-I255 HydrophobicContact CE1-CG2 4.16Å; F227-I255 HydrophobicContact CE2-CG2 3.76Å; F227-I255 HydrophobicContact CZ-CD1 4.11Å; F227-I255 HydrophobicContact CZ-CG2 3.69Å; F227-L256 HydrophobicContact CB-CD1 4.45Å; F227-L256 HydrophobicContact CB-CD2 4.4Å; F227-L256 HydrophobicContact CD2-CD2 4.46Å; F227-F259 HydrophobicContact CE2-CE2 4.49Å
228	S	93.8	Very high	80.1	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.007	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	160.8	175.8	56.4	0	0	0	0	111.5	M167 C214 A215 H242	M167-S228 PolarHBondContact SD-OG 3.03Å; M167-S228 VanDerWaalsContact SD-OG 3.35Å; C214-S228 CarbonylContact C-O 3.51Å; C214-S228 VanDerWaalsContact CA-O 3.31Å; C214-S228 WeakPolarHBondContact CA-O 3.38Å; A215-S228 PolarHBondContact N-O 3.06Å; A215-S228 PolarHBondContact O-N 3.16Å; S228-H242 WeakPolarHBondContact CA-O 3.24Å; S228-H242 WeakPolarHBondContact CB-O 3.34Å
229	F	93.5	Very high	80.4	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	161.2	166.8	65.6	-106.5	0	0	0	111	I194 F206 V211 F213 C214 F227 I241 H242 F244 F259	I194-F229 HydrophobicContact CD1-CZ 4.45Å; F206-F229 HydrophobicContact CE1-CE2 4.24Å; F206-F229 HydrophobicContact CE1-CZ 4.16Å; F206-F229 HydrophobicContact CE2-CD2 4.42Å; F206-F229 AromaticContact CE2-CE2 3.63Å; F206-F229 HydrophobicContact CE2-CE2 3.63Å; F206-F229 AromaticContact CE2-CZ 3.88Å; F206-F229 HydrophobicContact CE2-CZ 3.88Å; F206-F229 HydrophobicContact CZ-CE1 4.3Å; F206-F229 AromaticContact CZ-CE2 3.39Å; F206-F229 HydrophobicContact CZ-CE2 3.39Å; F206-F229 AromaticContact CZ-CZ 3.28Å; F206-F229 HydrophobicContact CZ-CZ 3.28Å; V211-F229 HydrophobicContact CG1-CB 3.62Å; V211-F229 HydrophobicContact CG1-CD2 3.8Å; V211-F229 HydrophobicContact CG1-CG 3.89Å; V211-F229 HydrophobicContact CG2-CD2 4.25Å; F213-F229 CarbonylContact O-C 3.52Å; F213-F229 WeakPolarHBondContact O-CA 3.34Å; C214-F229 HydrophobicContact CB-CB 4.24Å; C214-F229 VanDerWaalsContact SG-CB 3.52Å; F227-F229 HydrophobicContact CE2-CD1 4.44Å; F229-I241 CarbonylContact O-C 3.5Å; F229-I241 WeakPolarHBondContact O-CA 3.34Å; F229-H242 HydrophobicContact CD2-CB 4.27Å; F229-H242 HydrophobicContact CE1-CB 4.33Å; F229-H242 HydrophobicContact CE2-CB 3.71Å; F229-H242 AromaticContact CE2-CD2 3.51Å; F229-H242 AromaticContact CE2-CG 3.71Å; F229-H242 HydrophobicContact CZ-CB 3.7Å; F229-H242 AromaticContact CZ-CG 3.99Å; F229-H242 PolarHBondContact N-O 2.94Å; F229-H242 VanDerWaalsContact N-O 3.11Å; F229-H242 PolarHBondContact O-N 3.12Å; F229-F244 AromaticContact CD1-CE2 3.78Å; F229-F244 HydrophobicContact CD1-CE2 3.78Å; F229-F244 HydrophobicContact CD1-CZ 4.47Å; F229-F244 HydrophobicContact CE1-CD2 4.25Å; F229-F244 AromaticContact CE1-CE2 3.2Å; F229-F244 HydrophobicContact CE1-CE2 3.2Å; F229-F244 AromaticContact CE1-CZ 3.48Å; F229-F244 HydrophobicContact CE1-CZ 3.48Å; F229-F244 VanDerWaalsContact CE1-CZ 3.48Å; F229-F244 AromaticContact CZ-CE2 3.75Å; F229-F244 HydrophobicContact CZ-CE2 3.75Å; F229-F244 AromaticContact CZ-CZ 3.73Å; F229-F244 HydrophobicContact CZ-CZ 3.73Å; F229-F259 HydrophobicContact CD1-CE1 4.45Å; F229-F259 HydrophobicContact CD1-CE2 4.32Å; F229-F259 AromaticContact CD1-CZ 3.81Å; F229-F259 HydrophobicContact CD1-CZ 3.81Å; F229-F259 HydrophobicContact CE1-CZ 4.08Å
230	T	91.5	Very high	81.1	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.5	-176.2	-43.4	0	0	0	0	111.2	V154 P157 V211 L212 F213 F239 Q240 I241	V154-T230 HydrophobicContact CG2-CG2 3.99Å; P157-T230 HydrophobicContact CB-CG2 3.9Å; P157-T230 PolarHBondContact O-OG1 3.31Å; V211-T230 CarbonylContact C-O 3.53Å; V211-T230 WeakPolarHBondContact CA-O 3.33Å; L212-T230 PolarHBondContact N-O 3.38Å; F213-T230 PolarHBondContact O-N 2.84Å; T230-F239 HydrophobicContact CG2-CB 4.05Å; T230-Q240 CarbonylContact C-O 3.44Å; T230-Q240 VanDerWaalsContact CA-O 3.31Å; T230-Q240 WeakPolarHBondContact CA-O 3.34Å; T230-I241 HydrophobicContact CG2-CG1 3.93Å
231	E	90.3	Very high	82.2	Confident	13 Å²	13	46.4 Å²	46.4	6%	0.061	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	147.7	172.1	-159.7	-154.8	159.1	0	0	111.1	F206 K210 F239 Q240	F206-E231 HydrophobicContact CB-CG 4.26Å; F206-E231 WeakPolarHBondContact CB-OE1 3.38Å; F206-E231 HydrophobicContact CD2-CG 4.25Å; F206-E231 HydrophobicContact CG-CG 4.16Å; K210-E231 HydrophobicContact CB-CG 3.81Å; K210-E231 HydrophobicContact CD-CG 4.04Å; K210-E231 WeakPolarHBondContact CD-OE1 3.16Å; K210-E231 IonicContact NZ-OE1 3.17Å; K210-E231 PolarHBondContact NZ-OE1 3.32Å; K210-E231 WeakPolarHBondContact O-CA 3.07Å; E231-F239 WeakPolarHBondContact O-CA 3.49Å; E231-Q240 PolarHBondContact N-O 3.27Å; E231-Q240 PolarHBondContact O-N 3.3Å
232	S	86.3	Confident	82.8	Confident	25 Å²	25	45.2 Å²	45.2	18%	0.175	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	110.2	158.3	45.9	0	0	0	0	111.7	K210 R234	K210-S232 PolarHBondContact O-N 3.39Å; K210-S232 VanDerWaalsContact O-N 3.11Å; K210-S232 PolarHBondContact O-OG 2.94Å; S232-R234 PolarHBondContact O-N 2.84Å
233	Y	75.8	Confident	83.5	Confident	71 Å²	71	40.5 Å²	40.5	28%	0.278	20%	0.202	S	C	.	.			trans	-96.1	103.7	-169.6	-171.2	-87.7	0	0	0	112.1	W153 S235 D238	W153-Y233 AromaticContact CH2-CD1 3.49Å; W153-Y233 HydrophobicContact CH2-CD1 3.49Å; W153-Y233 VanDerWaalsContact CH2-CD1 3.49Å; W153-Y233 AromaticContact CH2-CE1 3.98Å; W153-Y233 HydrophobicContact CH2-CE1 3.98Å; W153-Y233 AromaticContact CH2-CG 3.87Å; W153-Y233 HydrophobicContact CH2-CG 3.87Å; W153-Y233 HydrophobicContact CZ3-CD1 4.05Å; W153-Y233 HydrophobicContact CZ3-CG 4.12Å; Y233-S235 PolarHBondContact O-N 3.45Å; Y233-D238 PolarHBondContact N-O 2.7Å
234	R	62.8	Low	84.1	Confident	212 Å²	212	38.9 Å²	38.9	80%	0.8	19%	0.194	S	C	*	.	S	Bend	trans	61.5	-26	177.3	-57.3	-178.9	-170.9	-125.2	3.1	117.2	S232	S232-R234 PolarHBondContact O-N 2.84Å
235	S	59	Low	84.5	Confident	47 Å²	47	39.1 Å²	39.1	33%	0.329	20%	0.196	S	C	.	.	S	Bend	trans	-124.9	177.3	176.4	85.3	0	0	0	0	110.9	Y233 E237 D238	Y233-S235 PolarHBondContact O-N 3.45Å; S235-E237 PolarHBondContact OG-N 3.22Å; S235-E237 VanDerWaalsContact OG-N 3.09Å; S235-D238 WeakPolarHBondContact CB-OD2 3.35Å; S235-D238 WeakPolarHBondContact OG-CB 3.26Å; S235-D238 PolarHBondContact OG-N 3.3Å; S235-D238 PolarHBondContact OG-OD2 2.72Å
236	S	61.1	Low	84.6	Confident	103 Å²	103	38.1 Å²	38.1	72%	0.72	19%	0.191	S	C	*	.	S	Bend	trans	-87.8	-0.6	171.9	55.1	0	0	0	0	114.1	F239	S236-F239 VanDerWaalsContact O-CZ 3.25Å; S236-F239 WeakPolarHBondContact O-CZ 3.48Å
237	E	68	Low	84.2	Confident	159 Å²	159	44.2 Å²	44.2	74%	0.743	22%	0.219	S	C	*	.	S	Bend	trans	-121.9	-16	-173.8	-59.8	-168	157.9	0	0	113.6	S235 F239	S235-E237 PolarHBondContact OG-N 3.22Å; S235-E237 VanDerWaalsContact OG-N 3.09Å; E237-F239 WeakPolarHBondContact O-CD2 3.47Å; E237-F239 VanDerWaalsContact O-CE2 3.28Å; E237-F239 WeakPolarHBondContact O-CE2 3.46Å
238	D	80	Confident	83.5	Confident	84 Å²	84	48.1 Å²	48.1	45%	0.449	24%	0.239	S	C	.	.			trans	-98.4	122.5	178.2	-60.2	-71	0	0	0	111.2	W153 Y233 S235	W153-D238 HydrophobicContact CZ3-CB 4.05Å; Y233-D238 PolarHBondContact N-O 2.7Å; S235-D238 WeakPolarHBondContact CB-OD2 3.35Å; S235-D238 WeakPolarHBondContact OG-CB 3.26Å; S235-D238 PolarHBondContact OG-N 3.3Å; S235-D238 PolarHBondContact OG-OD2 2.72Å
239	F	88.4	Confident	82.5	Confident	30 Å²	30	52.6 Å²	52.6	13%	0.132	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	135.9	-174.2	-51.6	-69	0	0	0	112.6	W153 V154 P157 L212 T230 E231 S236 E237	W153-F239 WeakPolarHBondContact CA-O 3.44Å; V154-F239 HydrophobicContact CG2-CB 3.91Å; V154-F239 PolarHBondContact N-O 2.82Å; P157-F239 HydrophobicContact CB-CB 4.01Å; P157-F239 HydrophobicContact CB-CD1 3.72Å; P157-F239 HydrophobicContact CB-CD2 3.98Å; P157-F239 HydrophobicContact CB-CE1 4.18Å; P157-F239 HydrophobicContact CB-CE2 4.4Å; P157-F239 HydrophobicContact CB-CG 3.61Å; P157-F239 HydrophobicContact CB-CZ 4.49Å; P157-F239 HydrophobicContact CG-CD1 3.96Å; P157-F239 HydrophobicContact CG-CD2 3.78Å; P157-F239 HydrophobicContact CG-CE1 3.93Å; P157-F239 HydrophobicContact CG-CE2 3.74Å; P157-F239 HydrophobicContact CG-CG 3.89Å; P157-F239 HydrophobicContact CG-CZ 3.82Å; L212-F239 HydrophobicContact CD1-CD1 3.54Å; L212-F239 HydrophobicContact CD1-CE1 3.46Å; L212-F239 VanDerWaalsContact CD1-CE1 3.46Å; T230-F239 HydrophobicContact CG2-CB 4.05Å; E231-F239 WeakPolarHBondContact O-CA 3.49Å; S236-F239 VanDerWaalsContact O-CZ 3.25Å; S236-F239 WeakPolarHBondContact O-CZ 3.48Å; E237-F239 WeakPolarHBondContact O-CD2 3.47Å; E237-F239 VanDerWaalsContact O-CE2 3.28Å; E237-F239 WeakPolarHBondContact O-CE2 3.46Å
240	Q	90.4	Very high	81.6	Confident	23 Å²	23	58.7 Å²	58.7	11%	0.107	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	124.6	-177	-176.7	161.3	107.3	0	0	110.9	C151 T152 W153 T230 E231 H242	C151-Q240 HydrophobicContact CB-CG 3.73Å; C151-Q240 VanDerWaalsContact SG-CD 3.51Å; C151-Q240 PolarHBondContact SG-OE1 3.46Å; T152-Q240 CarbonylContact O-C 3.58Å; T152-Q240 WeakPolarHBondContact O-CA 3.43Å; W153-Q240 HydrophobicContact CE3-CB 4.36Å; W153-Q240 HydrophobicContact CZ3-CB 4.4Å; T230-Q240 CarbonylContact C-O 3.44Å; T230-Q240 VanDerWaalsContact CA-O 3.31Å; T230-Q240 WeakPolarHBondContact CA-O 3.34Å; E231-Q240 PolarHBondContact N-O 3.27Å; E231-Q240 PolarHBondContact O-N 3.3Å; Q240-H242 PolarHBondContact O-CD2 3.08Å; Q240-H242 PolarHBondContact OE1-CE1 3.43Å
241	I	92.3	Very high	80.9	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	127.1	171.8	-61.2	-166.1	0	0	0	109.3	C151 T152 V154 A163 A166 F229 T230 V243	C151-I241 CarbonylContact C-O 3.46Å; C151-I241 WeakPolarHBondContact CA-O 3.32Å; C151-I241 WeakPolarHBondContact CB-O 3.42Å; T152-I241 PolarHBondContact N-O 2.75Å; T152-I241 PolarHBondContact O-N 3.35Å; V154-I241 HydrophobicContact CB-CD1 4.3Å; V154-I241 HydrophobicContact CB-CG1 4.27Å; V154-I241 HydrophobicContact CG1-CB 4.45Å; V154-I241 HydrophobicContact CG1-CD1 3.54Å; V154-I241 HydrophobicContact CG1-CG1 3.65Å; V154-I241 HydrophobicContact CG2-CD1 4Å; V154-I241 HydrophobicContact CG2-CG1 3.65Å; A163-I241 HydrophobicContact CB-CD1 3.92Å; A166-I241 HydrophobicContact CB-CB 4.37Å; A166-I241 HydrophobicContact CB-CD1 4.38Å; A166-I241 HydrophobicContact CB-CG2 4.12Å; F229-I241 CarbonylContact O-C 3.5Å; F229-I241 WeakPolarHBondContact O-CA 3.34Å; T230-I241 HydrophobicContact CG2-CG1 3.93Å; I241-V243 HydrophobicContact CG2-CG2 4.1Å
242	H	92.3	Very high	80.6	Confident	5 Å²	5	59 Å²	59	2%	0.023	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132	173.2	-60.6	-93.5	0	0	0	109.1	Y148 S228 F229 Q240 F244	Y148-H242 HydrophobicContact CE2-CB 4.06Å; Y148-H242 AromaticContact CZ-ND1 3.93Å; Y148-H242 PolarHBondContact OH-ND1 2.75Å; S228-H242 WeakPolarHBondContact CA-O 3.24Å; S228-H242 WeakPolarHBondContact CB-O 3.34Å; F229-H242 HydrophobicContact CD2-CB 4.27Å; F229-H242 HydrophobicContact CE1-CB 4.33Å; F229-H242 HydrophobicContact CE2-CB 3.71Å; F229-H242 AromaticContact CE2-CD2 3.51Å; F229-H242 AromaticContact CE2-CG 3.71Å; F229-H242 HydrophobicContact CZ-CB 3.7Å; F229-H242 AromaticContact CZ-CG 3.99Å; F229-H242 PolarHBondContact N-O 2.94Å; F229-H242 VanDerWaalsContact N-O 3.11Å; F229-H242 PolarHBondContact O-N 3.12Å; Q240-H242 PolarHBondContact O-CD2 3.08Å; Q240-H242 PolarHBondContact OE1-CE1 3.43Å; H242-F244 HydrophobicContact CB-CE2 3.67Å; H242-F244 HydrophobicContact CB-CZ 3.93Å
243	V	92.8	Very high	80.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	137.5	-174.6	176.5	0	0	0	0	111.4	Y148 L149 G150 A166 M167 L170 I241	Y148-V243 VanDerWaalsContact CD2-O 3.29Å; Y148-V243 WeakPolarHBondContact CD2-O 3.26Å; L149-V243 HydrophobicContact CB-CB 4.31Å; L149-V243 HydrophobicContact CB-CG1 4Å; L149-V243 HydrophobicContact CD1-CG1 3.91Å; L149-V243 HydrophobicContact CG-CG1 4.24Å; L149-V243 PolarHBondContact N-O 2.71Å; G150-V243 PolarHBondContact O-N 3.44Å; A166-V243 HydrophobicContact CB-CG2 4.5Å; M167-V243 HydrophobicContact CB-CG1 4.35Å; M167-V243 HydrophobicContact CG-CG1 3.97Å; M167-V243 HydrophobicContact CG-CG2 3.97Å; L170-V243 HydrophobicContact CB-CB 4.39Å; L170-V243 HydrophobicContact CB-CG2 4.45Å; L170-V243 HydrophobicContact CD1-CB 4.01Å; L170-V243 HydrophobicContact CD1-CG2 3.59Å; I241-V243 HydrophobicContact CG2-CG2 4.1Å
244	F	94	Very high	80.6	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145.9	-177.6	-51.5	-96.7	0	0	0	110.7	S147 Y148 I180 I194 C226 F227 F229 H242	S147-F244 CarbonylContact O-C 3.6Å; S147-F244 VanDerWaalsContact O-CA 3.27Å; S147-F244 WeakPolarHBondContact O-CA 3.49Å; Y148-F244 AromaticContact CD2-CD1 3.8Å; Y148-F244 HydrophobicContact CD2-CD1 3.8Å; Y148-F244 AromaticContact CD2-CE1 3.44Å; Y148-F244 HydrophobicContact CD2-CE1 3.44Å; Y148-F244 VanDerWaalsContact CD2-CE1 3.44Å; Y148-F244 HydrophobicContact CD2-CG 4.48Å; Y148-F244 AromaticContact CD2-CZ 3.83Å; Y148-F244 HydrophobicContact CD2-CZ 3.83Å; Y148-F244 HydrophobicContact CE2-CE1 4.01Å; Y148-F244 AromaticContact CE2-CZ 3.92Å; Y148-F244 HydrophobicContact CE2-CZ 3.92Å; Y148-F244 HydrophobicContact CG-CE1 4.25Å; I180-F244 HydrophobicContact CD1-CD1 3.99Å; I180-F244 HydrophobicContact CD1-CE1 4.16Å; I180-F244 HydrophobicContact CG1-CD1 4.24Å; I180-F244 HydrophobicContact CG1-CE1 4.49Å; I194-F244 HydrophobicContact CD1-CE1 3.91Å; I194-F244 HydrophobicContact CD1-CZ 3.67Å; I194-F244 HydrophobicContact CG1-CE1 4.26Å; I194-F244 HydrophobicContact CG1-CZ 4.28Å; I194-F244 HydrophobicContact CG2-CE1 4.32Å; C226-F244 WeakPolarHBondContact CA-O 3.3Å; C226-F244 WeakPolarHBondContact CB-O 3.36Å; C226-F244 PolarHBondContact SG-O 3.3Å; F227-F244 HydrophobicContact CD1-CB 4.04Å; F227-F244 HydrophobicContact CD2-CD2 4.16Å; F227-F244 HydrophobicContact CE1-CB 3.5Å; F227-F244 HydrophobicContact CE1-CD2 4.43Å; F227-F244 HydrophobicContact CE1-CG 4.12Å; F227-F244 HydrophobicContact CE2-CB 4.2Å; F227-F244 AromaticContact CE2-CD2 3.57Å; F227-F244 HydrophobicContact CE2-CD2 3.57Å; F227-F244 HydrophobicContact CE2-CE2 4.23Å; F227-F244 HydrophobicContact CE2-CG 4.02Å; F227-F244 HydrophobicContact CZ-CB 3.58Å; F227-F244 HydrophobicContact CZ-CD1 4.41Å; F227-F244 AromaticContact CZ-CD2 3.72Å; F227-F244 HydrophobicContact CZ-CD2 3.72Å; F227-F244 AromaticContact CZ-CG 3.64Å; F227-F244 HydrophobicContact CZ-CG 3.64Å; F227-F244 PolarHBondContact N-O 3.39Å; F227-F244 PolarHBondContact O-N 3.41Å; F229-F244 AromaticContact CD1-CE2 3.78Å; F229-F244 HydrophobicContact CD1-CE2 3.78Å; F229-F244 HydrophobicContact CD1-CZ 4.47Å; F229-F244 HydrophobicContact CE1-CD2 4.25Å; F229-F244 AromaticContact CE1-CE2 3.2Å; F229-F244 HydrophobicContact CE1-CE2 3.2Å; F229-F244 AromaticContact CE1-CZ 3.48Å; F229-F244 HydrophobicContact CE1-CZ 3.48Å; F229-F244 VanDerWaalsContact CE1-CZ 3.48Å; F229-F244 AromaticContact CZ-CE2 3.75Å; F229-F244 HydrophobicContact CZ-CE2 3.75Å; F229-F244 AromaticContact CZ-CZ 3.73Å; F229-F244 HydrophobicContact CZ-CZ 3.73Å; H242-F244 HydrophobicContact CB-CE2 3.67Å; H242-F244 HydrophobicContact CB-CZ 3.93Å
245	S	90.8	Very high	81.6	Confident	19 Å²	19	55.8 Å²	55.8	13%	0.133	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	131.6	167.5	58.2	0	0	0	0	110.8	S147	S147-S245 PolarHBondContact N-O 3.41Å; S147-S245 PolarHBondContact O-N 3.06Å
246	C	89.1	Confident	82.9	Confident	6 Å²	6	55.3 Å²	55.3	4%	0.041	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	134.2	173.6	-61.9	0	0	0	0	110.5	L146 D225 I248 A251 V252	L146-C246 HydrophobicContact CD2-CB 4.04Å; L146-C246 WeakPolarHBondContact CD2-SG 3.49Å; D225-C246 WeakPolarHBondContact O-CB 3.46Å; D225-C246 PolarHBondContact O-N 3.28Å; C246-I248 WeakPolarHBondContact CB-O 3.43Å; C246-I248 PolarHBondContact O-N 3.17Å; C246-A251 HydrophobicContact CB-CB 4.42Å; C246-V252 HydrophobicContact CB-CG2 3.98Å; C246-V252 WeakPolarHBondContact SG-CG2 3.19Å
247	H	82.3	Confident	84	Confident	127 Å²	127	57.4 Å²	57.4	59%	0.588	27%	0.272	S	S	*	.	S	Bend	trans	-71.6	-4.5	170.4	-65.3	80.9	0	0	0	113.3	K145 S147	K145-H247 HydrophobicContact CB-CB 4.22Å; K145-H247 PolarHBondContact O-N 2.68Å; K145-H247 PolarHBondContact O-ND1 3.48Å; S147-H247 PolarHBondContact OG-CE1 3.17Å
248	I	79.9	Confident	84.7	Confident	83 Å²	83	50.8 Å²	50.8	43%	0.426	24%	0.243	S	C	.	.	S	Bend	trans	-134.8	117.6	179.4	-60.2	174.9	0	0	0	106.4	C246 E250 A251	C246-I248 WeakPolarHBondContact CB-O 3.43Å; C246-I248 PolarHBondContact O-N 3.17Å; I248-E250 VanDerWaalsContact C-N 3.25Å; I248-E250 HydrophobicContact CG2-CB 4.33Å; I248-E250 WeakPolarHBondContact CG2-OE2 3.39Å; I248-E250 PolarHBondContact O-N 3.04Å; I248-A251 HydrophobicContact CB-CB 4.16Å; I248-A251 HydrophobicContact CG2-CB 4.38Å; I248-A251 WeakPolarHBondContact O-CB 3.46Å; I248-A251 PolarHBondContact O-N 3.43Å; I248-A251 VanDerWaalsContact O-N 3.15Å
249	K	71.5	Confident	84.9	Confident	94 Å²	94	46.9 Å²	46.9	41%	0.409	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-31.8	-170.8	-60.6	-152.3	171.7	-165.4	0	112.7	R216 S224 D225 A251 V252	R216-K249 PolarHBondContact NH2-O 2.95Å; S224-K249 PolarHBondContact OG-NZ 2.92Å; D225-K249 HydrophobicContact CB-CD 4.31Å; D225-K249 HydrophobicContact CB-CG 3.98Å; K249-A251 VanDerWaalsContact C-N 3.27Å; K249-A251 PolarHBondContact O-N 3.33Å; K249-V252 WeakPolarHBondContact O-CB 3.39Å; K249-V252 PolarHBondContact O-N 3.42Å
250	E	74.9	Confident	84.3	Confident	128 Å²	128	47.4 Å²	47.4	60%	0.598	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-22.7	-178.8	-56.9	67	-142.9	0	0	111.4	I248 V252 S253	I248-E250 VanDerWaalsContact C-N 3.25Å; I248-E250 HydrophobicContact CG2-CB 4.33Å; I248-E250 WeakPolarHBondContact CG2-OE2 3.39Å; I248-E250 PolarHBondContact O-N 3.04Å; E250-V252 VanDerWaalsContact C-N 3.28Å; E250-V252 PolarHBondContact O-N 2.9Å; E250-S253 PolarHBondContact O-N 2.62Å
251	A	77.9	Confident	83.7	Confident	21 Å²	21	48.3 Å²	48.3	17%	0.174	24%	0.237	C	C	.	.	H	α-helix	trans	-66.8	-28.8	177.3	0	0	0	0	0	112.4	C246 I248 K249 S253 R254 I255	C246-A251 HydrophobicContact CB-CB 4.42Å; I248-A251 HydrophobicContact CB-CB 4.16Å; I248-A251 HydrophobicContact CG2-CB 4.38Å; I248-A251 WeakPolarHBondContact O-CB 3.46Å; I248-A251 PolarHBondContact O-N 3.43Å; I248-A251 VanDerWaalsContact O-N 3.15Å; K249-A251 VanDerWaalsContact C-N 3.27Å; K249-A251 PolarHBondContact O-N 3.33Å; A251-S253 VanDerWaalsContact C-N 3.29Å; A251-S253 PolarHBondContact O-N 2.72Å; A251-R254 PolarHBondContact O-N 3.47Å; A251-I255 HydrophobicContact CB-CD1 4.49Å; A251-I255 WeakPolarHBondContact O-CD1 3.41Å; A251-I255 WeakPolarHBondContact O-CG1 3.48Å; A251-I255 PolarHBondContact O-N 3.31Å
252	V	82.3	Confident	82.8	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-54.5	-45.6	175.3	174.9	0	0	0	0	111.2	R216 D225 F227 C246 K249 E250 R254 I255 L256	R216-V252 HydrophobicContact CB-CG1 4.32Å; R216-V252 HydrophobicContact CG-CG1 3.79Å; D225-V252 WeakPolarHBondContact O-CG2 3.34Å; F227-V252 HydrophobicContact CB-CG1 3.99Å; C246-V252 HydrophobicContact CB-CG2 3.98Å; C246-V252 WeakPolarHBondContact SG-CG2 3.19Å; K249-V252 WeakPolarHBondContact O-CB 3.39Å; K249-V252 PolarHBondContact O-N 3.42Å; E250-V252 VanDerWaalsContact C-N 3.28Å; E250-V252 PolarHBondContact O-N 2.9Å; V252-R254 VanDerWaalsContact C-N 3.31Å; V252-R254 PolarHBondContact O-N 2.91Å; V252-I255 PolarHBondContact O-N 3.45Å; V252-L256 HydrophobicContact CG1-CD1 3.78Å; V252-L256 HydrophobicContact CG1-CG 4.49Å; V252-L256 WeakPolarHBondContact O-CG 3.46Å; V252-L256 PolarHBondContact O-N 2.89Å; V252-L256 VanDerWaalsContact O-N 3.12Å
253	S	80.3	Confident	81.8	Confident	61 Å²	61	50.6 Å²	50.6	43%	0.427	25%	0.247	S	C	.	.	H	α-helix	trans	-59	-42.8	177.4	-53.2	0	0	0	0	111.7	R216 E250 A251 Y257	R216-S253 PolarHBondContact NH1-OG 3.36Å; E250-S253 PolarHBondContact O-N 2.62Å; A251-S253 VanDerWaalsContact C-N 3.29Å; A251-S253 PolarHBondContact O-N 2.72Å; S253-Y257 VanDerWaalsContact O-CB 3.3Å; S253-Y257 WeakPolarHBondContact O-CB 3.47Å; S253-Y257 PolarHBondContact O-N 2.77Å
254	R	82	Confident	80.3	Confident	180 Å²	180	57.3 Å²	57.3	68%	0.679	27%	0.272	S	S	*	.	H	α-helix	trans	-71.4	-38	-177.2	-64.5	-176	63.9	176.2	-1	112.8	F143 A251 V252 Y257 S258	F143-R254 HydrophobicContact CE1-CB 4.17Å; A251-R254 PolarHBondContact O-N 3.47Å; V252-R254 VanDerWaalsContact C-N 3.31Å; V252-R254 PolarHBondContact O-N 2.91Å; R254-Y257 PolarHBondContact O-N 2.81Å; R254-S258 PolarHBondContact O-N 3.13Å; R254-S258 PolarHBondContact O-OG 3.34Å
255	I	84.2	Confident	78.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.7	-50.5	177.6	-65.7	158.7	0	0	0	110.1	F143 L146 L182 F227 A251 V252 Y257 S258 F259	F143-I255 HydrophobicContact CB-CD1 4.4Å; F143-I255 HydrophobicContact CB-CG1 4.19Å; F143-I255 HydrophobicContact CD1-CD1 4.19Å; F143-I255 HydrophobicContact CD1-CG1 3.38Å; F143-I255 HydrophobicContact CD2-CG1 3.94Å; F143-I255 HydrophobicContact CE1-CB 4.42Å; F143-I255 HydrophobicContact CE1-CG1 3.57Å; F143-I255 HydrophobicContact CE2-CG1 4.11Å; F143-I255 HydrophobicContact CG-CD1 4.28Å; F143-I255 HydrophobicContact CG-CG1 3.57Å; F143-I255 HydrophobicContact CZ-CB 4.37Å; F143-I255 HydrophobicContact CZ-CG1 3.93Å; L146-I255 HydrophobicContact CD1-CD1 4.01Å; L146-I255 HydrophobicContact CD2-CD1 3.77Å; L182-I255 HydrophobicContact CD2-CG2 4.04Å; F227-I255 HydrophobicContact CD1-CD1 4.29Å; F227-I255 HydrophobicContact CD2-CG2 4.29Å; F227-I255 HydrophobicContact CE1-CD1 3.64Å; F227-I255 HydrophobicContact CE1-CG2 4.16Å; F227-I255 HydrophobicContact CE2-CG2 3.76Å; F227-I255 HydrophobicContact CZ-CD1 4.11Å; F227-I255 HydrophobicContact CZ-CG2 3.69Å; A251-I255 HydrophobicContact CB-CD1 4.49Å; A251-I255 WeakPolarHBondContact O-CD1 3.41Å; A251-I255 WeakPolarHBondContact O-CG1 3.48Å; A251-I255 PolarHBondContact O-N 3.31Å; V252-I255 PolarHBondContact O-N 3.45Å; I255-Y257 VanDerWaalsContact C-N 3.27Å; I255-Y257 PolarHBondContact O-N 2.92Å; I255-S258 PolarHBondContact O-N 3.16Å; I255-S258 VanDerWaalsContact O-N 3.17Å; I255-F259 HydrophobicContact CG2-CD2 3.91Å; I255-F259 HydrophobicContact CG2-CE2 3.76Å; I255-F259 WeakPolarHBondContact O-CD2 3.34Å; I255-F259 PolarHBondContact O-N 2.93Å
256	L	87.1	Confident	76.6	Confident	37 Å²	37	63 Å²	63	19%	0.194	30%	0.297	C	S	.	.	H	α-helix	trans	-63.3	-33.9	178.2	-66.3	172.1	0	0	0	111.9	C214 R216 F227 V252 S260	C214-L256 HydrophobicContact CB-CD2 3.6Å; R216-L256 HydrophobicContact CB-CD1 3.74Å; F227-L256 HydrophobicContact CB-CD1 4.45Å; F227-L256 HydrophobicContact CB-CD2 4.4Å; F227-L256 HydrophobicContact CD2-CD2 4.46Å; V252-L256 HydrophobicContact CG1-CD1 3.78Å; V252-L256 HydrophobicContact CG1-CG 4.49Å; V252-L256 WeakPolarHBondContact O-CG 3.46Å; V252-L256 PolarHBondContact O-N 2.89Å; V252-L256 VanDerWaalsContact O-N 3.12Å; L256-S260 PolarHBondContact O-N 2.78Å
257	Y	83	Confident	74.4	Confident	146 Å²	146	66.4 Å²	66.4	57%	0.573	32%	0.32	S	S	*	.	H	α-helix	trans	-60.9	-50.5	170.9	-177.9	-96.5	0	0	0	111.9	S253 R254 I255 F259 S260 T261	S253-Y257 VanDerWaalsContact O-CB 3.3Å; S253-Y257 WeakPolarHBondContact O-CB 3.47Å; S253-Y257 PolarHBondContact O-N 2.77Å; R254-Y257 PolarHBondContact O-N 2.81Å; I255-Y257 VanDerWaalsContact C-N 3.27Å; I255-Y257 PolarHBondContact O-N 2.92Å; Y257-F259 VanDerWaalsContact C-N 3.35Å; Y257-F259 PolarHBondContact O-N 3.49Å; Y257-S260 WeakPolarHBondContact O-CA 3.5Å; Y257-S260 WeakPolarHBondContact O-CB 3.36Å; Y257-S260 PolarHBondContact O-N 2.87Å; Y257-S260 PolarHBondContact O-OG 3.4Å; Y257-T261 PolarHBondContact O-N 2.74Å; Y257-T261 PolarHBondContact O-OG1 3.42Å
258	S	82.8	Confident	72.6	Confident	21 Å²	21	67.3 Å²	67.3	15%	0.147	33%	0.325	C	S	.	.	H	α-helix	trans	-59.3	-40.9	177.3	-71.6	0	0	0	0	113.2	F143 R254 I255 S260 T261 A262	F143-S258 WeakPolarHBondContact CZ-OG 3.39Å; R254-S258 PolarHBondContact O-N 3.13Å; R254-S258 PolarHBondContact O-OG 3.34Å; I255-S258 PolarHBondContact O-N 3.16Å; I255-S258 VanDerWaalsContact O-N 3.17Å; S258-S260 PolarHBondContact O-N 2.87Å; S258-T261 PolarHBondContact O-N 3.44Å; S258-A262 WeakPolarHBondContact O-CB 3.05Å; S258-A262 PolarHBondContact O-N 3.24Å; S258-A262 VanDerWaalsContact O-N 3.08Å
259	F	84.3	Confident	70.7	Confident	1 Å²	1	71.6 Å²	71.6	0%	0.004	34%	0.336	C	S	.	.	H	α-helix	trans	-58.3	-46	169.8	-83.2	-76.9	0	0	0	111.4	L182 V184 V192 I208 F227 F229 I255 Y257 T261 A262 F263	L182-F259 HydrophobicContact CD2-CE2 4.05Å; L182-F259 HydrophobicContact CD2-CZ 4.31Å; V184-F259 HydrophobicContact CG1-CD1 4.1Å; V184-F259 HydrophobicContact CG1-CD2 4.42Å; V184-F259 HydrophobicContact CG1-CE1 4.3Å; V184-F259 HydrophobicContact CG1-CG 4.16Å; V184-F259 HydrophobicContact CG2-CD2 4.15Å; V184-F259 HydrophobicContact CG2-CE1 4.41Å; V184-F259 HydrophobicContact CG2-CE2 3.72Å; V184-F259 HydrophobicContact CG2-CZ 3.86Å; V192-F259 HydrophobicContact CG1-CE1 4.21Å; V192-F259 HydrophobicContact CG1-CZ 4.05Å; V192-F259 HydrophobicContact CG2-CE1 3.86Å; V192-F259 HydrophobicContact CG2-CZ 4.49Å; I208-F259 HydrophobicContact CD1-CD1 4.35Å; F227-F259 HydrophobicContact CE2-CE2 4.49Å; F229-F259 HydrophobicContact CD1-CE1 4.45Å; F229-F259 HydrophobicContact CD1-CE2 4.32Å; F229-F259 AromaticContact CD1-CZ 3.81Å; F229-F259 HydrophobicContact CD1-CZ 3.81Å; F229-F259 HydrophobicContact CE1-CZ 4.08Å; I255-F259 HydrophobicContact CG2-CD2 3.91Å; I255-F259 HydrophobicContact CG2-CE2 3.76Å; I255-F259 WeakPolarHBondContact O-CD2 3.34Å; I255-F259 PolarHBondContact O-N 2.93Å; Y257-F259 VanDerWaalsContact C-N 3.35Å; Y257-F259 PolarHBondContact O-N 3.49Å; F259-T261 VanDerWaalsContact C-N 3.32Å; F259-T261 PolarHBondContact O-N 2.95Å; F259-A262 PolarHBondContact O-N 3.16Å; F259-F263 HydrophobicContact CB-CD2 4.35Å; F259-F263 HydrophobicContact CB-CE2 3.9Å; F259-F263 HydrophobicContact CD1-CE2 4.25Å; F259-F263 HydrophobicContact CD1-CZ 4.1Å; F259-F263 WeakPolarHBondContact O-CD2 3.35Å; F259-F263 VanDerWaalsContact O-CG 3.3Å; F259-F263 WeakPolarHBondContact O-CG 3.45Å; F259-F263 PolarHBondContact O-N 3.46Å
260	S	77.2	Confident	69	Low	42 Å²	42	70.9 Å²	70.9	29%	0.294	35%	0.347	S	S	.	.	H	α-helix	trans	-62.3	-34	179.6	86.6	0	0	0	0	114.2	L256 Y257 S258 R264	L256-S260 PolarHBondContact O-N 2.78Å; Y257-S260 WeakPolarHBondContact O-CA 3.5Å; Y257-S260 WeakPolarHBondContact O-CB 3.36Å; Y257-S260 PolarHBondContact O-N 2.87Å; Y257-S260 PolarHBondContact O-OG 3.4Å; S258-S260 PolarHBondContact O-N 2.87Å; S260-R264 PolarHBondContact O-N 3.37Å
261	T	77	Confident	67	Low	42 Å²	42	72.1 Å²	72.1	26%	0.258	36%	0.358	S	S	.	.	H	α-helix	trans	-70.4	-46.6	176.3	-56	0	0	0	0	110.5	Y257 S258 F259 R264 R265	Y257-T261 PolarHBondContact O-N 2.74Å; Y257-T261 PolarHBondContact O-OG1 3.42Å; S258-T261 PolarHBondContact O-N 3.44Å; F259-T261 VanDerWaalsContact C-N 3.32Å; F259-T261 PolarHBondContact O-N 2.95Å; T261-R264 PolarHBondContact O-N 3.4Å; T261-R265 PolarHBondContact O-N 3.26Å
262	A	73.5	Confident	65	Low	1 Å²	1	78.3 Å²	78.3	1%	0.008	39%	0.386	C	S	.	.	H	α-helix	trans	-70	-33.7	-178.5	0	0	0	0	0	112.5	P185 I208 S258 F259 R265 S266	P185-A262 WeakPolarHBondContact O-CB 3.25Å; I208-A262 HydrophobicContact CD1-CB 3.38Å; S258-A262 WeakPolarHBondContact O-CB 3.05Å; S258-A262 PolarHBondContact O-N 3.24Å; S258-A262 VanDerWaalsContact O-N 3.08Å; F259-A262 PolarHBondContact O-N 3.16Å; A262-R265 PolarHBondContact O-N 3Å; A262-S266 PolarHBondContact O-N 3.27Å
263	F	71.9	Confident	62.8	Low	54 Å²	54	89.4 Å²	89.4	24%	0.237	43%	0.428	C	S	.	.	H	α-helix	trans	-63.2	-45.4	169.1	-68.1	-46.9	0	0	0	112.7	I208 V211 F259 R265 S266 S267	I208-F263 HydrophobicContact CD1-CD1 4.49Å; I208-F263 HydrophobicContact CD1-CE1 4.39Å; I208-F263 HydrophobicContact CG1-CD1 4.16Å; I208-F263 HydrophobicContact CG1-CE1 3.81Å; V211-F263 HydrophobicContact CB-CE1 3.93Å; V211-F263 HydrophobicContact CB-CZ 3.75Å; V211-F263 HydrophobicContact CG1-CE1 4.44Å; V211-F263 HydrophobicContact CG1-CZ 3.75Å; V211-F263 VanDerWaalsContact O-CE1 3.25Å; V211-F263 WeakPolarHBondContact O-CE1 3.12Å; V211-F263 WeakPolarHBondContact O-CZ 3.24Å; F259-F263 HydrophobicContact CB-CD2 4.35Å; F259-F263 HydrophobicContact CB-CE2 3.9Å; F259-F263 HydrophobicContact CD1-CE2 4.25Å; F259-F263 HydrophobicContact CD1-CZ 4.1Å; F259-F263 WeakPolarHBondContact O-CD2 3.35Å; F259-F263 VanDerWaalsContact O-CG 3.3Å; F259-F263 WeakPolarHBondContact O-CG 3.45Å; F259-F263 PolarHBondContact O-N 3.46Å; F263-R265 VanDerWaalsContact C-N 3.25Å; F263-R265 PolarHBondContact O-N 3.3Å; F263-S266 WeakPolarHBondContact O-CA 3.23Å; F263-S266 WeakPolarHBondContact O-CB 3.4Å; F263-S266 PolarHBondContact O-N 2.83Å; F263-S266 PolarHBondContact O-OG 3.2Å; F263-S267 PolarHBondContact O-N 3.34Å
264	R	60.3	Low	60.4	Low	141 Å²	141	94 Å²	94	53%	0.532	45%	0.448	S	S	.	.	H	α-helix	trans	-56.7	-39.3	177.2	-95.3	-175.9	-82.4	-174.1	-6.1	112.5	S260 T261 S266 S267	S260-R264 PolarHBondContact O-N 3.37Å; T261-R264 PolarHBondContact O-N 3.4Å; R264-S266 PolarHBondContact O-N 2.83Å; R264-S267 PolarHBondContact O-OG 3.21Å; R264-S267 VanDerWaalsContact O-OG 3.04Å
265	R	56.1	Low	58	Low	101 Å²	101	92.2 Å²	92.2	38%	0.381	46%	0.457	S	S	.	.	H	α-helix	trans	-71.4	-12.1	175.1	-69.3	177.2	170.3	-173.8	-7	114	C186 P188 T261 A262 F263	C186-R265 WeakPolarHBondContact O-CD 3.44Å; C186-R265 PolarHBondContact O-NH1 3.49Å; P188-R265 WeakPolarHBondContact CG-O 3.48Å; T261-R265 PolarHBondContact O-N 3.26Å; A262-R265 PolarHBondContact O-N 3Å; F263-R265 VanDerWaalsContact C-N 3.25Å; F263-R265 PolarHBondContact O-N 3.3Å
266	S	50	Low	55.6	Low	38 Å²	38	96.2 Å²	96.2	27%	0.266	49%	0.49	S	S	.	.	H	α-helix	trans	-92.8	-30.9	178.6	75.2	0	0	0	0	114.8	P188 A262 F263 R264 Q268	P188-S266 VanDerWaalsContact CB-CA 3.48Å; A262-S266 PolarHBondContact O-N 3.27Å; F263-S266 WeakPolarHBondContact O-CA 3.23Å; F263-S266 WeakPolarHBondContact O-CB 3.4Å; F263-S266 PolarHBondContact O-N 2.83Å; F263-S266 PolarHBondContact O-OG 3.2Å; R264-S266 PolarHBondContact O-N 2.83Å; S266-Q268 VanDerWaalsContact C-N 3.33Å; S266-Q268 PolarHBondContact O-N 2.8Å
267	S	44.8	Very low	52.9	Low	76 Å²	76	102.6 Å²	102.6	53%	0.531	52%	0.524	S	S	.	.	H	α-helix	trans	-68.5	-27.8	179.4	33.7	0	0	0	0	113.7	F263 R264 R269 A270	F263-S267 PolarHBondContact O-N 3.34Å; R264-S267 PolarHBondContact O-OG 3.21Å; R264-S267 VanDerWaalsContact O-OG 3.04Å; S267-R269 PolarHBondContact O-N 3.03Å; S267-R269 VanDerWaalsContact O-N 3.1Å; S267-A270 PolarHBondContact O-N 3.46Å
268	Q	43.1	Very low	50.5	Low	146 Å²	146	101.8 Å²	101.8	68%	0.682	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-7.1	-172.4	-73.3	177.1	-33.4	0	0	115.8	S266	S266-Q268 VanDerWaalsContact C-N 3.33Å; S266-Q268 PolarHBondContact O-N 2.8Å
269	R	39.7	Very low	47.8	Very low	174 Å²	174	104.1 Å²	104.1	66%	0.657	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-4.2	-178.4	-97.5	-174.4	-178.8	162.5	4.3	115.4	D189 S267	D189-R269 VanDerWaalsContact CG-NH1 3.26Å; D189-R269 IonicContact OD1-NH1 3.75Å; D189-R269 PolarHBondContact OD1-NH1 2.94Å; D189-R269 IonicContact OD2-CZ 3.23Å; D189-R269 IonicContact OD2-NH1 2.68Å; D189-R269 PolarHBondContact OD2-NH1 2.94Å; D189-R269 IonicContact OD2-NH2 3.72Å; S267-R269 PolarHBondContact O-N 3.03Å; S267-R269 VanDerWaalsContact O-N 3.1Å
270	A	35.7	Very low	45.1	Very low	78 Å²	78	109.9 Å²	109.9	65%	0.645	60%	0.604	S	S	*	*	S	Bend	trans	-76.4	-39.3	-167.6	0	0	0	0	0	114.9	S267	S267-A270 PolarHBondContact O-N 3.46Å
271	D	34.8	Very low	43.2	Very low	155 Å²	155	114.2 Å²	114.2	83%	0.829	63%	0.631	S	S	*	*	S	Bend	trans	-96	6.5	-162.6	-68.7	-51.5	0	0	0	115.9	R273	D271-R273 PolarHBondContact O-N 3.4Å
272	I	35.8	Very low	41.5	Very low	150 Å²	150	116.4 Å²	116.4	77%	0.769	64%	0.641	S	S	*	*			trans	-95.3	56.1	-176.6	-42.5	-177.2	0	0	0	112
273	R	35.2	Very low	40.6	Very low	234 Å²	234	118.8 Å²	118.8	88%	0.883	67%	0.666	S	S	*	*	S	Bend	trans	-151.1	63.3	165.1	-75.9	-157.5	178.3	177.4	1.4	113.8	D271	D271-R273 PolarHBondContact O-N 3.4Å
274	D	30.2	Very low	40.5	Very low	158 Å²	158	119.3 Å²	119.3	85%	0.845	67%	0.671	S	S	*	*	S	Bend	trans	-170.5	167.2	132.7	-108.2	-27.7	0	0	0	112.5
275	T	31	Very low	41.6	Very low	142 Å²	142	115.1 Å²	115.1	87%	0.871	66%	0.659	S	S	*	*			trans	78.2	132	-179.4	-32.4	0	0	0	0	115.4
276	A	33.2	Very low	43	Very low	84 Å²	84	110.4 Å²	110.4	69%	0.694	64%	0.641	S	S	*	*			trans	-142.1	169.4	177.3	0	0	0	0	0	110.4
277	L	32.3	Very low	44.8	Very low	171 Å²	171	110.1 Å²	110.1	90%	0.895	64%	0.638	S	S	*	*			trans	74.4	92.1	174.4	-50.8	173.7	0	0	0	116.8
278	S	30.8	Very low	47.1	Very low	129 Å²	129	106.6 Å²	106.6	90%	0.902	61%	0.613	S	S	*	*				161.5	129.1	109.2	64.9	0	0	0	0	112.3
279	G	26.5	Very low	49.5	Very low	69 Å²	69	101.1 Å²	101.1	71%	0.711	59%	0.59	S	S	*	*			trans	124.8	152.4	171.2	0	0	0	0	0	114.7
280	P	28.5	Very low	52.1	Low	122 Å²	122	92.9 Å²	92.9	79%	0.792	56%	0.558	S	S	*	*			trans	-73.2	164.1	170.6	32.6	-34.9	0	0	0	111.8	D282	P280-D282 PolarHBondContact O-N 2.83Å
281	P	36.7	Very low	54.8	Low	133 Å²	133	90.3 Å²	90.3	86%	0.864	54%	0.536	S	S	*	.			trans	-83.2	82.3	-166.6	33.8	-36.8	0	0	0	113.6	G283	P281-G283 VanDerWaalsContact C-N 3.27Å; P281-G283 PolarHBondContact O-N 3.27Å
282	D	42.3	Very low	57.6	Low	89 Å²	89	83 Å²	83	48%	0.476	50%	0.497	S	S	.	.			trans	-81.6	72.8	168.4	-150.7	-12	0	0	0	110.2	P280 D284 R450	P280-D282 PolarHBondContact O-N 2.83Å; D282-D284 PolarHBondContact O-N 3.38Å; D282-R450 IonicContact OD1-CZ 2.62Å; D282-R450 IonicContact OD1-NE 2.7Å; D282-R450 IonicContact OD1-NH2 2.68Å; D282-R450 PolarHBondContact OD1-NH2 2.78Å; D282-R450 IonicContact OD2-NH2 2.79Å; D282-R450 PolarHBondContact OD2-NH2 3.41Å
283	G	52.8	Low	60.2	Low	50 Å²	50	78.1 Å²	78.1	52%	0.515	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-2.2	-173.5	0	0	0	0	0	115.7	P281	P281-G283 VanDerWaalsContact C-N 3.27Å; P281-G283 PolarHBondContact O-N 3.27Å
284	D	71.7	Confident	63	Low	65 Å²	65	67 Å²	67	35%	0.348	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-1.2	-160.2	-73.5	-10.7	0	0	0	113.5	D282 Y286 R450 L451	D282-D284 PolarHBondContact O-N 3.38Å; D284-Y286 WeakPolarHBondContact O-CD2 3.47Å; D284-Y286 WeakPolarHBondContact O-CE2 3.14Å; D284-R450 HydrophobicContact CB-CG 4.33Å; D284-R450 CarbonylContact O-C 3.5Å; D284-R450 WeakPolarHBondContact O-CA 3.42Å; D284-L451 WeakPolarHBondContact CB-O 3.42Å; D284-L451 VanDerWaalsContact CG-O 3.26Å; D284-L451 PolarHBondContact O-N 2.98Å
285	L	81.7	Confident	65.9	Low	53 Å²	53	63.3 Å²	63.3	28%	0.277	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	129.6	-174.7	-165.7	69.9	0	0	0	112.9	R450	L285-R450 HydrophobicContact CD1-CB 4.02Å; L285-R450 HydrophobicContact CD1-CG 4.19Å
286	Y	85.9	Confident	68.8	Low	3 Å²	3	56.9 Å²	56.9	1%	0.012	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	124.8	-177.3	-54	-104.2	0	0	0	110.8	D284 K335 L337 L449 L451	D284-Y286 WeakPolarHBondContact O-CD2 3.47Å; D284-Y286 WeakPolarHBondContact O-CE2 3.14Å; Y286-K335 HydrophobicContact CE1-CB 4.18Å; Y286-K335 HydrophobicContact CE1-CD 3.8Å; Y286-K335 HydrophobicContact CE1-CG 4.05Å; Y286-K335 WeakPolarHBondContact OH-CE 3.24Å; Y286-K335 PolarHBondContact OH-NZ 2.86Å; Y286-L337 HydrophobicContact CD1-CD1 3.36Å; Y286-L337 HydrophobicContact CD1-CD2 4.29Å; Y286-L337 HydrophobicContact CD1-CG 3.56Å; Y286-L337 HydrophobicContact CD2-CD1 4.01Å; Y286-L337 HydrophobicContact CE1-CD1 3.71Å; Y286-L337 HydrophobicContact CE1-CD2 3.81Å; Y286-L337 HydrophobicContact CE1-CG 3.59Å; Y286-L337 HydrophobicContact CE2-CD1 4.36Å; Y286-L337 HydrophobicContact CG-CD1 3.51Å; Y286-L337 HydrophobicContact CG-CG 4.25Å; Y286-L449 PolarHBondContact N-O 2.82Å; Y286-L449 PolarHBondContact O-N 3.39Å; Y286-L451 HydrophobicContact CD2-CB 4.49Å; Y286-L451 HydrophobicContact CD2-CD1 4Å; Y286-L451 HydrophobicContact CD2-CG 4.03Å; Y286-L451 HydrophobicContact CE2-CB 3.95Å; Y286-L451 HydrophobicContact CE2-CD1 3.62Å; Y286-L451 HydrophobicContact CE2-CG 3.84Å
287	T	88.5	Confident	71.5	Confident	32 Å²	32	55 Å²	55	20%	0.196	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	131.9	-176.8	-50.5	0	0	0	0	110.9	M332 T446 F447 Y448	T287-M332 HydrophobicContact CG2-CB 4.25Å; T287-M332 PolarHBondContact O-N 2.98Å; T287-T446 HydrophobicContact CG2-CG2 3.4Å; T287-T446 VanDerWaalsContact CG2-CG2 3.4Å; T287-F447 WeakPolarHBondContact CA-O 3.29Å; T287-Y448 HydrophobicContact CG2-CD1 4.03Å; T287-Y448 HydrophobicContact CG2-CE1 3.71Å
288	F	92.1	Very high	73.9	Confident	1 Å²	1	50 Å²	50	0%	0.004	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	131.2	177.3	-65.7	-94.1	0	0	0	110.8	V290 V329 Q330 Q331 L337 F420 T446 F447 L449	F288-V290 HydrophobicContact CB-CG2 4.42Å; F288-V329 HydrophobicContact CD1-CG1 3.91Å; F288-Q330 CarbonylContact C-O 3.56Å; F288-Q330 VanDerWaalsContact CA-O 3.24Å; F288-Q330 WeakPolarHBondContact CA-O 3.36Å; F288-Q331 HydrophobicContact CD1-CB 3.85Å; F288-Q331 HydrophobicContact CD1-CG 4Å; F288-Q331 HydrophobicContact CE1-CB 3.74Å; F288-Q331 HydrophobicContact CE1-CG 3.68Å; F288-Q331 HydrophobicContact CZ-CG 4.01Å; F288-L337 HydrophobicContact CE2-CD1 4.3Å; F288-L337 HydrophobicContact CZ-CB 4.32Å; F288-L337 HydrophobicContact CZ-CD1 3.99Å; F288-F420 HydrophobicContact CB-CE1 3.94Å; F288-F420 HydrophobicContact CB-CZ 4.26Å; F288-F420 HydrophobicContact CD1-CZ 4.28Å; F288-F420 HydrophobicContact CD2-CE1 4.23Å; F288-F420 HydrophobicContact CD2-CZ 4.02Å; F288-F420 HydrophobicContact CE2-CZ 4.41Å; F288-F420 HydrophobicContact CG-CE1 4.1Å; F288-F420 AromaticContact CG-CZ 3.94Å; F288-F420 HydrophobicContact CG-CZ 3.94Å; F288-T446 CarbonylContact O-C 3.54Å; F288-T446 WeakPolarHBondContact O-CA 3.5Å; F288-T446 WeakPolarHBondContact O-CG2 3.44Å; F288-F447 PolarHBondContact N-O 2.81Å; F288-F447 PolarHBondContact O-N 3.45Å; F288-L449 HydrophobicContact CD2-CB 4.29Å; F288-L449 HydrophobicContact CE2-CB 4.07Å; F288-L449 HydrophobicContact CE2-CD2 3.8Å; F288-L449 HydrophobicContact CZ-CD2 4.45Å
289	T	93.3	Very high	76.1	Confident	32 Å²	32	47 Å²	47	20%	0.196	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	119.8	166	-58.6	0	0	0	0	108.8	Q330	T289-Q330 PolarHBondContact N-O 3.23Å; T289-Q330 PolarHBondContact O-N 3.04Å
290	V	94.4	Very high	78.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128.8	-178.7	-174.7	0	0	0	0	109.6	F288 V327 S328 V329 F420 L422 S444 E445 F447	F288-V290 HydrophobicContact CB-CG2 4.42Å; V290-V327 HydrophobicContact CG1-CG1 3.52Å; V290-S328 CarbonylContact C-O 3.07Å; V290-S328 WeakPolarHBondContact CA-O 3.23Å; V290-V329 HydrophobicContact CB-CG2 4.47Å; V290-V329 HydrophobicContact CG1-CG2 3.85Å; V290-V329 HydrophobicContact CG2-CB 4.44Å; V290-V329 HydrophobicContact CG2-CG1 4.22Å; V290-V329 HydrophobicContact CG2-CG2 3.99Å; V290-F420 HydrophobicContact CG2-CB 4.36Å; V290-F420 HydrophobicContact CG2-CD1 3.58Å; V290-F420 HydrophobicContact CG2-CE1 4.04Å; V290-F420 HydrophobicContact CG2-CG 4.03Å; V290-L422 HydrophobicContact CB-CD2 4.38Å; V290-L422 HydrophobicContact CG1-CD1 3.88Å; V290-L422 HydrophobicContact CG1-CD2 4.12Å; V290-L422 HydrophobicContact CG1-CG 4.34Å; V290-S444 CarbonylContact O-C 3.51Å; V290-S444 VanDerWaalsContact O-CA 3.3Å; V290-S444 WeakPolarHBondContact O-CA 3.46Å; V290-E445 PolarHBondContact N-O 3.03Å; V290-E445 PolarHBondContact O-N 3.32Å; V290-F447 HydrophobicContact CB-CD2 3.99Å; V290-F447 HydrophobicContact CB-CE2 3.79Å; V290-F447 HydrophobicContact CG2-CD2 3.72Å; V290-F447 HydrophobicContact CG2-CE2 3.96Å
291	S	92.7	Very high	80.7	Confident	25 Å²	25	48.7 Å²	48.7	18%	0.175	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143	-173.7	60.7	0	0	0	0	113.9	V327 S328 F443	S291-V327 CarbonylContact O-C 3.6Å; S291-V327 VanDerWaalsContact O-CA 3.3Å; S291-V327 WeakPolarHBondContact O-CA 3.49Å; S291-S328 PolarHBondContact N-O 3.05Å; S291-S328 PolarHBondContact O-N 2.85Å; S291-S328 PolarHBondContact OG-O 3.02Å; S291-F443 CarbonylContact C-O 3.58Å; S291-F443 WeakPolarHBondContact CA-O 3.4Å; S291-F443 VanDerWaalsContact CB-O 3.23Å; S291-F443 WeakPolarHBondContact CB-O 3.16Å
292	L	93.4	Very high	82.9	Confident	1 Å²	1	47 Å²	47	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.1	-176.5	-172.2	63.4	0	0	0	111.7	K308 F315 V325 V327 M403 V405 L422 T424 F443	L292-K308 PolarHBondContact O-NZ 2.62Å; L292-F315 HydrophobicContact CB-CZ 4.35Å; L292-F315 HydrophobicContact CD2-CE2 4.1Å; L292-F315 HydrophobicContact CD2-CZ 3.97Å; L292-F315 HydrophobicContact CG-CZ 3.96Å; L292-V325 HydrophobicContact CD1-CG1 3.8Å; L292-V327 HydrophobicContact CD1-CG2 3.85Å; L292-M403 HydrophobicContact CD2-CE 4.03Å; L292-V405 HydrophobicContact CD1-CB 4.38Å; L292-V405 HydrophobicContact CD1-CG1 4.22Å; L292-V405 HydrophobicContact CD1-CG2 4.21Å; L292-V405 HydrophobicContact CD2-CG2 4.28Å; L292-L422 HydrophobicContact CB-CD1 4.27Å; L292-L422 HydrophobicContact CD1-CD1 4.46Å; L292-T424 HydrophobicContact CD2-CG2 4.08Å; L292-F443 HydrophobicContact CB-CB 4.4Å; L292-F443 HydrophobicContact CB-CD1 3.86Å; L292-F443 PolarHBondContact N-O 2.88Å
293	E	91.8	Very high	85.1	Confident	47 Å²	47	45.2 Å²	45.2	22%	0.22	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	138.7	167	-160.1	-167.2	159.9	0	0	109.9	R295 P305 L326	E293-R295 VanDerWaalsContact CD-NE 3.31Å; E293-R295 IonicContact OE1-CZ 2.92Å; E293-R295 IonicContact OE1-NE 2.7Å; E293-R295 PolarHBondContact OE1-NE 3.47Å; E293-R295 IonicContact OE1-NH2 2.74Å; E293-R295 PolarHBondContact OE1-NH2 3.04Å; E293-R295 IonicContact OE2-CZ 3.73Å; E293-R295 IonicContact OE2-NE 2.7Å; E293-R295 PolarHBondContact OE2-NE 2.76Å; E293-R295 IonicContact OE2-NH2 3.51Å; E293-R295 PolarHBondContact OE2-NH2 3.31Å; E293-P305 WeakPolarHBondContact OE1-CB 3.33Å; E293-P305 VanDerWaalsContact OE1-CG 3.3Å; E293-P305 WeakPolarHBondContact OE1-CG 3.42Å; E293-L326 HydrophobicContact CB-CB 4.25Å; E293-L326 PolarHBondContact N-O 3.18Å; E293-L326 PolarHBondContact O-N 2.7Å
294	I	92.4	Very high	86.7	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	138.4	171.6	-49.9	170.9	0	0	0	106.4	V306 F315 L317 K323 K324 M403	I294-V306 HydrophobicContact CB-CB 4.15Å; I294-V306 HydrophobicContact CB-CG2 3.91Å; I294-V306 HydrophobicContact CG2-CG2 3.84Å; I294-V306 WeakPolarHBondContact O-CB 3.49Å; I294-V306 WeakPolarHBondContact O-CG2 3.33Å; I294-V306 PolarHBondContact O-N 2.77Å; I294-F315 HydrophobicContact CB-CD1 4.2Å; I294-F315 HydrophobicContact CB-CE1 4.11Å; I294-F315 HydrophobicContact CD1-CB 4.25Å; I294-F315 HydrophobicContact CD1-CD1 3.47Å; I294-F315 VanDerWaalsContact CD1-CD1 3.47Å; I294-F315 HydrophobicContact CD1-CD2 4.34Å; I294-F315 HydrophobicContact CD1-CE1 3.65Å; I294-F315 HydrophobicContact CD1-CG 3.81Å; I294-F315 HydrophobicContact CD1-CZ 4.16Å; I294-F315 HydrophobicContact CG1-CD1 3.85Å; I294-F315 HydrophobicContact CG1-CE1 3.58Å; I294-F315 HydrophobicContact CG1-CZ 4.18Å; I294-L317 HydrophobicContact CD1-CD2 4.25Å; I294-L317 HydrophobicContact CG2-CD2 4.08Å; I294-K323 HydrophobicContact CG2-CB 4.35Å; I294-K323 HydrophobicContact CG2-CD 4.43Å; I294-K323 HydrophobicContact CG2-CG 4.46Å; I294-K324 WeakPolarHBondContact CA-O 3.5Å; I294-M403 HydrophobicContact CD1-CE 3.56Å; I294-M403 HydrophobicContact CD1-SD 4.2Å; I294-M403 HydrophobicContact CG1-CE 4.48Å
295	R	91.9	Very high	87.4	Confident	81 Å²	81	46.9 Å²	46.9	31%	0.306	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	142.3	174.4	-55.4	-167.2	175.8	159.2	10.2	111	E293 Y303 N304 K323 K324 L326	E293-R295 VanDerWaalsContact CD-NE 3.31Å; E293-R295 IonicContact OE1-CZ 2.92Å; E293-R295 IonicContact OE1-NE 2.7Å; E293-R295 PolarHBondContact OE1-NE 3.47Å; E293-R295 IonicContact OE1-NH2 2.74Å; E293-R295 PolarHBondContact OE1-NH2 3.04Å; E293-R295 IonicContact OE2-CZ 3.73Å; E293-R295 IonicContact OE2-NE 2.7Å; E293-R295 PolarHBondContact OE2-NE 2.76Å; E293-R295 IonicContact OE2-NH2 3.51Å; E293-R295 PolarHBondContact OE2-NH2 3.31Å; R295-Y303 HydrophobicContact CB-CD1 4.46Å; R295-N304 CarbonylContact C-O 3.55Å; R295-N304 WeakPolarHBondContact CA-O 3.37Å; R295-N304 WeakPolarHBondContact CB-O 3.48Å; R295-K323 CarbonylContact O-C 3.59Å; R295-K323 WeakPolarHBondContact O-CA 3.31Å; R295-K324 PolarHBondContact N-O 3.03Å; R295-K324 PolarHBondContact O-N 3.01Å; R295-L326 HydrophobicContact CG-CD1 4.16Å
296	E	92.1	Very high	87.7	Confident	7 Å²	7	44.8 Å²	44.8	3%	0.033	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	139.5	177.3	-84	-179.9	178.3	0	0	111	Y303 N304 V306 L317 R318 V321 K323	E296-Y303 CarbonylContact O-C 3.59Å; E296-Y303 WeakPolarHBondContact O-CA 3.25Å; E296-N304 PolarHBondContact N-O 2.81Å; E296-N304 PolarHBondContact O-N 3.18Å; E296-V306 HydrophobicContact CB-CG2 4.5Å; E296-V306 HydrophobicContact CG-CG2 3.88Å; E296-L317 WeakPolarHBondContact OE1-CA 3.34Å; E296-R318 PolarHBondContact OE1-N 2.78Å; E296-R318 WeakPolarHBondContact OE2-CG 3.48Å; E296-R318 IonicContact OE2-CZ 3.42Å; E296-R318 IonicContact OE2-NH1 2.62Å; E296-R318 PolarHBondContact OE2-NH1 3.34Å; E296-V321 HydrophobicContact CB-CG1 3.86Å; E296-V321 HydrophobicContact CG-CB 4.47Å; E296-V321 HydrophobicContact CG-CG1 3.97Å; E296-K323 HydrophobicContact CG-CD 4.43Å; E296-K323 HydrophobicContact CG-CG 3.8Å; E296-K323 VanDerWaalsContact OE1-CE 3.25Å; E296-K323 WeakPolarHBondContact OE1-CE 3.47Å; E296-K323 IonicContact OE1-NZ 2.66Å
297	D	89.8	Confident	87.5	Confident	45 Å²	45	45 Å²	45	24%	0.241	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	134.3	169.3	-178.5	17.8	0	0	0	111.1	G299 G301 Y303 V321 Q322	D297-G299 VanDerWaalsContact C-N 3.28Å; D297-G299 PolarHBondContact OD1-N 3.31Å; D297-G301 PolarHBondContact OD1-N 2.7Å; D297-Y303 HydrophobicContact CB-CD1 4.41Å; D297-Y303 HydrophobicContact CB-CE1 3.97Å; D297-Y303 HydrophobicContact CB-CE2 4.42Å; D297-V321 WeakPolarHBondContact O-CG1 3.27Å; D297-Q322 PolarHBondContact N-O 3.31Å
298	D	82.9	Confident	87	Confident	66 Å²	66	44.4 Å²	44.4	35%	0.353	25%	0.253	S	S	.	.			trans	-86.1	5	175.3	73.2	-12.4	0	0	0	114.2	K300 N302	D298-K300 PolarHBondContact O-N 2.9Å; D298-K300 WeakPolarHBondContact OD1-CA 3.42Å; D298-K300 VanDerWaalsContact OD1-CB 3.3Å; D298-K300 WeakPolarHBondContact OD1-CB 3.34Å; D298-K300 PolarHBondContact OD1-N 3.12Å; D298-N302 PolarHBondContact N-O 2.95Å; D298-N302 PolarHBondContact OD1-N 3.5Å; D298-N302 VanDerWaalsContact OD1-N 3.12Å
299	G	76.3	Confident	86.3	Confident	66 Å²	66	45.5 Å²	45.5	68%	0.68	26%	0.259	S	S	*	.	S	Bend	trans	75.3	10.4	-176.1	0	0	0	0	0	113.2	D297	D297-G299 VanDerWaalsContact C-N 3.28Å; D297-G299 PolarHBondContact OD1-N 3.31Å
300	K	77.9	Confident	84.5	Confident	171 Å²	171	53 Å²	53	74%	0.743	28%	0.284	S	S	*	.	S	Bend	trans	-119.3	8.7	171.6	-52.4	171.5	-172.9	164.7	0	111.4	D298	D298-K300 PolarHBondContact O-N 2.9Å; D298-K300 WeakPolarHBondContact OD1-CA 3.42Å; D298-K300 VanDerWaalsContact OD1-CB 3.3Å; D298-K300 WeakPolarHBondContact OD1-CB 3.34Å; D298-K300 PolarHBondContact OD1-N 3.12Å
301	G	73.4	Confident	82.7	Confident	55 Å²	55	59 Å²	59	57%	0.567	32%	0.316	S	S	*	.	S	Bend	trans	85.2	9.6	-177.9	0	0	0	0	0	114.4	D297	D297-G301 PolarHBondContact OD1-N 2.7Å
302	N	82.6	Confident	81	Confident	96 Å²	96	65.1 Å²	65.1	51%	0.513	34%	0.339	S	S	.	.			trans	-105.1	125	176.1	-62.3	-69.9	0	0	0	111.2	D298 N304	D298-N302 PolarHBondContact N-O 2.95Å; D298-N302 PolarHBondContact OD1-N 3.5Å; D298-N302 VanDerWaalsContact OD1-N 3.12Å; N302-N304 PolarHBondContact O-N 2.84Å; N302-N304 PolarHBondContact O-ND2 2.66Å; N302-N304 VanDerWaalsContact O-ND2 3.13Å
303	Y	89	Confident	79.8	Confident	52 Å²	52	70.8 Å²	70.8	20%	0.204	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	108.7	177	-76.7	-93.6	0	0	0	110.6	R295 E296 D297 Q322 K324	R295-Y303 HydrophobicContact CB-CD1 4.46Å; E296-Y303 CarbonylContact O-C 3.59Å; E296-Y303 WeakPolarHBondContact O-CA 3.25Å; D297-Y303 HydrophobicContact CB-CD1 4.41Å; D297-Y303 HydrophobicContact CB-CE1 3.97Å; D297-Y303 HydrophobicContact CB-CE2 4.42Å; Y303-Q322 HydrophobicContact CE1-CG 4.48Å; Y303-Q322 WeakPolarHBondContact OH-CG 3.42Å; Y303-Q322 PolarHBondContact OH-OE1 2.96Å; Y303-K324 HydrophobicContact CD1-CB 4.08Å; Y303-K324 HydrophobicContact CD1-CD 3.8Å; Y303-K324 HydrophobicContact CD1-CG 3.68Å; Y303-K324 HydrophobicContact CD2-CD 3.99Å; Y303-K324 HydrophobicContact CE1-CB 4.42Å; Y303-K324 HydrophobicContact CE1-CD 4.02Å; Y303-K324 HydrophobicContact CE1-CG 3.67Å; Y303-K324 HydrophobicContact CE2-CD 4.22Å; Y303-K324 HydrophobicContact CG-CD 3.77Å; Y303-K324 HydrophobicContact CG-CG 4.2Å
304	N	87	Confident	79.4	Confident	80 Å²	80	70.1 Å²	70.1	43%	0.428	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	140.3	-177.1	-75.1	-91	0	0	0	111.5	R295 E296 N302 V306	R295-N304 CarbonylContact C-O 3.55Å; R295-N304 WeakPolarHBondContact CA-O 3.37Å; R295-N304 WeakPolarHBondContact CB-O 3.48Å; E296-N304 PolarHBondContact N-O 2.81Å; E296-N304 PolarHBondContact O-N 3.18Å; N302-N304 PolarHBondContact O-N 2.84Å; N302-N304 PolarHBondContact O-ND2 2.66Å; N302-N304 VanDerWaalsContact O-ND2 3.13Å; N304-V306 PolarHBondContact O-N 3.25Å
305	P	87.1	Confident	79.3	Confident	71 Å²	71	70.1 Å²	70.1	46%	0.461	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	131.4	179.9	-24.9	34.2	0	0	0	113.8	E293	E293-P305 WeakPolarHBondContact OE1-CB 3.33Å; E293-P305 VanDerWaalsContact OE1-CG 3.3Å; E293-P305 WeakPolarHBondContact OE1-CG 3.42Å
306	V	88.3	Confident	79.1	Confident	9 Å²	9	68.1 Å²	68.1	6%	0.055	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-66.2	130	175.2	165.9	0	0	0	0	110	I294 E296 N304 F315 K316 L317	I294-V306 HydrophobicContact CB-CB 4.15Å; I294-V306 HydrophobicContact CB-CG2 3.91Å; I294-V306 HydrophobicContact CG2-CG2 3.84Å; I294-V306 WeakPolarHBondContact O-CB 3.49Å; I294-V306 WeakPolarHBondContact O-CG2 3.33Å; I294-V306 PolarHBondContact O-N 2.77Å; E296-V306 HydrophobicContact CB-CG2 4.5Å; E296-V306 HydrophobicContact CG-CG2 3.88Å; N304-V306 PolarHBondContact O-N 3.25Å; V306-F315 HydrophobicContact CB-CD1 4.32Å; V306-F315 HydrophobicContact CG1-CB 4.05Å; V306-F315 HydrophobicContact CG1-CD1 3.84Å; V306-F315 HydrophobicContact CG1-CG 4.46Å; V306-K316 WeakPolarHBondContact CG1-O 3.45Å; V306-L317 HydrophobicContact CB-CD2 4.28Å; V306-L317 HydrophobicContact CG1-CD2 3.66Å; V306-L317 HydrophobicContact CG2-CD2 3.65Å
307	P	81.1	Confident	79.1	Confident	7 Å²	7	67.8 Å²	67.8	5%	0.045	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-73.2	140.4	178.2	27.1	-28.9	0	0	0	111.5	K316 F435 F438	P307-K316 HydrophobicContact CG-CB 4.28Å; P307-K316 WeakPolarHBondContact O-CB 3.41Å; P307-K316 PolarHBondContact O-N 3.24Å; P307-F435 HydrophobicContact CB-CB 4.31Å; P307-F435 HydrophobicContact CG-CB 3.64Å; P307-F435 HydrophobicContact CG-CD2 3.26Å; P307-F435 HydrophobicContact CG-CE2 4Å; P307-F435 HydrophobicContact CG-CG 3.57Å; P307-F438 HydrophobicContact CB-CB 3.55Å; P307-F438 HydrophobicContact CB-CD1 3.55Å; P307-F438 HydrophobicContact CB-CD2 3.55Å; P307-F438 HydrophobicContact CB-CE1 4.03Å; P307-F438 HydrophobicContact CB-CE2 4.02Å; P307-F438 HydrophobicContact CB-CG 3.27Å; P307-F438 HydrophobicContact CB-CZ 4.24Å
308	K	78.1	Confident	79	Confident	19 Å²	19	68.5 Å²	68.5	8%	0.083	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-106.6	142.7	177.6	-47.7	-167.9	-168.6	-159.2	0	110.2	L292 Y314 F315 S439	L292-K308 PolarHBondContact O-NZ 2.62Å; K308-Y314 WeakPolarHBondContact CA-O 3.21Å; K308-F315 HydrophobicContact CD-CD1 4.3Å; K308-F315 HydrophobicContact CD-CE1 4.09Å; K308-F315 HydrophobicContact CD-CE2 4.48Å; K308-F315 HydrophobicContact CD-CZ 4.22Å; K308-F315 HydrophobicContact CG-CD1 4.2Å; K308-F315 HydrophobicContact CG-CE1 4.45Å; K308-F315 VanDerWaalsContact NZ-CE1 3.28Å; K308-S439 PolarHBondContact O-N 3.09Å
309	D	76	Confident	79.4	Confident	25 Å²	25	68.4 Å²	68.4	13%	0.134	35%	0.349	C	S	.	.			trans	-63.4	136.2	172.1	-161.1	-82.7	0	0	0	110.6	D311 K312 F313 Y314 K316	D309-D311 PolarHBondContact OD1-N 3.41Å; D309-D311 VanDerWaalsContact OD1-N 3.08Å; D309-K312 HydrophobicContact CB-CB 4.48Å; D309-K312 PolarHBondContact OD1-N 3.04Å; D309-F313 WeakPolarHBondContact O-CA 3.21Å; D309-F313 PolarHBondContact O-N 2.91Å; D309-Y314 HydrophobicContact CB-CD1 3.6Å; D309-Y314 HydrophobicContact CB-CD2 4.36Å; D309-Y314 HydrophobicContact CB-CE1 3.37Å; D309-Y314 HydrophobicContact CB-CE2 4.2Å; D309-Y314 HydrophobicContact CB-CG 4.06Å; D309-Y314 PolarHBondContact N-O 2.81Å; D309-Y314 WeakPolarHBondContact OD2-CE1 3.39Å; D309-Y314 PolarHBondContact OD2-OH 3.4Å; D309-K316 WeakPolarHBondContact OD2-CE 3.41Å; D309-K316 IonicContact OD2-NZ 3.1Å; D309-K316 PolarHBondContact OD2-NZ 2.74Å
310	R	56.1	Low	79.9	Confident	189 Å²	189	67.9 Å²	67.9	71%	0.713	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-34.9	-173.9	179.3	-176	160.5	164.4	-3.3	112.1
311	D	56	Low	80.4	Confident	126 Å²	126	61.1 Å²	61.1	67%	0.674	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-22.2	-166.7	-48.2	-44.9	0	0	0	111.1	D309	D309-D311 PolarHBondContact OD1-N 3.41Å; D309-D311 VanDerWaalsContact OD1-N 3.08Å
312	K	58.8	Low	81.2	Confident	153 Å²	153	62.2 Å²	62.2	67%	0.665	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.7	9	179.3	-59.4	-168.3	177.5	-163.8	0	114.9	D309 Y314	D309-K312 HydrophobicContact CB-CB 4.48Å; D309-K312 PolarHBondContact OD1-N 3.04Å; K312-Y314 HydrophobicContact CB-CD1 3.62Å; K312-Y314 HydrophobicContact CB-CE1 3.69Å; K312-Y314 HydrophobicContact CD-CE1 4.39Å; K312-Y314 PolarHBondContact O-N 3.48Å
313	F	67.6	Low	81.7	Confident	120 Å²	120	57.7 Å²	57.7	53%	0.526	28%	0.282	S	S	.	.			trans	54.4	1.7	171	-73.8	-86	0	0	0	119.3	D309	D309-F313 WeakPolarHBondContact O-CA 3.21Å; D309-F313 PolarHBondContact O-N 2.91Å
314	Y	83.8	Confident	81.9	Confident	34 Å²	34	56.8 Å²	56.8	13%	0.133	28%	0.279	C	S	.	.			trans	-77.1	148.8	-179.5	67.3	-91.3	0	0	0	113.7	K308 D309 K312 K316 L425 R427 Y429	K308-Y314 WeakPolarHBondContact CA-O 3.21Å; D309-Y314 HydrophobicContact CB-CD1 3.6Å; D309-Y314 HydrophobicContact CB-CD2 4.36Å; D309-Y314 HydrophobicContact CB-CE1 3.37Å; D309-Y314 HydrophobicContact CB-CE2 4.2Å; D309-Y314 HydrophobicContact CB-CG 4.06Å; D309-Y314 PolarHBondContact N-O 2.81Å; D309-Y314 WeakPolarHBondContact OD2-CE1 3.39Å; D309-Y314 PolarHBondContact OD2-OH 3.4Å; K312-Y314 HydrophobicContact CB-CD1 3.62Å; K312-Y314 HydrophobicContact CB-CE1 3.69Å; K312-Y314 HydrophobicContact CD-CE1 4.39Å; K312-Y314 PolarHBondContact O-N 3.48Å; Y314-K316 HydrophobicContact CD2-CG 4.07Å; Y314-K316 HydrophobicContact CE2-CD 4.1Å; Y314-K316 HydrophobicContact CE2-CG 3.72Å; Y314-K316 WeakPolarHBondContact OH-CE 3.47Å; Y314-K316 PolarHBondContact OH-NZ 2.69Å; Y314-L425 CarbonylContact C-O 3.44Å; Y314-L425 WeakPolarHBondContact CA-O 3.26Å; Y314-L425 WeakPolarHBondContact CB-O 3.47Å; Y314-R427 HydrophobicContact CD2-CB 3.41Å; Y314-R427 VanDerWaalsContact CD2-CB 3.41Å; Y314-R427 HydrophobicContact CE2-CB 3.45Å; Y314-R427 VanDerWaalsContact CE2-CB 3.45Å; Y314-R427 HydrophobicContact CE2-CG 4.18Å; Y314-R427 HydrophobicContact CG-CB 4.47Å; Y314-Y429 PolarHBondContact OH-OH 2.85Å
315	F	89.1	Confident	82.2	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	136.9	172.9	-72.5	-103.6	0	0	0	111.2	L292 I294 V306 K308 T424 L425 V426 R427 F443	L292-F315 HydrophobicContact CB-CZ 4.35Å; L292-F315 HydrophobicContact CD2-CE2 4.1Å; L292-F315 HydrophobicContact CD2-CZ 3.97Å; L292-F315 HydrophobicContact CG-CZ 3.96Å; I294-F315 HydrophobicContact CB-CD1 4.2Å; I294-F315 HydrophobicContact CB-CE1 4.11Å; I294-F315 HydrophobicContact CD1-CB 4.25Å; I294-F315 HydrophobicContact CD1-CD1 3.47Å; I294-F315 VanDerWaalsContact CD1-CD1 3.47Å; I294-F315 HydrophobicContact CD1-CD2 4.34Å; I294-F315 HydrophobicContact CD1-CE1 3.65Å; I294-F315 HydrophobicContact CD1-CG 3.81Å; I294-F315 HydrophobicContact CD1-CZ 4.16Å; I294-F315 HydrophobicContact CG1-CD1 3.85Å; I294-F315 HydrophobicContact CG1-CE1 3.58Å; I294-F315 HydrophobicContact CG1-CZ 4.18Å; V306-F315 HydrophobicContact CB-CD1 4.32Å; V306-F315 HydrophobicContact CG1-CB 4.05Å; V306-F315 HydrophobicContact CG1-CD1 3.84Å; V306-F315 HydrophobicContact CG1-CG 4.46Å; K308-F315 HydrophobicContact CD-CD1 4.3Å; K308-F315 HydrophobicContact CD-CE1 4.09Å; K308-F315 HydrophobicContact CD-CE2 4.48Å; K308-F315 HydrophobicContact CD-CZ 4.22Å; K308-F315 HydrophobicContact CG-CD1 4.2Å; K308-F315 HydrophobicContact CG-CE1 4.45Å; K308-F315 VanDerWaalsContact NZ-CE1 3.28Å; F315-T424 HydrophobicContact CD2-CG2 3.69Å; F315-T424 HydrophobicContact CE2-CG2 3.65Å; F315-T424 WeakPolarHBondContact CE2-OG1 3.48Å; F315-L425 PolarHBondContact N-O 3.49Å; F315-V426 HydrophobicContact CB-CG2 4.42Å; F315-R427 PolarHBondContact O-N 2.87Å; F315-F443 HydrophobicContact CE2-CB 4.2Å; F315-F443 HydrophobicContact CE2-CG 4.4Å; F315-F443 HydrophobicContact CZ-CB 4.13Å
316	K	88.4	Confident	82.6	Confident	39 Å²	39	50.6 Å²	50.6	17%	0.17	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	94.1	-179.2	-54.5	-166.1	-178.8	-168.9	0	111.3	V306 P307 D309 Y314 R427 Y429 F435	V306-K316 WeakPolarHBondContact CG1-O 3.45Å; P307-K316 HydrophobicContact CG-CB 4.28Å; P307-K316 WeakPolarHBondContact O-CB 3.41Å; P307-K316 PolarHBondContact O-N 3.24Å; D309-K316 WeakPolarHBondContact OD2-CE 3.41Å; D309-K316 IonicContact OD2-NZ 3.1Å; D309-K316 PolarHBondContact OD2-NZ 2.74Å; Y314-K316 HydrophobicContact CD2-CG 4.07Å; Y314-K316 HydrophobicContact CE2-CD 4.1Å; Y314-K316 HydrophobicContact CE2-CG 3.72Å; Y314-K316 WeakPolarHBondContact OH-CE 3.47Å; Y314-K316 PolarHBondContact OH-NZ 2.69Å; K316-R427 WeakPolarHBondContact CA-O 3.36Å; K316-Y429 HydrophobicContact CB-CD2 4.17Å; K316-Y429 HydrophobicContact CB-CE2 3.72Å; K316-Y429 HydrophobicContact CD-CE2 4.06Å; K316-Y429 HydrophobicContact CG-CE2 3.9Å; K316-F435 HydrophobicContact CB-CD1 4.19Å; K316-F435 HydrophobicContact CB-CE1 3.81Å; K316-F435 HydrophobicContact CB-CE2 4.27Å; K316-F435 HydrophobicContact CB-CZ 3.84Å; K316-F435 HydrophobicContact CD-CD1 4.23Å; K316-F435 HydrophobicContact CD-CE1 4.41Å; K316-F435 WeakPolarHBondContact O-CE2 3.34Å; K316-F435 WeakPolarHBondContact O-CZ 3.3Å
317	L	91	Very high	82.9	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	161.3	-175.5	-61.1	-175.8	0	0	0	112.5	I294 E296 V306 K323 W381 V426 R427 V428 Y429	I294-L317 HydrophobicContact CD1-CD2 4.25Å; I294-L317 HydrophobicContact CG2-CD2 4.08Å; E296-L317 WeakPolarHBondContact OE1-CA 3.34Å; V306-L317 HydrophobicContact CB-CD2 4.28Å; V306-L317 HydrophobicContact CG1-CD2 3.66Å; V306-L317 HydrophobicContact CG2-CD2 3.65Å; L317-K323 HydrophobicContact CD1-CD 4.33Å; L317-K323 HydrophobicContact CD2-CD 4.15Å; L317-W381 HydrophobicContact CD1-CH2 3.38Å; L317-W381 HydrophobicContact CD1-CZ3 3.69Å; L317-V426 HydrophobicContact CD1-CG1 3.5Å; L317-V426 HydrophobicContact CG-CG1 3.95Å; L317-R427 PolarHBondContact N-O 3.35Å; L317-V428 CarbonylContact O-C 3.58Å; L317-V428 WeakPolarHBondContact O-CA 3.47Å; L317-Y429 PolarHBondContact O-N 3.02Å
318	R	89.6	Confident	83.5	Confident	60 Å²	60	51.1 Å²	51.1	23%	0.226	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	137.3	171.1	-66.4	-176.7	-176.6	94.5	-4.8	111.9	E296 V321 K323 Y429 E433 F435	E296-R318 PolarHBondContact OE1-N 2.78Å; E296-R318 WeakPolarHBondContact OE2-CG 3.48Å; E296-R318 IonicContact OE2-CZ 3.42Å; E296-R318 IonicContact OE2-NH1 2.62Å; E296-R318 PolarHBondContact OE2-NH1 3.34Å; R318-V321 HydrophobicContact CB-CB 4.35Å; R318-V321 HydrophobicContact CB-CG2 3.75Å; R318-K323 PolarHBondContact O-NZ 3.44Å; R318-Y429 WeakPolarHBondContact CA-O 3.22Å; R318-E433 PolarHBondContact NE-O 2.97Å; R318-E433 VanDerWaalsContact NE-O 3.15Å; R318-E433 PolarHBondContact NH2-O 3.5Å; R318-F435 HydrophobicContact CG-CE2 4.11Å; R318-F435 HydrophobicContact CG-CZ 4.25Å
319	Q	91	Very high	84.2	Confident	65 Å²	65	50.2 Å²	50.2	30%	0.304	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	143.4	168.2	65.7	-176	22.4	0	0	111.9	V321 N392 V428 Y429 S431	Q319-V321 PolarHBondContact O-N 2.84Å; Q319-V321 VanDerWaalsContact O-N 3.16Å; Q319-N392 WeakPolarHBondContact CA-OD1 3.36Å; Q319-N392 WeakPolarHBondContact CB-O 3.41Å; Q319-V428 HydrophobicContact CB-CG1 4.17Å; Q319-Y429 PolarHBondContact N-O 3.21Å; Q319-S431 WeakPolarHBondContact O-CB 3.5Å
320	G	85.8	Confident	84.9	Confident	55 Å²	55	52.2 Å²	52.2	57%	0.567	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	-2.4	171.9	0	0	0	0	0	116.9	N392	G320-N392 PolarHBondContact N-OD1 3.42Å
321	V	88.8	Confident	86.5	Confident	28 Å²	28	45 Å²	45	17%	0.17	23%	0.226	C	C	.	.			trans	-93.4	134.4	-178.3	-177.4	0	0	0	0	111.1	E296 D297 R318 Q319 K323	E296-V321 HydrophobicContact CB-CG1 3.86Å; E296-V321 HydrophobicContact CG-CB 4.47Å; E296-V321 HydrophobicContact CG-CG1 3.97Å; D297-V321 WeakPolarHBondContact O-CG1 3.27Å; R318-V321 HydrophobicContact CB-CB 4.35Å; R318-V321 HydrophobicContact CB-CG2 3.75Å; Q319-V321 PolarHBondContact O-N 2.84Å; Q319-V321 VanDerWaalsContact O-N 3.16Å; V321-K323 PolarHBondContact O-NZ 3.1Å
322	Q	89.5	Confident	87.6	Confident	79 Å²	79	43.9 Å²	43.9	37%	0.369	22%	0.218	S	C	.	.			trans	-67.4	138.1	174.9	-170.1	175.1	4.7	0	0	111.2	D297 Y303	D297-Q322 PolarHBondContact N-O 3.31Å; Y303-Q322 HydrophobicContact CE1-CG 4.48Å; Y303-Q322 WeakPolarHBondContact OH-CG 3.42Å; Y303-Q322 PolarHBondContact OH-OE1 2.96Å
323	K	92.8	Very high	88.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	154.6	-172.8	-70.4	168.5	-170.8	78	0	111.5	I294 R295 E296 L317 R318 V321 W381	I294-K323 HydrophobicContact CG2-CB 4.35Å; I294-K323 HydrophobicContact CG2-CD 4.43Å; I294-K323 HydrophobicContact CG2-CG 4.46Å; R295-K323 CarbonylContact O-C 3.59Å; R295-K323 WeakPolarHBondContact O-CA 3.31Å; E296-K323 HydrophobicContact CG-CD 4.43Å; E296-K323 HydrophobicContact CG-CG 3.8Å; E296-K323 VanDerWaalsContact OE1-CE 3.25Å; E296-K323 WeakPolarHBondContact OE1-CE 3.47Å; E296-K323 IonicContact OE1-NZ 2.66Å; L317-K323 HydrophobicContact CD1-CD 4.33Å; L317-K323 HydrophobicContact CD2-CD 4.15Å; R318-K323 PolarHBondContact O-NZ 3.44Å; V321-K323 PolarHBondContact O-NZ 3.1Å; K323-W381 HydrophobicContact CB-CB 4.01Å; K323-W381 HydrophobicContact CB-CD2 3.97Å; K323-W381 HydrophobicContact CB-CE3 3.75Å; K323-W381 HydrophobicContact CB-CG 4.14Å; K323-W381 HydrophobicContact CD-CD2 3.85Å; K323-W381 HydrophobicContact CD-CE3 3.47Å; K323-W381 VanDerWaalsContact CD-CE3 3.47Å; K323-W381 HydrophobicContact CD-CH2 3.78Å; K323-W381 HydrophobicContact CD-CZ2 4.1Å; K323-W381 HydrophobicContact CD-CZ3 3.45Å; K323-W381 VanDerWaalsContact CD-CZ3 3.45Å; K323-W381 HydrophobicContact CG-CE3 4.23Å; K323-W381 PolarHBondContact N-O 3.17Å; K323-W381 VanDerWaalsContact N-O 3.09Å; K323-W381 PolarHBondContact O-N 3.41Å
324	K	93.9	Very high	87.7	Confident	33 Å²	33	41.1 Å²	41.1	14%	0.143	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	134.1	164.5	-74.3	-179	179.6	-163.4	0	109.1	I294 R295 Y303 L326 E364 T378 G379 T380	I294-K324 WeakPolarHBondContact CA-O 3.5Å; R295-K324 PolarHBondContact N-O 3.03Å; R295-K324 PolarHBondContact O-N 3.01Å; Y303-K324 HydrophobicContact CD1-CB 4.08Å; Y303-K324 HydrophobicContact CD1-CD 3.8Å; Y303-K324 HydrophobicContact CD1-CG 3.68Å; Y303-K324 HydrophobicContact CD2-CD 3.99Å; Y303-K324 HydrophobicContact CE1-CB 4.42Å; Y303-K324 HydrophobicContact CE1-CD 4.02Å; Y303-K324 HydrophobicContact CE1-CG 3.67Å; Y303-K324 HydrophobicContact CE2-CD 4.22Å; Y303-K324 HydrophobicContact CG-CD 3.77Å; Y303-K324 HydrophobicContact CG-CG 4.2Å; K324-L326 HydrophobicContact CB-CD1 3.83Å; K324-E364 WeakPolarHBondContact CD-OE2 3.4Å; K324-E364 WeakPolarHBondContact CE-OE2 3.25Å; K324-E364 IonicContact NZ-OE1 2.76Å; K324-E364 PolarHBondContact NZ-OE1 3.04Å; K324-E364 IonicContact NZ-OE2 2.65Å; K324-E364 PolarHBondContact NZ-OE2 2.78Å; K324-T378 HydrophobicContact CD-CG2 4.47Å; K324-G379 WeakPolarHBondContact CA-O 3.36Å; K324-T380 HydrophobicContact CG-CG2 4.1Å
325	V	94.4	Very high	86.8	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.6	172.6	-178	0	0	0	0	106.8	L292 V327 M345 L361 T378 G379 W381 V405	L292-V325 HydrophobicContact CD1-CG1 3.8Å; V325-V327 HydrophobicContact CG1-CG2 4.36Å; V325-M345 HydrophobicContact CB-CE 4.03Å; V325-M345 HydrophobicContact CB-SD 4.2Å; V325-M345 HydrophobicContact CG1-CE 4.33Å; V325-M345 HydrophobicContact CG1-SD 3.83Å; V325-L361 HydrophobicContact CB-CD1 3.99Å; V325-L361 HydrophobicContact CG2-CD1 3.75Å; V325-T378 WeakPolarHBondContact O-CA 3.3Å; V325-G379 PolarHBondContact N-O 3.06Å; V325-G379 PolarHBondContact O-N 2.92Å; V325-G379 VanDerWaalsContact O-N 3.07Å; V325-W381 HydrophobicContact CG2-CB 4.3Å; V325-W381 HydrophobicContact CG2-CE3 4.18Å; V325-V405 HydrophobicContact CG1-CG1 4.01Å; V325-V405 HydrophobicContact CG1-CG2 4.37Å
326	L	94.3	Very high	85.8	Confident	21 Å²	21	49.7 Å²	49.7	11%	0.11	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	122.5	177.4	-71.7	74.5	0	0	0	107.6	E293 R295 K324 I377 T378	E293-L326 HydrophobicContact CB-CB 4.25Å; E293-L326 PolarHBondContact N-O 3.18Å; E293-L326 PolarHBondContact O-N 2.7Å; R295-L326 HydrophobicContact CG-CD1 4.16Å; K324-L326 HydrophobicContact CB-CD1 3.83Å; L326-I377 WeakPolarHBondContact CA-O 3.24Å; L326-T378 HydrophobicContact CD1-CG2 4.05Å; L326-T378 HydrophobicContact CG-CG2 3.96Å
327	V	95	Very high	85.5	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124	172.7	-179	0	0	0	0	108.6	V290 S291 L292 V325 V329 M345 I377 V405 V407 L422	V290-V327 HydrophobicContact CG1-CG1 3.52Å; S291-V327 CarbonylContact O-C 3.6Å; S291-V327 VanDerWaalsContact O-CA 3.3Å; S291-V327 WeakPolarHBondContact O-CA 3.49Å; L292-V327 HydrophobicContact CD1-CG2 3.85Å; V325-V327 HydrophobicContact CG1-CG2 4.36Å; V327-V329 HydrophobicContact CG1-CG2 4.26Å; V327-M345 HydrophobicContact CG2-SD 4.08Å; V327-I377 PolarHBondContact N-O 3.08Å; V327-I377 PolarHBondContact O-N 3.24Å; V327-V405 HydrophobicContact CG2-CG1 3.99Å; V327-V407 HydrophobicContact CB-CG2 3.82Å; V327-V407 HydrophobicContact CG1-CG2 3.84Å; V327-V407 HydrophobicContact CG2-CG2 3.72Å; V327-L422 HydrophobicContact CG1-CD1 3.9Å; V327-L422 HydrophobicContact CG2-CD1 4.12Å
328	S	93.6	Very high	84.9	Confident	27 Å²	27	49.3 Å²	49.3	19%	0.189	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	118.5	176.9	-173.4	0	0	0	0	110.5	V290 S291 A374 Y375	V290-S328 CarbonylContact C-O 3.07Å; V290-S328 WeakPolarHBondContact CA-O 3.23Å; S291-S328 PolarHBondContact N-O 3.05Å; S291-S328 PolarHBondContact O-N 2.85Å; S291-S328 PolarHBondContact OG-O 3.02Å; S328-A374 WeakPolarHBondContact OG-CB 3.11Å; S328-Y375 CarbonylContact C-O 3.59Å; S328-Y375 VanDerWaalsContact CA-O 3.24Å; S328-Y375 WeakPolarHBondContact CA-O 3.42Å
329	V	93.3	Very high	84.7	Confident	1 Å²	1	47 Å²	47	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	112.4	-177.7	176.4	0	0	0	0	108.9	F288 V290 V327 I339 A374 Y375 I377 L409 F420	F288-V329 HydrophobicContact CD1-CG1 3.91Å; V290-V329 HydrophobicContact CB-CG2 4.47Å; V290-V329 HydrophobicContact CG1-CG2 3.85Å; V290-V329 HydrophobicContact CG2-CB 4.44Å; V290-V329 HydrophobicContact CG2-CG1 4.22Å; V290-V329 HydrophobicContact CG2-CG2 3.99Å; V327-V329 HydrophobicContact CG1-CG2 4.26Å; V329-I339 HydrophobicContact CG1-CD1 3.97Å; V329-A374 CarbonylContact O-C 3.52Å; V329-A374 VanDerWaalsContact O-CA 3.3Å; V329-A374 WeakPolarHBondContact O-CA 3.23Å; V329-Y375 PolarHBondContact N-O 2.83Å; V329-Y375 PolarHBondContact O-N 2.87Å; V329-I377 HydrophobicContact CG2-CD1 4.16Å; V329-L409 HydrophobicContact CB-CD1 4.31Å; V329-L409 HydrophobicContact CG1-CD1 4.11Å; V329-L409 HydrophobicContact CG2-CD1 3.95Å; V329-F420 HydrophobicContact CG1-CE2 4.5Å
330	Q	91.4	Very high	84.2	Confident	66 Å²	66	49.3 Å²	49.3	31%	0.308	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128.3	178.1	-178.2	174.2	-18.6	0	0	109.9	F288 T289 M332 A374	F288-Q330 CarbonylContact C-O 3.56Å; F288-Q330 VanDerWaalsContact CA-O 3.24Å; F288-Q330 WeakPolarHBondContact CA-O 3.36Å; T289-Q330 PolarHBondContact N-O 3.23Å; T289-Q330 PolarHBondContact O-N 3.04Å; Q330-M332 HydrophobicContact CG-SD 3.96Å; Q330-A374 HydrophobicContact CB-CB 3.82Å; Q330-A374 HydrophobicContact CG-CB 4.33Å
331	Q	88.4	Confident	84	Confident	38 Å²	38	52.6 Å²	52.6	18%	0.178	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	143.6	171.6	-165	177.1	-7.6	0	0	110.6	F288 C333 K335	F288-Q331 HydrophobicContact CD1-CB 3.85Å; F288-Q331 HydrophobicContact CD1-CG 4Å; F288-Q331 HydrophobicContact CE1-CB 3.74Å; F288-Q331 HydrophobicContact CE1-CG 3.68Å; F288-Q331 HydrophobicContact CZ-CG 4.01Å; Q331-C333 PolarHBondContact NE2-SG 3.45Å; Q331-K335 PolarHBondContact NE2-O 3.05Å
332	M	80.4	Confident	84	Confident	103 Å²	103	52.4 Å²	52.4	51%	0.507	26%	0.261	S	S	.	.			trans	-119.1	-6	-170.3	-61	-62.2	-70.5	0	0	114.4	T287 Q330	T287-M332 HydrophobicContact CG2-CB 4.25Å; T287-M332 PolarHBondContact O-N 2.98Å; Q330-M332 HydrophobicContact CG-SD 3.96Å
333	C	72.1	Confident	83.5	Confident	37 Å²	37	55.1 Å²	55.1	25%	0.25	27%	0.272	C	S	.	.	S	Bend	trans	-108	159.1	178.6	64.9	0	0	0	0	113	Q331 K335	Q331-C333 PolarHBondContact NE2-SG 3.45Å; C333-K335 VanDerWaalsContact C-N 3.26Å; C333-K335 PolarHBondContact O-N 3.24Å
334	N	54.7	Low	83.1	Confident	177 Å²	177	55.4 Å²	55.4	95%	0.947	28%	0.275	S	S	*	.	S	Bend	trans	-72.5	-6.8	-168.7	-63.7	-1.9	0	0	0	115.6
335	K	65.6	Low	83.1	Confident	91 Å²	91	53.9 Å²	53.9	40%	0.396	27%	0.268	S	S	.	.	S	Bend	trans	-107.9	89.4	179.1	-175.1	-177.4	173.2	-165.4	0	109	Y286 Q331 C333 L337 Y469	Y286-K335 HydrophobicContact CE1-CB 4.18Å; Y286-K335 HydrophobicContact CE1-CD 3.8Å; Y286-K335 HydrophobicContact CE1-CG 4.05Å; Y286-K335 WeakPolarHBondContact OH-CE 3.24Å; Y286-K335 PolarHBondContact OH-NZ 2.86Å; Q331-K335 PolarHBondContact NE2-O 3.05Å; C333-K335 VanDerWaalsContact C-N 3.26Å; C333-K335 PolarHBondContact O-N 3.24Å; K335-L337 PolarHBondContact O-N 2.96Å; K335-Y469 PolarHBondContact NZ-OH 3.29Å
336	E	67.9	Low	83	Confident	124 Å²	124	54.7 Å²	54.7	58%	0.579	27%	0.272	S	S	*	.			trans	-58.3	125	-177.4	-173.3	176	-169.6	0	0	111.3	K368	E336-K368 IonicContact OE1-NZ 3.68Å; E336-K368 PolarHBondContact OE1-NZ 3.19Å
337	L	81.6	Confident	83	Confident	8 Å²	8	53.7 Å²	53.7	4%	0.042	27%	0.267	C	S	.	.			trans	-95.5	114.6	169	-75.9	176.2	0	0	0	107.7	Y286 F288 K335 I339 V411 L449 L451	Y286-L337 HydrophobicContact CD1-CD1 3.36Å; Y286-L337 HydrophobicContact CD1-CD2 4.29Å; Y286-L337 HydrophobicContact CD1-CG 3.56Å; Y286-L337 HydrophobicContact CD2-CD1 4.01Å; Y286-L337 HydrophobicContact CE1-CD1 3.71Å; Y286-L337 HydrophobicContact CE1-CD2 3.81Å; Y286-L337 HydrophobicContact CE1-CG 3.59Å; Y286-L337 HydrophobicContact CE2-CD1 4.36Å; Y286-L337 HydrophobicContact CG-CD1 3.51Å; Y286-L337 HydrophobicContact CG-CG 4.25Å; F288-L337 HydrophobicContact CE2-CD1 4.3Å; F288-L337 HydrophobicContact CZ-CB 4.32Å; F288-L337 HydrophobicContact CZ-CD1 3.99Å; K335-L337 PolarHBondContact O-N 2.96Å; L337-I339 PolarHBondContact O-N 3.23Å; L337-V411 HydrophobicContact CB-CG1 3.71Å; L337-V411 HydrophobicContact CD1-CG1 4.36Å; L337-V411 HydrophobicContact CD2-CG1 4.36Å; L337-V411 HydrophobicContact CG-CG1 4.37Å; L337-L449 HydrophobicContact CD1-CD2 3.96Å; L337-L451 HydrophobicContact CD1-CD1 3.84Å; L337-L451 HydrophobicContact CD2-CD1 4.14Å
338	G	78.3	Confident	83	Confident	23 Å²	23	53.9 Å²	53.9	24%	0.237	27%	0.268	C	S	.	.			trans	-65.6	115.8	-178.2	0	0	0	0	0	111.1	V411 T412	G338-V411 CarbonylContact O-C 3.5Å; G338-V411 WeakPolarHBondContact O-CA 3.39Å; G338-T412 PolarHBondContact O-N 2.87Å; G338-T412 PolarHBondContact O-OG1 2.91Å
339	I	85.8	Confident	82.9	Confident	10 Å²	10	54.1 Å²	54.1	5%	0.051	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	117.6	169.1	-61.2	158.4	0	0	0	107.5	V329 L337 M366 Y375 L409 V411	V329-I339 HydrophobicContact CG1-CD1 3.97Å; L337-I339 PolarHBondContact O-N 3.23Å; I339-M366 HydrophobicContact CG2-CE 3.42Å; I339-M366 VanDerWaalsContact CG2-CE 3.42Å; I339-Y375 HydrophobicContact CB-CD1 4.21Å; I339-Y375 HydrophobicContact CB-CD2 4.17Å; I339-Y375 HydrophobicContact CB-CE1 3.87Å; I339-Y375 HydrophobicContact CB-CE2 3.85Å; I339-Y375 HydrophobicContact CB-CG 4.32Å; I339-Y375 HydrophobicContact CD1-CD2 3.63Å; I339-Y375 HydrophobicContact CD1-CE2 3.92Å; I339-Y375 HydrophobicContact CD1-CG 4.1Å; I339-Y375 HydrophobicContact CG1-CD2 4.39Å; I339-Y375 HydrophobicContact CG1-CE2 4.24Å; I339-Y375 HydrophobicContact CG2-CD1 4.34Å; I339-Y375 HydrophobicContact CG2-CE1 4.3Å; I339-Y375 PolarHBondContact N-OH 3.19Å; I339-Y375 WeakPolarHBondContact O-CE1 3.36Å; I339-Y375 VanDerWaalsContact O-CZ 3.3Å; I339-Y375 PolarHBondContact O-OH 2.97Å; I339-L409 HydrophobicContact CD1-CD1 3.88Å; I339-L409 HydrophobicContact CG1-CD1 4.3Å; I339-L409 HydrophobicContact CG2-CB 4.12Å; I339-L409 HydrophobicContact CG2-CD1 3.99Å; I339-L409 HydrophobicContact CG2-CD2 4.01Å; I339-L409 HydrophobicContact CG2-CG 4.28Å; I339-V411 HydrophobicContact CG1-CG2 4.38Å
340	E	81.6	Confident	82.5	Confident	115 Å²	115	55.4 Å²	55.4	54%	0.537	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-47.8	-174.9	-58.2	-165.5	165.8	0	0	112.1	V410 T412	E340-V410 PolarHBondContact N-O 2.96Å; E340-T412 WeakPolarHBondContact CG-OG1 3.46Å; E340-T412 WeakPolarHBondContact OE1-CB 3.22Å; E340-T412 PolarHBondContact OE1-OG1 3.18Å
341	R	81.8	Confident	82.3	Confident	124 Å²	124	56.5 Å²	56.5	47%	0.468	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	152.2	-174.5	58.4	-179.3	-178.1	82.2	-1.1	111.7	V410	R341-V410 HydrophobicContact CG-CB 3.91Å; R341-V410 HydrophobicContact CG-CG2 4.15Å; R341-V410 PolarHBondContact O-N 3.42Å
342	C	88.3	Confident	81.9	Confident	23 Å²	23	63 Å²	63	16%	0.155	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	125.9	162.8	-165.2	0	0	0	0	108.2	G344 M363 M366 I377 D408 L409	C342-G344 VanDerWaalsContact SG-C 3.55Å; C342-G344 PolarHBondContact SG-O 2.93Å; C342-M363 HydrophobicContact CB-CE 4.09Å; C342-M363 VanDerWaalsContact SG-CE 3.55Å; C342-M366 HydrophobicContact CB-CE 4.47Å; C342-M366 HydrophobicContact CB-SD 3.66Å; C342-M366 PolarHBondContact N-SD 3.36Å; C342-I377 HydrophobicContact CB-CG2 4.42Å; C342-D408 CarbonylContact C-O 3.56Å; C342-D408 WeakPolarHBondContact CA-O 3.44Å; C342-L409 HydrophobicContact CB-CD2 4.06Å
343	F	78.5	Confident	82.1	Confident	137 Å²	137	59.3 Å²	59.3	60%	0.601	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	-37.6	171.2	174.1	-111.9	0	0	0	111.1	D408 V410	F343-D408 HydrophobicContact CB-CB 3.94Å; F343-D408 HydrophobicContact CD1-CB 4.03Å; F343-D408 PolarHBondContact N-O 2.99Å; F343-V410 HydrophobicContact CB-CG2 4.39Å
344	G	84.4	Confident	82.4	Confident	6 Å²	6	61 Å²	61	6%	0.062	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	154.9	171.5	0	0	0	0	0	112.4	C342 D408	C342-G344 VanDerWaalsContact SG-C 3.55Å; C342-G344 PolarHBondContact SG-O 2.93Å; G344-D408 PolarHBondContact O-N 2.96Å
345	M	93	Very high	83.6	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	125.1	163	177	173.3	62.7	0	0	108.2	V325 V327 L361 M363 I377 G379 V405 A406 V407	V325-M345 HydrophobicContact CB-CE 4.03Å; V325-M345 HydrophobicContact CB-SD 4.2Å; V325-M345 HydrophobicContact CG1-CE 4.33Å; V325-M345 HydrophobicContact CG1-SD 3.83Å; V327-M345 HydrophobicContact CG2-SD 4.08Å; M345-L361 HydrophobicContact CE-CB 4.26Å; M345-L361 HydrophobicContact CE-CD1 3.9Å; M345-L361 HydrophobicContact CG-CD1 4.48Å; M345-L361 PolarHBondContact O-N 3.47Å; M345-M363 HydrophobicContact CB-CE 3.72Å; M345-I377 HydrophobicContact SD-CG2 4.44Å; M345-G379 VanDerWaalsContact CE-CA 3.41Å; M345-V405 HydrophobicContact CG-CG1 4.44Å; M345-A406 CarbonylContact C-O 3.54Å; M345-A406 WeakPolarHBondContact CA-O 3.26Å; M345-V407 HydrophobicContact CB-CG2 4.44Å; M345-V407 HydrophobicContact CG-CG2 4.02Å; M345-V407 HydrophobicContact SD-CG2 4.31Å
346	L	93.8	Very high	84.2	Confident	17 Å²	17	58.7 Å²	58.7	9%	0.089	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	147.2	-170.3	-58.7	152	0	0	0	110.1	M358 H359 L360 V405 A406 R419	L346-M358 HydrophobicContact CB-CB 4.13Å; L346-M358 HydrophobicContact CB-CE 3.66Å; L346-M358 HydrophobicContact CD1-CB 4.47Å; L346-M358 HydrophobicContact CD2-CB 4.41Å; L346-H359 CarbonylContact C-O 3.45Å; L346-H359 WeakPolarHBondContact CA-O 3.46Å; L346-L360 HydrophobicContact CD2-CB 4.13Å; L346-L360 HydrophobicContact CD2-CD1 4.03Å; L346-L360 HydrophobicContact CG-CD1 4.46Å; L346-V405 CarbonylContact O-C 3.54Å; L346-V405 WeakPolarHBondContact O-CA 2.89Å; L346-A406 HydrophobicContact CB-CB 4.33Å; L346-A406 HydrophobicContact CD1-CB 4.38Å; L346-A406 PolarHBondContact N-O 2.81Å; L346-A406 PolarHBondContact O-N 2.85Å; L346-R419 VanDerWaalsContact CD1-NH2 3.29Å
347	L	94.1	Very high	85	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	144.7	178.2	175.9	65.9	0	0	0	109.8	H359 L361 W381 F388 L391 M403 T404 V405	L347-H359 PolarHBondContact N-O 3.17Å; L347-H359 PolarHBondContact O-N 3.17Å; L347-L361 HydrophobicContact CB-CD1 3.89Å; L347-L361 HydrophobicContact CB-CD2 3.97Å; L347-L361 HydrophobicContact CB-CG 3.88Å; L347-L361 HydrophobicContact CD2-CD1 4.28Å; L347-L361 HydrophobicContact CD2-CD2 3.99Å; L347-W381 HydrophobicContact CD2-CB 4.33Å; L347-W381 HydrophobicContact CD2-CD2 3.55Å; L347-W381 HydrophobicContact CD2-CE3 3.87Å; L347-W381 HydrophobicContact CD2-CG 3.73Å; L347-W381 HydrophobicContact CD2-CZ2 4.43Å; L347-W381 HydrophobicContact CD2-CZ3 4.4Å; L347-F388 HydrophobicContact CB-CE1 3.81Å; L347-F388 HydrophobicContact CB-CZ 3.95Å; L347-F388 HydrophobicContact CD2-CD1 3.88Å; L347-F388 HydrophobicContact CD2-CD2 4.37Å; L347-F388 HydrophobicContact CD2-CE1 3.66Å; L347-F388 HydrophobicContact CD2-CE2 4.15Å; L347-F388 HydrophobicContact CD2-CG 4.25Å; L347-F388 HydrophobicContact CD2-CZ 3.81Å; L347-F388 HydrophobicContact CG-CD1 4.08Å; L347-F388 HydrophobicContact CG-CE1 3.62Å; L347-F388 HydrophobicContact CG-CZ 4.07Å; L347-L391 HydrophobicContact CD1-CD1 4.19Å; L347-L391 HydrophobicContact CD2-CD1 4.45Å; L347-L391 HydrophobicContact CG-CD1 4.33Å; L347-M403 HydrophobicContact CD1-CG 3.46Å; L347-M403 VanDerWaalsContact CD1-CG 3.46Å; L347-M403 HydrophobicContact CD1-SD 3.61Å; L347-T404 CarbonylContact C-O 3.51Å; L347-T404 WeakPolarHBondContact CA-O 3.47Å; L347-V405 HydrophobicContact CD1-CG2 3.8Å
348	S	94	Very high	85.4	Confident	5 Å²	5	56.9 Å²	56.9	4%	0.035	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	148.8	165.2	-157.3	0	0	0	0	113.2	D357 M358 T404	S348-D357 WeakPolarHBondContact CB-O 3.47Å; S348-D357 PolarHBondContact OG-O 2.97Å; S348-M358 WeakPolarHBondContact CB-SD 3.43Å; S348-T404 PolarHBondContact N-O 3.3Å; S348-T404 PolarHBondContact O-N 3.49Å
349	P	91.4	Very high	86	Confident	32 Å²	32	59.3 Å²	59.3	21%	0.208	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	138.9	160.8	25.3	-34.2	0	0	0	112.1	A387 P390 L391	P349-A387 WeakPolarHBondContact CD-O 3.43Å; P349-P390 HydrophobicContact CB-CB 3.9Å; P349-P390 HydrophobicContact CB-CG 4.19Å; P349-P390 HydrophobicContact CG-CB 4.33Å; P349-P390 HydrophobicContact CG-CG 4.08Å; P349-L391 HydrophobicContact CB-CD1 4.42Å; P349-L391 HydrophobicContact CB-CD2 4.27Å; P349-L391 HydrophobicContact CB-CG 3.98Å
350	G	85.6	Confident	86.2	Confident	27 Å²	27	64 Å²	64	28%	0.278	33%	0.333	S	S	.	.	S	Bend	trans	115.4	-171.7	175	0	0	0	0	0	113.7	Y402 M403 T404	G350-Y402 VanDerWaalsContact C-CB 3.44Å; G350-Y402 PolarHBondContact N-O 3.42Å; G350-Y402 CarbonylContact O-C 3.6Å; G350-Y402 VanDerWaalsContact O-C 3.26Å; G350-Y402 WeakPolarHBondContact O-CB 3.24Å; G350-M403 PolarHBondContact O-N 3.1Å; G350-T404 PolarHBondContact O-OG1 2.9Å
351	Q	86.3	Confident	86.6	Confident	90 Å²	90	58.7 Å²	58.7	42%	0.421	31%	0.309	S	S	.	.	S	Bend	trans	-135.2	147.2	175.1	-161.8	-168.8	4.1	0	0	107.9	V353 Y402 E423	Q351-V353 PolarHBondContact O-N 3.22Å; Q351-Y402 HydrophobicContact CB-CD1 4.03Å; Q351-Y402 HydrophobicContact CB-CG 3.97Å; Q351-Y402 HydrophobicContact CG-CD1 4.15Å; Q351-E423 HydrophobicContact CG-CB 4.33Å; Q351-E423 HydrophobicContact CG-CG 4.33Å; Q351-E423 VanDerWaalsContact CG-OE1 3.31Å; Q351-E423 WeakPolarHBondContact CG-OE1 3.39Å; Q351-E423 WeakPolarHBondContact CG-OE2 3.09Å; Q351-E423 PolarHBondContact NE2-OE2 3Å
352	K	81.2	Confident	86.9	Confident	174 Å²	174	57.6 Å²	57.6	76%	0.757	31%	0.312	S	S	*	.	S	Bend	trans	53.1	38.5	-175.2	-55.7	-174.6	-179.2	-176.1	0	112.3	E423	K352-E423 PolarHBondContact N-OE1 2.81Å
353	V	83.4	Confident	86.8	Confident	26 Å²	26	60.4 Å²	60.4	16%	0.158	32%	0.324	C	S	.	.			trans	-68.1	136.8	-174.3	-176.3	0	0	0	0	110.7	Q351 D357 M358	Q351-V353 PolarHBondContact O-N 3.22Å; V353-D357 HydrophobicContact CG1-CB 3.73Å; V353-M358 HydrophobicContact CB-SD 4.05Å; V353-M358 HydrophobicContact CG1-CG 4.31Å; V353-M358 HydrophobicContact CG1-SD 4.01Å
354	C	79.4	Confident	87.2	Confident	73 Å²	73	58.6 Å²	58.6	49%	0.493	32%	0.317	S	S	.	.			trans	-64.8	147.3	177.8	-68.1	0	0	0	0	111.7	S356 D357	C354-S356 WeakPolarHBondContact CB-OG 3.5Å; C354-S356 PolarHBondContact O-N 3.3Å; C354-S356 VanDerWaalsContact O-N 3.07Å; C354-D357 PolarHBondContact O-N 3.1Å
355	N	79.9	Confident	87.3	Confident	120 Å²	120	61.1 Å²	61.1	64%	0.642	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-57.9	-25.3	179.3	-73.6	-23.6	0	0	0	113.7	D357 R419	N355-D357 VanDerWaalsContact C-N 3.3Å; N355-R419 VanDerWaalsContact CG-NH1 3.33Å; N355-R419 PolarHBondContact OD1-NH1 2.89Å
356	S	78.7	Confident	87	Confident	99 Å²	99	64 Å²	64	69%	0.692	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-67	-27.3	173.8	48.2	0	0	0	0	114.1	C354	C354-S356 WeakPolarHBondContact CB-OG 3.5Å; C354-S356 PolarHBondContact O-N 3.3Å; C354-S356 VanDerWaalsContact O-N 3.07Å
357	D	84.1	Confident	86.6	Confident	77 Å²	77	64.8 Å²	64.8	41%	0.412	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-104.5	2.9	-168.3	-42.4	-20.3	0	0	0	110.9	S348 V353 C354 N355 H359	S348-D357 WeakPolarHBondContact CB-O 3.47Å; S348-D357 PolarHBondContact OG-O 2.97Å; V353-D357 HydrophobicContact CG1-CB 3.73Å; C354-D357 PolarHBondContact O-N 3.1Å; N355-D357 VanDerWaalsContact C-N 3.3Å; D357-H359 PolarHBondContact O-CE1 3.08Å; D357-H359 PolarHBondContact O-ND1 3.2Å
358	M	89.9	Confident	86.1	Confident	16 Å²	16	69.3 Å²	69.3	8%	0.079	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-88.4	118.3	177.6	-71.8	-63.8	-62.3	0	0	110.3	L346 S348 V353 T404 A406	L346-M358 HydrophobicContact CB-CB 4.13Å; L346-M358 HydrophobicContact CB-CE 3.66Å; L346-M358 HydrophobicContact CD1-CB 4.47Å; L346-M358 HydrophobicContact CD2-CB 4.41Å; S348-M358 WeakPolarHBondContact CB-SD 3.43Å; V353-M358 HydrophobicContact CB-SD 4.05Å; V353-M358 HydrophobicContact CG1-CG 4.31Å; V353-M358 HydrophobicContact CG1-SD 4.01Å; M358-T404 HydrophobicContact CE-CG2 3.9Å; M358-T404 HydrophobicContact SD-CG2 3.88Å; M358-A406 HydrophobicContact CE-CB 3.92Å
359	H	90	Very high	85.6	Confident	74 Å²	74	70.4 Å²	70.4	34%	0.343	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	130.3	-171.5	-68.3	69.9	0	0	0	111.4	L346 L347 D357 L361 A387 F388	L346-H359 CarbonylContact C-O 3.45Å; L346-H359 WeakPolarHBondContact CA-O 3.46Å; L347-H359 PolarHBondContact N-O 3.17Å; L347-H359 PolarHBondContact O-N 3.17Å; D357-H359 PolarHBondContact O-CE1 3.08Å; D357-H359 PolarHBondContact O-ND1 3.2Å; H359-L361 PolarHBondContact O-N 2.84Å; H359-A387 WeakPolarHBondContact CD2-CB 3.36Å; H359-A387 VanDerWaalsContact NE2-CB 3.29Å; H359-A387 WeakPolarHBondContact NE2-CB 3.45Å; H359-F388 HydrophobicContact CB-CE1 3.83Å; H359-F388 HydrophobicContact CB-CZ 3.74Å
360	L	90.4	Very high	84.9	Confident	109 Å²	109	75.3 Å²	75.3	57%	0.571	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	129.8	-178.7	-169.9	70.3	0	0	0	111.2	L346	L346-L360 HydrophobicContact CD2-CB 4.13Å; L346-L360 HydrophobicContact CD2-CD1 4.03Å; L346-L360 HydrophobicContact CG-CD1 4.46Å
361	L	90.3	Very high	84.2	Confident	4 Å²	4	78.2 Å²	78.2	2%	0.021	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-89	142.2	171	-64.9	-176.4	0	0	0	110.6	V325 M345 L347 H359 M363 W381 F388	V325-L361 HydrophobicContact CB-CD1 3.99Å; V325-L361 HydrophobicContact CG2-CD1 3.75Å; M345-L361 HydrophobicContact CE-CB 4.26Å; M345-L361 HydrophobicContact CE-CD1 3.9Å; M345-L361 HydrophobicContact CG-CD1 4.48Å; M345-L361 PolarHBondContact O-N 3.47Å; L347-L361 HydrophobicContact CB-CD1 3.89Å; L347-L361 HydrophobicContact CB-CD2 3.97Å; L347-L361 HydrophobicContact CB-CG 3.88Å; L347-L361 HydrophobicContact CD2-CD1 4.28Å; L347-L361 HydrophobicContact CD2-CD2 3.99Å; H359-L361 PolarHBondContact O-N 2.84Å; L361-M363 PolarHBondContact O-N 3.38Å; L361-M363 VanDerWaalsContact O-N 3.13Å; L361-W381 HydrophobicContact CD2-CB 4.13Å; L361-F388 HydrophobicContact CD2-CE2 3.75Å; L361-F388 HydrophobicContact CD2-CZ 3.71Å
362	D	87.6	Confident	83.7	Confident	101 Å²	101	75.6 Å²	75.6	54%	0.54	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	116.2	173.8	-61.3	-58.6	0	0	0	109.7	E364 G379 T380	D362-E364 PolarHBondContact O-N 3.07Å; D362-G379 CarbonylContact O-C 3.5Å; D362-G379 WeakPolarHBondContact O-CA 3.21Å; D362-T380 PolarHBondContact O-N 3.04Å
363	M	86.8	Confident	83.6	Confident	81 Å²	81	73.8 Å²	73.8	40%	0.399	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	120.7	-177.8	-172.5	61.5	62.1	0	0	110.4	C342 M345 L361 I377 T378	C342-M363 HydrophobicContact CB-CE 4.09Å; C342-M363 VanDerWaalsContact SG-CE 3.55Å; M345-M363 HydrophobicContact CB-CE 3.72Å; L361-M363 PolarHBondContact O-N 3.38Å; L361-M363 VanDerWaalsContact O-N 3.13Å; M363-I377 HydrophobicContact CE-CG2 3.66Å; M363-I377 HydrophobicContact SD-CG2 3.62Å; M363-T378 VanDerWaalsContact SD-O 3.4Å
364	E	86.8	Confident	83.7	Confident	99 Å²	99	72.8 Å²	72.8	46%	0.463	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-45.8	178.7	-180	176.6	-146.1	0	0	111.5	K324 D362 T378	K324-E364 WeakPolarHBondContact CD-OE2 3.4Å; K324-E364 WeakPolarHBondContact CE-OE2 3.25Å; K324-E364 IonicContact NZ-OE1 2.76Å; K324-E364 PolarHBondContact NZ-OE1 3.04Å; K324-E364 IonicContact NZ-OE2 2.65Å; K324-E364 PolarHBondContact NZ-OE2 2.78Å; D362-E364 PolarHBondContact O-N 3.07Å; E364-T378 WeakPolarHBondContact CA-O 3.43Å; E364-T378 HydrophobicContact CB-CG2 4.46Å; E364-T378 WeakPolarHBondContact CB-O 3.07Å; E364-T378 PolarHBondContact N-O 3.43Å; E364-T378 WeakPolarHBondContact OE2-CG2 3.25Å
365	S	87.6	Confident	84.3	Confident	60 Å²	60	71.1 Å²	71.1	42%	0.42	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	154.9	179.7	57.6	0	0	0	0	113.3	T378	S365-T378 PolarHBondContact N-O 3.06Å; S365-T378 PolarHBondContact O-N 2.82Å
366	M	86.6	Confident	84.9	Confident	59 Å²	59	68.2 Å²	68.2	29%	0.291	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	138.1	166.2	178.6	179.9	-170.3	0	0	109	I339 C342 Y375 I376 I377 L409	I339-M366 HydrophobicContact CG2-CE 3.42Å; I339-M366 VanDerWaalsContact CG2-CE 3.42Å; C342-M366 HydrophobicContact CB-CE 4.47Å; C342-M366 HydrophobicContact CB-SD 3.66Å; C342-M366 PolarHBondContact N-SD 3.36Å; M366-Y375 HydrophobicContact CE-CD1 3.76Å; M366-Y375 HydrophobicContact CE-CE1 4.35Å; M366-Y375 HydrophobicContact CE-CG 4.49Å; M366-I376 WeakPolarHBondContact CA-O 3.49Å; M366-I377 HydrophobicContact CE-CG1 4.34Å; M366-I377 HydrophobicContact CG-CG1 4.2Å; M366-I377 HydrophobicContact SD-CG1 4.45Å; M366-L409 HydrophobicContact CE-CD2 3.92Å
367	G	85.1	Confident	85.6	Confident	35 Å²	35	63.5 Å²	63.5	36%	0.361	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	167.9	173.4	0	0	0	0	0	112.6	Y375 I376	G367-Y375 CarbonylContact O-C 3.53Å; G367-Y375 WeakPolarHBondContact O-CA 3.46Å; G367-I376 PolarHBondContact N-O 3.14Å; G367-I376 VanDerWaalsContact N-O 3.1Å; G367-I376 PolarHBondContact O-N 2.86Å
368	K	83.4	Confident	86.1	Confident	94 Å²	94	60.4 Å²	60.4	41%	0.409	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	143.1	169.3	-75.6	-168.8	166.9	-161.2	0	110.5	E336 A374 Y375	E336-K368 IonicContact OE1-NZ 3.68Å; E336-K368 PolarHBondContact OE1-NZ 3.19Å; K368-A374 CarbonylContact C-O 3.46Å; K368-A374 WeakPolarHBondContact CA-O 3.43Å; K368-Y375 HydrophobicContact CD-CE2 4.33Å; K368-Y375 WeakPolarHBondContact CE-OH 3.47Å; K368-Y375 HydrophobicContact CG-CD1 4.15Å; K368-Y375 HydrophobicContact CG-CD2 4.24Å; K368-Y375 HydrophobicContact CG-CE1 4.02Å; K368-Y375 HydrophobicContact CG-CE2 4.08Å; K368-Y375 HydrophobicContact CG-CG 4.29Å
369	S	84.1	Confident	86.3	Confident	28 Å²	28	59.7 Å²	59.7	20%	0.196	33%	0.331	C	S	.	.			trans	-53.8	159.7	170.8	170.3	0	0	0	0	111.6	D371 G372 A374	S369-D371 WeakPolarHBondContact CB-OD1 3.44Å; S369-D371 PolarHBondContact O-N 3.17Å; S369-D371 VanDerWaalsContact O-N 3.14Å; S369-D371 PolarHBondContact OG-OD1 2.85Å; S369-G372 WeakPolarHBondContact O-CA 3.44Å; S369-G372 PolarHBondContact O-N 3.29Å; S369-A374 VanDerWaalsContact CB-O 3.3Å; S369-A374 WeakPolarHBondContact CB-O 3.17Å; S369-A374 PolarHBondContact N-O 3.35Å
370	S	74.8	Confident	86.4	Confident	135 Å²	135	57.5 Å²	57.5	94%	0.944	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.2	179.6	52.9	0	0	0	0	114.5
371	D	72.4	Confident	86.5	Confident	89 Å²	89	52.3 Å²	52.3	48%	0.476	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-3.5	171	74.2	-25.3	0	0	0	113.7	S369 K373	S369-D371 WeakPolarHBondContact CB-OD1 3.44Å; S369-D371 PolarHBondContact O-N 3.17Å; S369-D371 VanDerWaalsContact O-N 3.14Å; S369-D371 PolarHBondContact OG-OD1 2.85Å; D371-K373 VanDerWaalsContact C-N 3.26Å; D371-K373 PolarHBondContact O-N 2.91Å; D371-K373 PolarHBondContact OD1-N 2.99Å; D371-K373 WeakPolarHBondContact OD2-CD 3.4Å; D371-K373 WeakPolarHBondContact OD2-CG 3.3Å
372	G	76	Confident	86.3	Confident	34 Å²	34	55 Å²	55	35%	0.351	31%	0.31	S	S	.	.	S	Bend	trans	76.5	-4	179.6	0	0	0	0	0	116.2	S369	S369-G372 WeakPolarHBondContact O-CA 3.44Å; S369-G372 PolarHBondContact O-N 3.29Å
373	K	77.4	Confident	86	Confident	137 Å²	137	50.7 Å²	50.7	60%	0.596	29%	0.287	S	S	*	.	S	Bend	trans	-89.4	-27.7	-167.3	-60.8	-172.6	-177.1	-178.3	0	115	D371	D371-K373 VanDerWaalsContact C-N 3.26Å; D371-K373 PolarHBondContact O-N 2.91Å; D371-K373 PolarHBondContact OD1-N 2.99Å; D371-K373 WeakPolarHBondContact OD2-CD 3.4Å; D371-K373 WeakPolarHBondContact OD2-CG 3.3Å
374	A	87.3	Confident	85.9	Confident	4 Å²	4	53.6 Å²	53.6	3%	0.033	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	149.2	-179.5	0	0	0	0	0	110.9	S328 V329 Q330 K368 S369	S328-A374 WeakPolarHBondContact OG-CB 3.11Å; V329-A374 CarbonylContact O-C 3.52Å; V329-A374 VanDerWaalsContact O-CA 3.3Å; V329-A374 WeakPolarHBondContact O-CA 3.23Å; Q330-A374 HydrophobicContact CB-CB 3.82Å; Q330-A374 HydrophobicContact CG-CB 4.33Å; K368-A374 CarbonylContact C-O 3.46Å; K368-A374 WeakPolarHBondContact CA-O 3.43Å; S369-A374 VanDerWaalsContact CB-O 3.3Å; S369-A374 WeakPolarHBondContact CB-O 3.17Å; S369-A374 PolarHBondContact N-O 3.35Å
375	Y	91.1	Very high	85.8	Confident	38 Å²	38	51.9 Å²	51.9	15%	0.149	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	134.4	163.2	-74.5	-105.1	0	0	0	108.9	S328 V329 I339 M366 G367 K368	S328-Y375 CarbonylContact C-O 3.59Å; S328-Y375 VanDerWaalsContact CA-O 3.24Å; S328-Y375 WeakPolarHBondContact CA-O 3.42Å; V329-Y375 PolarHBondContact N-O 2.83Å; V329-Y375 PolarHBondContact O-N 2.87Å; I339-Y375 HydrophobicContact CB-CD1 4.21Å; I339-Y375 HydrophobicContact CB-CD2 4.17Å; I339-Y375 HydrophobicContact CB-CE1 3.87Å; I339-Y375 HydrophobicContact CB-CE2 3.85Å; I339-Y375 HydrophobicContact CB-CG 4.32Å; I339-Y375 HydrophobicContact CD1-CD2 3.63Å; I339-Y375 HydrophobicContact CD1-CE2 3.92Å; I339-Y375 HydrophobicContact CD1-CG 4.1Å; I339-Y375 HydrophobicContact CG1-CD2 4.39Å; I339-Y375 HydrophobicContact CG1-CE2 4.24Å; I339-Y375 HydrophobicContact CG2-CD1 4.34Å; I339-Y375 HydrophobicContact CG2-CE1 4.3Å; I339-Y375 PolarHBondContact N-OH 3.19Å; I339-Y375 WeakPolarHBondContact O-CE1 3.36Å; I339-Y375 VanDerWaalsContact O-CZ 3.3Å; I339-Y375 PolarHBondContact O-OH 2.97Å; M366-Y375 HydrophobicContact CE-CD1 3.76Å; M366-Y375 HydrophobicContact CE-CE1 4.35Å; M366-Y375 HydrophobicContact CE-CG 4.49Å; G367-Y375 CarbonylContact O-C 3.53Å; G367-Y375 WeakPolarHBondContact O-CA 3.46Å; K368-Y375 HydrophobicContact CD-CE2 4.33Å; K368-Y375 WeakPolarHBondContact CE-OH 3.47Å; K368-Y375 HydrophobicContact CG-CD1 4.15Å; K368-Y375 HydrophobicContact CG-CD2 4.24Å; K368-Y375 HydrophobicContact CG-CE1 4.02Å; K368-Y375 HydrophobicContact CG-CE2 4.08Å; K368-Y375 HydrophobicContact CG-CG 4.29Å
376	I	92.3	Very high	85.6	Confident	59 Å²	59	52.7 Å²	52.7	30%	0.303	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	120.5	174.8	-56.1	174.4	0	0	0	107.6	M366 G367	M366-I376 WeakPolarHBondContact CA-O 3.49Å; G367-I376 PolarHBondContact N-O 3.14Å; G367-I376 VanDerWaalsContact N-O 3.1Å; G367-I376 PolarHBondContact O-N 2.86Å
377	I	94.4	Very high	85.5	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.7	174.4	-58.1	84.4	0	0	0	107	L326 V327 V329 C342 M345 M363 M366 V407 L409	L326-I377 WeakPolarHBondContact CA-O 3.24Å; V327-I377 PolarHBondContact N-O 3.08Å; V327-I377 PolarHBondContact O-N 3.24Å; V329-I377 HydrophobicContact CG2-CD1 4.16Å; C342-I377 HydrophobicContact CB-CG2 4.42Å; M345-I377 HydrophobicContact SD-CG2 4.44Å; M363-I377 HydrophobicContact CE-CG2 3.66Å; M363-I377 HydrophobicContact SD-CG2 3.62Å; M366-I377 HydrophobicContact CE-CG1 4.34Å; M366-I377 HydrophobicContact CG-CG1 4.2Å; M366-I377 HydrophobicContact SD-CG1 4.45Å; I377-V407 HydrophobicContact CD1-CG1 4.37Å; I377-V407 HydrophobicContact CG1-CG1 4.14Å; I377-V407 HydrophobicContact CG2-CG1 4.4Å; I377-L409 HydrophobicContact CD1-CD2 4.32Å; I377-L409 HydrophobicContact CG1-CD2 4.35Å
378	T	94.6	Very high	85.7	Confident	13 Å²	13	49.5 Å²	49.5	8%	0.08	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	134	179.8	-53.2	0	0	0	0	110.8	K324 V325 L326 M363 E364 S365	K324-T378 HydrophobicContact CD-CG2 4.47Å; V325-T378 WeakPolarHBondContact O-CA 3.3Å; L326-T378 HydrophobicContact CD1-CG2 4.05Å; L326-T378 HydrophobicContact CG-CG2 3.96Å; M363-T378 VanDerWaalsContact SD-O 3.4Å; E364-T378 WeakPolarHBondContact CA-O 3.43Å; E364-T378 HydrophobicContact CB-CG2 4.46Å; E364-T378 WeakPolarHBondContact CB-O 3.07Å; E364-T378 PolarHBondContact N-O 3.43Å; E364-T378 WeakPolarHBondContact OE2-CG2 3.25Å; S365-T378 PolarHBondContact N-O 3.06Å; S365-T378 PolarHBondContact O-N 2.82Å
379	G	93.9	Very high	85.8	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	159	174.6	0	0	0	0	0	112.7	K324 V325 M345 D362	K324-G379 WeakPolarHBondContact CA-O 3.36Å; V325-G379 PolarHBondContact N-O 3.06Å; V325-G379 PolarHBondContact O-N 2.92Å; V325-G379 VanDerWaalsContact O-N 3.07Å; M345-G379 VanDerWaalsContact CE-CA 3.41Å; D362-G379 CarbonylContact O-C 3.5Å; D362-G379 WeakPolarHBondContact O-CA 3.21Å
380	T	91.8	Very high	86	Confident	28 Å²	28	51.6 Å²	51.6	17%	0.172	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	131.7	-173	53.2	0	0	0	0	112.3	K324 D362	K324-T380 HydrophobicContact CG-CG2 4.1Å; D362-T380 PolarHBondContact O-N 3.04Å
381	W	91.6	Very high	86.6	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	111.1	172.9	167.4	16.8	0	0	0	109.6	L317 K323 V325 L347 L361 F388 L391 M403	L317-W381 HydrophobicContact CD1-CH2 3.38Å; L317-W381 HydrophobicContact CD1-CZ3 3.69Å; K323-W381 HydrophobicContact CB-CB 4.01Å; K323-W381 HydrophobicContact CB-CD2 3.97Å; K323-W381 HydrophobicContact CB-CE3 3.75Å; K323-W381 HydrophobicContact CB-CG 4.14Å; K323-W381 HydrophobicContact CD-CD2 3.85Å; K323-W381 HydrophobicContact CD-CE3 3.47Å; K323-W381 VanDerWaalsContact CD-CE3 3.47Å; K323-W381 HydrophobicContact CD-CH2 3.78Å; K323-W381 HydrophobicContact CD-CZ2 4.1Å; K323-W381 HydrophobicContact CD-CZ3 3.45Å; K323-W381 VanDerWaalsContact CD-CZ3 3.45Å; K323-W381 HydrophobicContact CG-CE3 4.23Å; K323-W381 PolarHBondContact N-O 3.17Å; K323-W381 VanDerWaalsContact N-O 3.09Å; K323-W381 PolarHBondContact O-N 3.41Å; V325-W381 HydrophobicContact CG2-CB 4.3Å; V325-W381 HydrophobicContact CG2-CE3 4.18Å; L347-W381 HydrophobicContact CD2-CB 4.33Å; L347-W381 HydrophobicContact CD2-CD2 3.55Å; L347-W381 HydrophobicContact CD2-CE3 3.87Å; L347-W381 HydrophobicContact CD2-CG 3.73Å; L347-W381 HydrophobicContact CD2-CZ2 4.43Å; L347-W381 HydrophobicContact CD2-CZ3 4.4Å; L361-W381 HydrophobicContact CD2-CB 4.13Å; W381-F388 AromaticContact CD1-CD2 3.34Å; W381-F388 AromaticContact CD1-CE2 3.84Å; W381-F388 AromaticContact CD1-CG 3.96Å; W381-F388 HydrophobicContact CG-CD2 4.47Å; W381-F388 AromaticContact NE1-CD2 3.39Å; W381-F388 AromaticContact NE1-CG 3.53Å; W381-L391 HydrophobicContact CH2-CB 3.77Å; W381-L391 HydrophobicContact CH2-CD1 4.09Å; W381-L391 HydrophobicContact CH2-CG 4.5Å; W381-L391 HydrophobicContact CZ2-CB 3.5Å; W381-L391 VanDerWaalsContact CZ2-CB 3.5Å; W381-L391 HydrophobicContact CZ2-CD1 4.06Å; W381-L391 HydrophobicContact CZ2-CG 4.43Å; W381-M403 HydrophobicContact CH2-SD 4.25Å; W381-M403 HydrophobicContact CZ3-SD 3.93Å
382	N	86.3	Confident	87.4	Confident	61 Å²	61	42.3 Å²	42.3	33%	0.326	24%	0.24	S	C	.	.			trans	-83.9	119	176.1	-175.5	-9.9	0	0	0	110.8	N384 M385	N382-N384 PolarHBondContact O-N 3.48Å; N382-N384 WeakPolarHBondContact OD1-CB 3.36Å; N382-N384 PolarHBondContact OD1-N 3.49Å; N382-N384 PolarHBondContact OD1-ND2 2.94Å; N382-M385 PolarHBondContact O-N 3.36Å
383	P	82.9	Confident	88	Confident	10 Å²	10	45.6 Å²	45.6	7%	0.065	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-12.7	-178	30.9	-36.9	0	0	0	113.3	M385 N392	P383-M385 VanDerWaalsContact C-N 3.31Å; P383-N392 PolarHBondContact O-ND2 3.25Å
384	N	83.1	Confident	88.4	Confident	142 Å²	142	43.2 Å²	43.2	76%	0.759	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	-1.6	179.4	-55	-57.7	0	0	0	113.2	N382	N382-N384 PolarHBondContact O-N 3.48Å; N382-N384 WeakPolarHBondContact OD1-CB 3.36Å; N382-N384 PolarHBondContact OD1-N 3.49Å; N382-N384 PolarHBondContact OD1-ND2 2.94Å
385	M	85.8	Confident	88.4	Confident	63 Å²	63	43.2 Å²	43.2	31%	0.31	24%	0.24	S	C	.	.			trans	-80.3	119.7	177.5	-166.9	-176.8	-64.8	0	0	109.7	N382 P383 A387 F388	N382-M385 PolarHBondContact O-N 3.36Å; P383-M385 VanDerWaalsContact C-N 3.31Å; M385-A387 HydrophobicContact CG-CB 4.45Å; M385-A387 PolarHBondContact O-N 3.35Å; M385-A387 VanDerWaalsContact O-N 3.13Å; M385-F388 HydrophobicContact CB-CD2 3.84Å; M385-F388 HydrophobicContact CB-CE2 4.23Å; M385-F388 HydrophobicContact CE-CE2 4.14Å; M385-F388 HydrophobicContact CG-CD2 4.31Å; M385-F388 HydrophobicContact CG-CE2 4.34Å; M385-F388 PolarHBondContact O-N 3.19Å; M385-F388 HydrophobicContact SD-CD2 3.99Å; M385-F388 HydrophobicContact SD-CE2 3.43Å; M385-F388 WeakPolarHBondContact SD-CE2 3.3Å; M385-F388 HydrophobicContact SD-CZ 3.93Å
386	A	82.8	Confident	88	Confident	77 Å²	77	44.8 Å²	44.8	64%	0.636	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-55.6	-34.6	-172.4	0	0	0	0	0	113.9	F388 Q389	A386-F388 PolarHBondContact O-N 2.95Å; A386-F388 VanDerWaalsContact O-N 3.14Å; A386-Q389 WeakPolarHBondContact O-CB 3.42Å; A386-Q389 PolarHBondContact O-N 2.94Å
387	A	84.4	Confident	87	Confident	27 Å²	27	50.5 Å²	50.5	22%	0.223	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-55.1	-28.9	174.4	0	0	0	0	0	114.2	P349 H359 M385	P349-A387 WeakPolarHBondContact CD-O 3.43Å; H359-A387 WeakPolarHBondContact CD2-CB 3.36Å; H359-A387 VanDerWaalsContact NE2-CB 3.29Å; H359-A387 WeakPolarHBondContact NE2-CB 3.45Å; M385-A387 HydrophobicContact CG-CB 4.45Å; M385-A387 PolarHBondContact O-N 3.35Å; M385-A387 VanDerWaalsContact O-N 3.13Å
388	F	89.6	Confident	86.1	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-98.2	8.3	-179.7	-53	-40.4	0	0	0	113.4	L347 H359 L361 W381 M385 A386 L391 N392	L347-F388 HydrophobicContact CB-CE1 3.81Å; L347-F388 HydrophobicContact CB-CZ 3.95Å; L347-F388 HydrophobicContact CD2-CD1 3.88Å; L347-F388 HydrophobicContact CD2-CD2 4.37Å; L347-F388 HydrophobicContact CD2-CE1 3.66Å; L347-F388 HydrophobicContact CD2-CE2 4.15Å; L347-F388 HydrophobicContact CD2-CG 4.25Å; L347-F388 HydrophobicContact CD2-CZ 3.81Å; L347-F388 HydrophobicContact CG-CD1 4.08Å; L347-F388 HydrophobicContact CG-CE1 3.62Å; L347-F388 HydrophobicContact CG-CZ 4.07Å; H359-F388 HydrophobicContact CB-CE1 3.83Å; H359-F388 HydrophobicContact CB-CZ 3.74Å; L361-F388 HydrophobicContact CD2-CE2 3.75Å; L361-F388 HydrophobicContact CD2-CZ 3.71Å; W381-F388 AromaticContact CD1-CD2 3.34Å; W381-F388 AromaticContact CD1-CE2 3.84Å; W381-F388 AromaticContact CD1-CG 3.96Å; W381-F388 HydrophobicContact CG-CD2 4.47Å; W381-F388 AromaticContact NE1-CD2 3.39Å; W381-F388 AromaticContact NE1-CG 3.53Å; M385-F388 HydrophobicContact CB-CD2 3.84Å; M385-F388 HydrophobicContact CB-CE2 4.23Å; M385-F388 HydrophobicContact CE-CE2 4.14Å; M385-F388 HydrophobicContact CG-CD2 4.31Å; M385-F388 HydrophobicContact CG-CE2 4.34Å; M385-F388 PolarHBondContact O-N 3.19Å; M385-F388 HydrophobicContact SD-CD2 3.99Å; M385-F388 HydrophobicContact SD-CE2 3.43Å; M385-F388 WeakPolarHBondContact SD-CE2 3.3Å; M385-F388 HydrophobicContact SD-CZ 3.93Å; A386-F388 PolarHBondContact O-N 2.95Å; A386-F388 VanDerWaalsContact O-N 3.14Å; F388-L391 CarbonylContact O-C 3.58Å; F388-L391 WeakPolarHBondContact O-CA 3.46Å; F388-L391 PolarHBondContact O-N 2.59Å; F388-N392 WeakPolarHBondContact O-CB 3.38Å; F388-N392 PolarHBondContact O-N 3.09Å
389	Q	85.9	Confident	85.4	Confident	103 Å²	103	63.7 Å²	63.7	48%	0.481	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-52.3	-43.8	175.7	-179.9	174	-10.1	0	0	112.9	A386 L391 N392 E393	A386-Q389 WeakPolarHBondContact O-CB 3.42Å; A386-Q389 PolarHBondContact O-N 2.94Å; Q389-L391 PolarHBondContact O-N 2.8Å; Q389-L391 VanDerWaalsContact O-N 3.16Å; Q389-N392 CarbonylContact O-C 3.56Å; Q389-N392 WeakPolarHBondContact O-CA 3.36Å; Q389-N392 PolarHBondContact O-N 3.14Å; Q389-E393 HydrophobicContact CG-CG 4Å; Q389-E393 WeakPolarHBondContact CG-OE1 3.44Å; Q389-E393 PolarHBondContact NE2-OE1 3.23Å; Q389-E393 WeakPolarHBondContact O-CG 3.41Å; Q389-E393 PolarHBondContact O-N 2.6Å
390	P	86.9	Confident	84.7	Confident	63 Å²	63	68.7 Å²	68.7	41%	0.409	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-67.3	-15.4	176.7	-19.5	33.3	0	0	0	114.8	P349	P349-P390 HydrophobicContact CB-CB 3.9Å; P349-P390 HydrophobicContact CB-CG 4.19Å; P349-P390 HydrophobicContact CG-CB 4.33Å; P349-P390 HydrophobicContact CG-CG 4.08Å
391	L	89.1	Confident	84.5	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-98.6	8.6	172.4	-60.4	176.3	0	0	0	112.4	L347 P349 W381 F388 Q389 V401 M403 V426 V428	L347-L391 HydrophobicContact CD1-CD1 4.19Å; L347-L391 HydrophobicContact CD2-CD1 4.45Å; L347-L391 HydrophobicContact CG-CD1 4.33Å; P349-L391 HydrophobicContact CB-CD1 4.42Å; P349-L391 HydrophobicContact CB-CD2 4.27Å; P349-L391 HydrophobicContact CB-CG 3.98Å; W381-L391 HydrophobicContact CH2-CB 3.77Å; W381-L391 HydrophobicContact CH2-CD1 4.09Å; W381-L391 HydrophobicContact CH2-CG 4.5Å; W381-L391 HydrophobicContact CZ2-CB 3.5Å; W381-L391 VanDerWaalsContact CZ2-CB 3.5Å; W381-L391 HydrophobicContact CZ2-CD1 4.06Å; W381-L391 HydrophobicContact CZ2-CG 4.43Å; F388-L391 CarbonylContact O-C 3.58Å; F388-L391 WeakPolarHBondContact O-CA 3.46Å; F388-L391 PolarHBondContact O-N 2.59Å; Q389-L391 PolarHBondContact O-N 2.8Å; Q389-L391 VanDerWaalsContact O-N 3.16Å; L391-V401 HydrophobicContact CD2-CG1 3.8Å; L391-M403 HydrophobicContact CD1-CB 4.44Å; L391-M403 HydrophobicContact CD1-CG 3.79Å; L391-M403 HydrophobicContact CD1-SD 4.27Å; L391-M403 HydrophobicContact CD2-CB 3.99Å; L391-M403 HydrophobicContact CD2-CG 4.22Å; L391-V426 HydrophobicContact CD2-CG1 4.46Å; L391-V428 WeakPolarHBondContact O-CG2 3.49Å
392	N	89.1	Confident	84.5	Confident	29 Å²	29	71.5 Å²	71.5	16%	0.155	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.8	-2	-174.1	-159.6	43.7	0	0	0	113.4	Q319 G320 P383 F388 Q389	Q319-N392 WeakPolarHBondContact CA-OD1 3.36Å; Q319-N392 WeakPolarHBondContact CB-O 3.41Å; G320-N392 PolarHBondContact N-OD1 3.42Å; P383-N392 PolarHBondContact O-ND2 3.25Å; F388-N392 WeakPolarHBondContact O-CB 3.38Å; F388-N392 PolarHBondContact O-N 3.09Å; Q389-N392 CarbonylContact O-C 3.56Å; Q389-N392 WeakPolarHBondContact O-CA 3.36Å; Q389-N392 PolarHBondContact O-N 3.14Å
393	E	87	Confident	84.8	Confident	104 Å²	104	68.6 Å²	68.6	49%	0.486	36%	0.36	S	S	.	.	S	Bend	trans	-99.4	141.6	171.8	-72	178.9	161.5	0	0	111.5	Q389 T395 V428	Q389-E393 HydrophobicContact CG-CG 4Å; Q389-E393 WeakPolarHBondContact CG-OE1 3.44Å; Q389-E393 PolarHBondContact NE2-OE1 3.23Å; Q389-E393 WeakPolarHBondContact O-CG 3.41Å; Q389-E393 PolarHBondContact O-N 2.6Å; E393-T395 PolarHBondContact O-N 3.32Å; E393-V428 WeakPolarHBondContact O-CB 3.28Å; E393-V428 WeakPolarHBondContact O-CG1 3.34Å
394	D	86.9	Confident	85.3	Confident	87 Å²	87	68.2 Å²	68.2	47%	0.465	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-52.8	126.5	179.7	-175.6	31.3	0	0	0	112.2	P396 P430	D394-P396 WeakPolarHBondContact O-CD 3.21Å; D394-P430 WeakPolarHBondContact OD1-CD 3.23Å
395	T	86.6	Confident	85.9	Confident	4 Å²	4	61.4 Å²	61.4	3%	0.025	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-86.4	119.3	-171.1	-59.2	0	0	0	0	110.5	E393 K399 V401 R427 V428	E393-T395 PolarHBondContact O-N 3.32Å; T395-K399 WeakPolarHBondContact CG2-O 3.38Å; T395-V401 HydrophobicContact CG2-CG2 3.81Å; T395-R427 HydrophobicContact CG2-CG 4.06Å; T395-R427 PolarHBondContact O-NH2 3.33Å; T395-V428 WeakPolarHBondContact CB-O 3.25Å; T395-V428 PolarHBondContact N-O 2.91Å; T395-V428 WeakPolarHBondContact OG1-CB 3.42Å; T395-V428 PolarHBondContact OG1-N 2.75Å
396	P	83.4	Confident	86.3	Confident	71 Å²	71	58.5 Å²	58.5	46%	0.461	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-53.2	154.9	178.3	-27.6	35.5	0	0	0	113.2	D394 D398 K399 R427	D394-P396 WeakPolarHBondContact O-CD 3.21Å; P396-D398 PolarHBondContact O-N 2.87Å; P396-K399 HydrophobicContact CB-CB 4.01Å; P396-K399 HydrophobicContact CG-CB 4.25Å; P396-K399 HydrophobicContact CG-CD 4.49Å; P396-K399 PolarHBondContact O-N 2.63Å; P396-R427 PolarHBondContact O-NH2 2.7Å
397	K	71.9	Confident	86.8	Confident	178 Å²	178	54.8 Å²	54.8	77%	0.774	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-37.7	-175.9	-76.1	-174.1	177	179.1	0	112.9	R427	K397-R427 VanDerWaalsContact CA-NH2 3.31Å; K397-R427 PolarHBondContact O-NH1 2.86Å
398	D	75.1	Confident	87.2	Confident	163 Å²	163	53.9 Å²	53.9	87%	0.872	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	4.5	-168.2	-35.4	-71.9	0	0	0	112.4	P396	P396-D398 PolarHBondContact O-N 2.87Å
399	K	78.4	Confident	87.2	Confident	127 Å²	127	53.9 Å²	53.9	55%	0.552	27%	0.267	S	S	*	.			trans	-106.2	130.5	177.6	-172	173.9	-177.8	-177.8	0	110.7	T395 P396	T395-K399 WeakPolarHBondContact CG2-O 3.38Å; P396-K399 HydrophobicContact CB-CB 4.01Å; P396-K399 HydrophobicContact CG-CB 4.25Å; P396-K399 HydrophobicContact CG-CD 4.49Å; P396-K399 PolarHBondContact O-N 2.63Å
400	Q	80.1	Confident	87.2	Confident	106 Å²	106	50.1 Å²	50.1	50%	0.495	25%	0.251	S	S	.	.			trans	-88.7	141.5	165.1	-65.4	-177.4	8.3	0	0	109.6	Y402 L425	Q400-Y402 HydrophobicContact CB-CE2 4.04Å; Q400-Y402 PolarHBondContact OE1-OH 2.97Å; Q400-L425 HydrophobicContact CB-CD2 3.87Å; Q400-L425 HydrophobicContact CG-CD2 4.26Å
401	V	87.8	Confident	87.2	Confident	18 Å²	18	47.3 Å²	47.3	11%	0.109	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	132.1	170.4	176.9	0	0	0	0	107.4	L391 T395 V426	L391-V401 HydrophobicContact CD2-CG1 3.8Å; T395-V401 HydrophobicContact CG2-CG2 3.81Å; V401-V426 PolarHBondContact O-N 2.86Å
402	Y	91.5	Very high	86.7	Confident	68 Å²	68	49.1 Å²	49.1	27%	0.267	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	154.9	176.5	-71.9	-99	0	0	0	109.8	G350 Q351 Q400 L425	G350-Y402 VanDerWaalsContact C-CB 3.44Å; G350-Y402 PolarHBondContact N-O 3.42Å; G350-Y402 CarbonylContact O-C 3.6Å; G350-Y402 VanDerWaalsContact O-C 3.26Å; G350-Y402 WeakPolarHBondContact O-CB 3.24Å; Q351-Y402 HydrophobicContact CB-CD1 4.03Å; Q351-Y402 HydrophobicContact CB-CG 3.97Å; Q351-Y402 HydrophobicContact CG-CD1 4.15Å; Q400-Y402 HydrophobicContact CB-CE2 4.04Å; Q400-Y402 PolarHBondContact OE1-OH 2.97Å; Y402-L425 HydrophobicContact CD1-CD2 3.96Å; Y402-L425 HydrophobicContact CD1-CG 4.23Å; Y402-L425 HydrophobicContact CD2-CD2 3.92Å; Y402-L425 HydrophobicContact CE1-CD2 3.62Å; Y402-L425 HydrophobicContact CE1-CG 3.78Å; Y402-L425 HydrophobicContact CE2-CD2 3.55Å; Y402-L425 HydrophobicContact CG-CD2 4.09Å
403	M	92.5	Very high	86.1	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	127.6	175.2	-176.4	-172	73.2	0	0	109	L292 I294 L347 G350 W381 L391 V405 T424 V426	L292-M403 HydrophobicContact CD2-CE 4.03Å; I294-M403 HydrophobicContact CD1-CE 3.56Å; I294-M403 HydrophobicContact CD1-SD 4.2Å; I294-M403 HydrophobicContact CG1-CE 4.48Å; L347-M403 HydrophobicContact CD1-CG 3.46Å; L347-M403 VanDerWaalsContact CD1-CG 3.46Å; L347-M403 HydrophobicContact CD1-SD 3.61Å; G350-M403 PolarHBondContact O-N 3.1Å; W381-M403 HydrophobicContact CH2-SD 4.25Å; W381-M403 HydrophobicContact CZ3-SD 3.93Å; L391-M403 HydrophobicContact CD1-CB 4.44Å; L391-M403 HydrophobicContact CD1-CG 3.79Å; L391-M403 HydrophobicContact CD1-SD 4.27Å; L391-M403 HydrophobicContact CD2-CB 3.99Å; L391-M403 HydrophobicContact CD2-CG 4.22Å; M403-V405 HydrophobicContact CE-CG2 3.82Å; M403-T424 HydrophobicContact CB-CG2 4.38Å; M403-T424 HydrophobicContact CE-CG2 3.63Å; M403-T424 PolarHBondContact N-O 2.87Å; M403-T424 PolarHBondContact O-N 3.37Å; M403-V426 HydrophobicContact CB-CB 4.41Å; M403-V426 HydrophobicContact CB-CG2 3.46Å; M403-V426 VanDerWaalsContact CB-CG2 3.46Å; M403-V426 HydrophobicContact CE-CG2 4.21Å; M403-V426 HydrophobicContact CG-CG2 4.32Å; M403-V426 HydrophobicContact SD-CG2 4.03Å
404	T	94	Very high	85.7	Confident	1 Å²	1	48 Å²	48	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.9	175.1	-63.9	0	0	0	0	109.4	L347 S348 G350 M358 L421 E423	L347-T404 CarbonylContact C-O 3.51Å; L347-T404 WeakPolarHBondContact CA-O 3.47Å; S348-T404 PolarHBondContact N-O 3.3Å; S348-T404 PolarHBondContact O-N 3.49Å; G350-T404 PolarHBondContact O-OG1 2.9Å; M358-T404 HydrophobicContact CE-CG2 3.9Å; M358-T404 HydrophobicContact SD-CG2 3.88Å; T404-L421 HydrophobicContact CG2-CD1 4.22Å; T404-L421 HydrophobicContact CG2-CD2 3.54Å; T404-L421 HydrophobicContact CG2-CG 3.86Å; T404-E423 HydrophobicContact CG2-CG 4.48Å
405	V	94.4	Very high	85.1	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	127.7	173.1	177.8	0	0	0	0	108.2	L292 V325 V327 M345 L346 L347 M403 L422	L292-V405 HydrophobicContact CD1-CB 4.38Å; L292-V405 HydrophobicContact CD1-CG1 4.22Å; L292-V405 HydrophobicContact CD1-CG2 4.21Å; L292-V405 HydrophobicContact CD2-CG2 4.28Å; V325-V405 HydrophobicContact CG1-CG1 4.01Å; V325-V405 HydrophobicContact CG1-CG2 4.37Å; V327-V405 HydrophobicContact CG2-CG1 3.99Å; M345-V405 HydrophobicContact CG-CG1 4.44Å; L346-V405 CarbonylContact O-C 3.54Å; L346-V405 WeakPolarHBondContact O-CA 2.89Å; L347-V405 HydrophobicContact CD1-CG2 3.8Å; M403-V405 HydrophobicContact CE-CG2 3.82Å; V405-L422 PolarHBondContact N-O 2.81Å; V405-L422 PolarHBondContact O-N 3Å
406	A	93.9	Very high	84.7	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.008	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	145.6	174.7	0	0	0	0	0	111.2	M345 L346 M358 R419 F420 L421	M345-A406 CarbonylContact C-O 3.54Å; M345-A406 WeakPolarHBondContact CA-O 3.26Å; L346-A406 HydrophobicContact CB-CB 4.33Å; L346-A406 HydrophobicContact CD1-CB 4.38Å; L346-A406 PolarHBondContact N-O 2.81Å; L346-A406 PolarHBondContact O-N 2.85Å; M358-A406 HydrophobicContact CE-CB 3.92Å; A406-R419 HydrophobicContact CB-CG 4.19Å; A406-F420 CarbonylContact C-O 3.43Å; A406-F420 VanDerWaalsContact CA-O 3.31Å; A406-F420 WeakPolarHBondContact CA-O 3.46Å; A406-L421 HydrophobicContact CB-CB 4.47Å; A406-L421 HydrophobicContact CB-CG 4.28Å
407	V	94.3	Very high	84.7	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	118.5	176.6	-175.9	0	0	0	0	108.9	V327 M345 I377 L409 R419 F420	V327-V407 HydrophobicContact CB-CG2 3.82Å; V327-V407 HydrophobicContact CG1-CG2 3.84Å; V327-V407 HydrophobicContact CG2-CG2 3.72Å; M345-V407 HydrophobicContact CB-CG2 4.44Å; M345-V407 HydrophobicContact CG-CG2 4.02Å; M345-V407 HydrophobicContact SD-CG2 4.31Å; I377-V407 HydrophobicContact CD1-CG1 4.37Å; I377-V407 HydrophobicContact CG1-CG1 4.14Å; I377-V407 HydrophobicContact CG2-CG1 4.4Å; V407-L409 HydrophobicContact CG1-CD2 3.72Å; V407-L409 HydrophobicContact CG1-CG 4.01Å; V407-R419 WeakPolarHBondContact O-CA 3.46Å; V407-F420 PolarHBondContact N-O 2.88Å; V407-F420 PolarHBondContact O-N 2.83Å
408	D	91.8	Very high	85.6	Confident	8 Å²	8	45.4 Å²	45.4	4%	0.043	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	111.6	179.6	-62.2	-23.3	0	0	0	109.2	C342 F343 G344 R419	C342-D408 CarbonylContact C-O 3.56Å; C342-D408 WeakPolarHBondContact CA-O 3.44Å; F343-D408 HydrophobicContact CB-CB 3.94Å; F343-D408 HydrophobicContact CD1-CB 4.03Å; F343-D408 PolarHBondContact N-O 2.99Å; G344-D408 PolarHBondContact O-N 2.96Å; D408-R419 VanDerWaalsContact CG-NH2 3.32Å; D408-R419 WeakPolarHBondContact OD1-CB 3.45Å; D408-R419 WeakPolarHBondContact OD1-CG 3.47Å; D408-R419 IonicContact OD1-CZ 2.67Å; D408-R419 IonicContact OD1-NE 2.72Å; D408-R419 PolarHBondContact OD1-NE 3.28Å; D408-R419 IonicContact OD1-NH2 3.99Å; D408-R419 PolarHBondContact OD1-NH2 3.45Å; D408-R419 VanDerWaalsContact OD1-NH2 3.13Å; D408-R419 IonicContact OD2-CZ 3.81Å; D408-R419 IonicContact OD2-NE 2.66Å; D408-R419 IonicContact OD2-NH2 2.55Å; D408-R419 PolarHBondContact OD2-NH2 2.72Å
409	L	91	Very high	86.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	125.9	-178.5	-65.7	-172.4	0	0	0	111.3	V329 I339 C342 M366 I377 V407 V411 P417 V418 F420	V329-L409 HydrophobicContact CB-CD1 4.31Å; V329-L409 HydrophobicContact CG1-CD1 4.11Å; V329-L409 HydrophobicContact CG2-CD1 3.95Å; I339-L409 HydrophobicContact CD1-CD1 3.88Å; I339-L409 HydrophobicContact CG1-CD1 4.3Å; I339-L409 HydrophobicContact CG2-CB 4.12Å; I339-L409 HydrophobicContact CG2-CD1 3.99Å; I339-L409 HydrophobicContact CG2-CD2 4.01Å; I339-L409 HydrophobicContact CG2-CG 4.28Å; C342-L409 HydrophobicContact CB-CD2 4.06Å; M366-L409 HydrophobicContact CE-CD2 3.92Å; I377-L409 HydrophobicContact CD1-CD2 4.32Å; I377-L409 HydrophobicContact CG1-CD2 4.35Å; V407-L409 HydrophobicContact CG1-CD2 3.72Å; V407-L409 HydrophobicContact CG1-CG 4.01Å; L409-V411 HydrophobicContact CB-CG2 4.49Å; L409-P417 CarbonylContact O-C 3.58Å; L409-P417 WeakPolarHBondContact O-CA 3.41Å; L409-V418 PolarHBondContact N-O 2.74Å; L409-V418 PolarHBondContact O-N 3Å; L409-F420 HydrophobicContact CD1-CD2 3.96Å; L409-F420 HydrophobicContact CD1-CE2 3.9Å; L409-F420 HydrophobicContact CG-CD2 4.31Å; L409-F420 HydrophobicContact CG-CE2 4.49Å
410	V	85.5	Confident	87.1	Confident	23 Å²	23	35.3 Å²	35.3	14%	0.139	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	121.8	167.3	178.9	0	0	0	0	108.1	E340 R341 F343 P417	E340-V410 PolarHBondContact N-O 2.96Å; R341-V410 HydrophobicContact CG-CB 3.91Å; R341-V410 HydrophobicContact CG-CG2 4.15Å; R341-V410 PolarHBondContact O-N 3.42Å; F343-V410 HydrophobicContact CB-CG2 4.39Å; V410-P417 HydrophobicContact CG2-CB 4.38Å; V410-P417 HydrophobicContact CG2-CG 4.39Å
411	V	86.6	Confident	87.7	Confident	4 Å²	4	31.9 Å²	31.9	2%	0.024	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.9	-175.9	-176.3	0	0	0	0	108.1	L337 G338 I339 L409 V414 V418	L337-V411 HydrophobicContact CB-CG1 3.71Å; L337-V411 HydrophobicContact CD1-CG1 4.36Å; L337-V411 HydrophobicContact CD2-CG1 4.36Å; L337-V411 HydrophobicContact CG-CG1 4.37Å; G338-V411 CarbonylContact O-C 3.5Å; G338-V411 WeakPolarHBondContact O-CA 3.39Å; I339-V411 HydrophobicContact CG1-CG2 4.38Å; L409-V411 HydrophobicContact CB-CG2 4.49Å; V411-V414 HydrophobicContact CB-CB 4.11Å; V411-V414 HydrophobicContact CB-CG2 3.84Å; V411-V414 HydrophobicContact CG1-CG2 3.73Å; V411-V414 WeakPolarHBondContact O-CB 3.42Å; V411-V414 PolarHBondContact O-N 2.79Å; V411-V414 VanDerWaalsContact O-N 3.11Å; V411-V418 HydrophobicContact CG2-CB 4.26Å; V411-V418 HydrophobicContact CG2-CG2 3.84Å
412	T	78.5	Confident	87.9	Confident	38 Å²	38	31 Å²	31	23%	0.233	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	141.3	177.1	-59.9	0	0	0	0	110.4	G338 E340 V414	G338-T412 PolarHBondContact O-N 2.87Å; G338-T412 PolarHBondContact O-OG1 2.91Å; E340-T412 WeakPolarHBondContact CG-OG1 3.46Å; E340-T412 WeakPolarHBondContact OE1-CB 3.22Å; E340-T412 PolarHBondContact OE1-OG1 3.18Å; T412-V414 PolarHBondContact O-N 2.84Å; T412-V414 VanDerWaalsContact O-N 3.11Å
413	E	75.9	Confident	87.9	Confident	93 Å²	93	29.4 Å²	29.4	44%	0.435	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	-7.1	-175.3	-67.3	158.4	-145.3	0	0	115.6	Y469	E413-Y469 HydrophobicContact CB-CD2 3.98Å; E413-Y469 HydrophobicContact CB-CE2 4.48Å; E413-Y469 PolarHBondContact O-N 2.8Å
414	V	79.4	Confident	87.8	Confident	16 Å²	16	29.7 Å²	29.7	10%	0.097	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-93.3	134.1	175.1	-172	0	0	0	0	111	V411 T412 E416 V418 L451 Y469 V471	V411-V414 HydrophobicContact CB-CB 4.11Å; V411-V414 HydrophobicContact CB-CG2 3.84Å; V411-V414 HydrophobicContact CG1-CG2 3.73Å; V411-V414 WeakPolarHBondContact O-CB 3.42Å; V411-V414 PolarHBondContact O-N 2.79Å; V411-V414 VanDerWaalsContact O-N 3.11Å; T412-V414 PolarHBondContact O-N 2.84Å; T412-V414 VanDerWaalsContact O-N 3.11Å; V414-E416 WeakPolarHBondContact CG1-O 3.35Å; V414-V418 HydrophobicContact CG1-CG2 4.44Å; V414-L451 HydrophobicContact CG1-CD2 4.25Å; V414-L451 HydrophobicContact CG2-CD1 3.8Å; V414-L451 HydrophobicContact CG2-CD2 4.29Å; V414-Y469 WeakPolarHBondContact CA-O 3.47Å; V414-V471 HydrophobicContact CG1-CG2 3.51Å
415	V	74.3	Confident	87.6	Confident	87 Å²	87	31.9 Å²	31.9	53%	0.527	17%	0.166	S	C	.	.	S	Bend	trans	-65.4	-43.1	-178.3	-179.8	0	0	0	0	112.3	L454 V468 Y469	V415-L454 HydrophobicContact CG2-CD1 4.16Å; V415-V468 HydrophobicContact CG2-CG1 3.31Å; V415-Y469 PolarHBondContact N-O 3.29Å
416	E	79	Confident	87.5	Confident	126 Å²	126	32 Å²	32	59%	0.589	17%	0.167	S	C	*	.	S	Bend	trans	-110.8	149.1	-171	-58.9	-157.9	141.2	0	0	113.1	V414 V418	V414-E416 WeakPolarHBondContact CG1-O 3.35Å; E416-V418 PolarHBondContact O-N 2.87Å
417	P	83.8	Confident	87.3	Confident	68 Å²	68	34.3 Å²	34.3	44%	0.442	18%	0.176	S	C	.	.			trans	-65.5	124.8	173.5	-18.1	31.6	0	0	0	112.1	L409 V410 R419	L409-P417 CarbonylContact O-C 3.58Å; L409-P417 WeakPolarHBondContact O-CA 3.41Å; V410-P417 HydrophobicContact CG2-CB 4.38Å; V410-P417 HydrophobicContact CG2-CG 4.39Å; P417-R419 PolarHBondContact O-N 2.85Å
418	V	89.2	Confident	87.1	Confident	5 Å²	5	34.3 Å²	34.3	3%	0.03	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	111.5	178.9	-175.6	0	0	0	0	109.7	L409 V411 V414 E416 F420 L449 V471 L474	L409-V418 PolarHBondContact N-O 2.74Å; L409-V418 PolarHBondContact O-N 3Å; V411-V418 HydrophobicContact CG2-CB 4.26Å; V411-V418 HydrophobicContact CG2-CG2 3.84Å; V414-V418 HydrophobicContact CG1-CG2 4.44Å; E416-V418 PolarHBondContact O-N 2.87Å; V418-F420 HydrophobicContact CB-CE2 4.14Å; V418-F420 HydrophobicContact CG1-CD2 4.15Å; V418-F420 HydrophobicContact CG1-CE1 4.41Å; V418-F420 HydrophobicContact CG1-CE2 3.55Å; V418-F420 HydrophobicContact CG1-CZ 3.72Å; V418-L449 HydrophobicContact CG1-CD1 4.04Å; V418-L449 HydrophobicContact CG1-CD2 4.46Å; V418-L449 HydrophobicContact CG2-CD1 4.25Å; V418-L449 HydrophobicContact CG2-CD2 4.23Å; V418-V471 HydrophobicContact CG2-CG2 4.27Å; V418-L474 HydrophobicContact CG1-CD1 4.38Å; V418-L474 HydrophobicContact CG1-CD2 3.87Å
419	R	92.5	Very high	87	Confident	77 Å²	77	35.6 Å²	35.6	29%	0.291	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	104.2	177.9	174.5	166.9	-72.4	-174.6	0.8	111.7	L346 N355 A406 V407 D408 P417 L474	L346-R419 VanDerWaalsContact CD1-NH2 3.29Å; N355-R419 VanDerWaalsContact CG-NH1 3.33Å; N355-R419 PolarHBondContact OD1-NH1 2.89Å; A406-R419 HydrophobicContact CB-CG 4.19Å; V407-R419 WeakPolarHBondContact O-CA 3.46Å; D408-R419 VanDerWaalsContact CG-NH2 3.32Å; D408-R419 WeakPolarHBondContact OD1-CB 3.45Å; D408-R419 WeakPolarHBondContact OD1-CG 3.47Å; D408-R419 IonicContact OD1-CZ 2.67Å; D408-R419 IonicContact OD1-NE 2.72Å; D408-R419 PolarHBondContact OD1-NE 3.28Å; D408-R419 IonicContact OD1-NH2 3.99Å; D408-R419 PolarHBondContact OD1-NH2 3.45Å; D408-R419 VanDerWaalsContact OD1-NH2 3.13Å; D408-R419 IonicContact OD2-CZ 3.81Å; D408-R419 IonicContact OD2-NE 2.66Å; D408-R419 IonicContact OD2-NH2 2.55Å; D408-R419 PolarHBondContact OD2-NH2 2.72Å; P417-R419 PolarHBondContact O-N 2.85Å; R419-L474 WeakPolarHBondContact O-CD2 3.38Å
420	F	93.8	Very high	86.8	Confident	1 Å²	1	37.5 Å²	37.5	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	122.4	169.1	-64.8	-85.4	0	0	0	109.8	F288 V290 V329 A406 V407 L409 V418 F447 L474	F288-F420 HydrophobicContact CB-CE1 3.94Å; F288-F420 HydrophobicContact CB-CZ 4.26Å; F288-F420 HydrophobicContact CD1-CZ 4.28Å; F288-F420 HydrophobicContact CD2-CE1 4.23Å; F288-F420 HydrophobicContact CD2-CZ 4.02Å; F288-F420 HydrophobicContact CE2-CZ 4.41Å; F288-F420 HydrophobicContact CG-CE1 4.1Å; F288-F420 AromaticContact CG-CZ 3.94Å; F288-F420 HydrophobicContact CG-CZ 3.94Å; V290-F420 HydrophobicContact CG2-CB 4.36Å; V290-F420 HydrophobicContact CG2-CD1 3.58Å; V290-F420 HydrophobicContact CG2-CE1 4.04Å; V290-F420 HydrophobicContact CG2-CG 4.03Å; V329-F420 HydrophobicContact CG1-CE2 4.5Å; A406-F420 CarbonylContact C-O 3.43Å; A406-F420 VanDerWaalsContact CA-O 3.31Å; A406-F420 WeakPolarHBondContact CA-O 3.46Å; V407-F420 PolarHBondContact N-O 2.88Å; V407-F420 PolarHBondContact O-N 2.83Å; L409-F420 HydrophobicContact CD1-CD2 3.96Å; L409-F420 HydrophobicContact CD1-CE2 3.9Å; L409-F420 HydrophobicContact CG-CD2 4.31Å; L409-F420 HydrophobicContact CG-CE2 4.49Å; V418-F420 HydrophobicContact CB-CE2 4.14Å; V418-F420 HydrophobicContact CG1-CD2 4.15Å; V418-F420 HydrophobicContact CG1-CE1 4.41Å; V418-F420 HydrophobicContact CG1-CE2 3.55Å; V418-F420 HydrophobicContact CG1-CZ 3.72Å; F420-F447 HydrophobicContact CD1-CB 4.11Å; F420-F447 AromaticContact CD1-CD1 3.85Å; F420-F447 HydrophobicContact CD1-CD1 3.85Å; F420-F447 HydrophobicContact CD1-CD2 4.06Å; F420-F447 HydrophobicContact CD1-CE1 4.24Å; F420-F447 HydrophobicContact CD1-CE2 4.45Å; F420-F447 AromaticContact CD1-CG 3.76Å; F420-F447 HydrophobicContact CD1-CG 3.76Å; F420-F447 HydrophobicContact CE1-CB 3.93Å; F420-F447 HydrophobicContact CE1-CD1 4.44Å; F420-F447 HydrophobicContact CE1-CG 4.11Å; F420-L474 HydrophobicContact CD1-CD1 4.45Å; F420-L474 HydrophobicContact CD1-CD2 4.3Å; F420-L474 HydrophobicContact CE1-CD1 3.97Å; F420-L474 HydrophobicContact CE1-CD2 4.47Å
421	L	92.4	Very high	86.6	Confident	34 Å²	34	39.8 Å²	39.8	18%	0.178	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	119.9	-174	-168.4	166.8	0	0	0	111	T404 A406 E423 F447 R476	T404-L421 HydrophobicContact CG2-CD1 4.22Å; T404-L421 HydrophobicContact CG2-CD2 3.54Å; T404-L421 HydrophobicContact CG2-CG 3.86Å; A406-L421 HydrophobicContact CB-CB 4.47Å; A406-L421 HydrophobicContact CB-CG 4.28Å; L421-E423 HydrophobicContact CD2-CG 3.48Å; L421-E423 VanDerWaalsContact CD2-CG 3.48Å; L421-F447 WeakPolarHBondContact O-CZ 3.44Å; L421-R476 PolarHBondContact O-NE 2.85Å
422	L	92.3	Very high	86.3	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	124.8	-175.9	-60.8	152.1	0	0	0	109.1	V290 L292 V327 V405 F443 E445 F447	V290-L422 HydrophobicContact CB-CD2 4.38Å; V290-L422 HydrophobicContact CG1-CD1 3.88Å; V290-L422 HydrophobicContact CG1-CD2 4.12Å; V290-L422 HydrophobicContact CG1-CG 4.34Å; L292-L422 HydrophobicContact CB-CD1 4.27Å; L292-L422 HydrophobicContact CD1-CD1 4.46Å; V327-L422 HydrophobicContact CG1-CD1 3.9Å; V327-L422 HydrophobicContact CG2-CD1 4.12Å; V405-L422 PolarHBondContact N-O 2.81Å; V405-L422 PolarHBondContact O-N 3Å; L422-F443 HydrophobicContact CB-CE1 4.49Å; L422-F443 HydrophobicContact CD2-CE1 4.16Å; L422-E445 HydrophobicContact CD2-CB 4.22Å; L422-E445 HydrophobicContact CD2-CG 4.37Å; L422-F447 HydrophobicContact CD2-CE2 4.17Å; L422-F447 HydrophobicContact CD2-CZ 4.34Å
423	E	91.3	Very high	86.4	Confident	33 Å²	33	47.9 Å²	47.9	15%	0.154	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	134.8	176.4	-56.3	-169.7	133.8	0	0	109.6	Q351 K352 T404 L421 F443 R476	Q351-E423 HydrophobicContact CG-CB 4.33Å; Q351-E423 HydrophobicContact CG-CG 4.33Å; Q351-E423 VanDerWaalsContact CG-OE1 3.31Å; Q351-E423 WeakPolarHBondContact CG-OE1 3.39Å; Q351-E423 WeakPolarHBondContact CG-OE2 3.09Å; Q351-E423 PolarHBondContact NE2-OE2 3Å; K352-E423 PolarHBondContact N-OE1 2.81Å; T404-E423 HydrophobicContact CG2-CG 4.48Å; L421-E423 HydrophobicContact CD2-CG 3.48Å; L421-E423 VanDerWaalsContact CD2-CG 3.48Å; E423-F443 VanDerWaalsContact O-CZ 3.25Å; E423-F443 WeakPolarHBondContact O-CZ 3.4Å; E423-R476 IonicContact OE2-NH1 2.62Å
424	T	90.1	Very high	86.3	Confident	7 Å²	7	52.1 Å²	52.1	4%	0.043	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	150.4	-177.7	-160.3	0	0	0	0	112.2	L292 F315 M403 V426	L292-T424 HydrophobicContact CD2-CG2 4.08Å; F315-T424 HydrophobicContact CD2-CG2 3.69Å; F315-T424 HydrophobicContact CE2-CG2 3.65Å; F315-T424 WeakPolarHBondContact CE2-OG1 3.48Å; M403-T424 HydrophobicContact CB-CG2 4.38Å; M403-T424 HydrophobicContact CE-CG2 3.63Å; M403-T424 PolarHBondContact N-O 2.87Å; M403-T424 PolarHBondContact O-N 3.37Å; T424-V426 HydrophobicContact CG2-CG2 4.22Å
425	L	90.3	Very high	86.1	Confident	47 Å²	47	53 Å²	53	25%	0.246	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	140.8	170.7	-83.2	169.9	0	0	0	110.5	Y314 F315 Q400 Y402	Y314-L425 CarbonylContact C-O 3.44Å; Y314-L425 WeakPolarHBondContact CA-O 3.26Å; Y314-L425 WeakPolarHBondContact CB-O 3.47Å; F315-L425 PolarHBondContact N-O 3.49Å; Q400-L425 HydrophobicContact CB-CD2 3.87Å; Q400-L425 HydrophobicContact CG-CD2 4.26Å; Y402-L425 HydrophobicContact CD1-CD2 3.96Å; Y402-L425 HydrophobicContact CD1-CG 4.23Å; Y402-L425 HydrophobicContact CD2-CD2 3.92Å; Y402-L425 HydrophobicContact CE1-CD2 3.62Å; Y402-L425 HydrophobicContact CE1-CG 3.78Å; Y402-L425 HydrophobicContact CE2-CD2 3.55Å; Y402-L425 HydrophobicContact CG-CD2 4.09Å
426	V	90.9	Very high	84.8	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.018	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	145.3	178.5	172.6	0	0	0	0	109	F315 L317 L391 V401 M403 T424 V428	F315-V426 HydrophobicContact CB-CG2 4.42Å; L317-V426 HydrophobicContact CD1-CG1 3.5Å; L317-V426 HydrophobicContact CG-CG1 3.95Å; L391-V426 HydrophobicContact CD2-CG1 4.46Å; V401-V426 PolarHBondContact O-N 2.86Å; M403-V426 HydrophobicContact CB-CB 4.41Å; M403-V426 HydrophobicContact CB-CG2 3.46Å; M403-V426 VanDerWaalsContact CB-CG2 3.46Å; M403-V426 HydrophobicContact CE-CG2 4.21Å; M403-V426 HydrophobicContact CG-CG2 4.32Å; M403-V426 HydrophobicContact SD-CG2 4.03Å; T424-V426 HydrophobicContact CG2-CG2 4.22Å; V426-V428 HydrophobicContact CG1-CG2 4.36Å
427	R	89.4	Confident	83.4	Confident	50 Å²	50	63 Å²	63	19%	0.189	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	118	167.3	-169.3	176.2	177.5	102.7	29.5	108.9	Y314 F315 K316 L317 T395 P396 K397 Y429	Y314-R427 HydrophobicContact CD2-CB 3.41Å; Y314-R427 VanDerWaalsContact CD2-CB 3.41Å; Y314-R427 HydrophobicContact CE2-CB 3.45Å; Y314-R427 VanDerWaalsContact CE2-CB 3.45Å; Y314-R427 HydrophobicContact CE2-CG 4.18Å; Y314-R427 HydrophobicContact CG-CB 4.47Å; F315-R427 PolarHBondContact O-N 2.87Å; K316-R427 WeakPolarHBondContact CA-O 3.36Å; L317-R427 PolarHBondContact N-O 3.35Å; T395-R427 HydrophobicContact CG2-CG 4.06Å; T395-R427 PolarHBondContact O-NH2 3.33Å; P396-R427 PolarHBondContact O-NH2 2.7Å; K397-R427 VanDerWaalsContact CA-NH2 3.31Å; K397-R427 PolarHBondContact O-NH1 2.86Å; R427-Y429 HydrophobicContact CB-CE2 3.98Å; R427-Y429 WeakPolarHBondContact CD-OH 3.13Å; R427-Y429 HydrophobicContact CG-CD2 4.34Å; R427-Y429 HydrophobicContact CG-CE2 3.77Å; R427-Y429 WeakPolarHBondContact O-CD2 3.37Å
428	V	90.4	Very high	82	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	143.5	174	-170.2	0	0	0	0	108.7	L317 Q319 L391 E393 T395 V426	L317-V428 CarbonylContact O-C 3.58Å; L317-V428 WeakPolarHBondContact O-CA 3.47Å; Q319-V428 HydrophobicContact CB-CG1 4.17Å; L391-V428 WeakPolarHBondContact O-CG2 3.49Å; E393-V428 WeakPolarHBondContact O-CB 3.28Å; E393-V428 WeakPolarHBondContact O-CG1 3.34Å; T395-V428 WeakPolarHBondContact CB-O 3.25Å; T395-V428 PolarHBondContact N-O 2.91Å; T395-V428 WeakPolarHBondContact OG1-CB 3.42Å; T395-V428 PolarHBondContact OG1-N 2.75Å; V426-V428 HydrophobicContact CG1-CG2 4.36Å
429	Y	89.4	Confident	80.5	Confident	35 Å²	35	66.1 Å²	66.1	14%	0.137	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	163.5	178.4	-69.3	-99.3	0	0	0	110.5	Y314 K316 L317 R318 Q319 R427 E433 F435	Y314-Y429 PolarHBondContact OH-OH 2.85Å; K316-Y429 HydrophobicContact CB-CD2 4.17Å; K316-Y429 HydrophobicContact CB-CE2 3.72Å; K316-Y429 HydrophobicContact CD-CE2 4.06Å; K316-Y429 HydrophobicContact CG-CE2 3.9Å; L317-Y429 PolarHBondContact O-N 3.02Å; R318-Y429 WeakPolarHBondContact CA-O 3.22Å; Q319-Y429 PolarHBondContact N-O 3.21Å; R427-Y429 HydrophobicContact CB-CE2 3.98Å; R427-Y429 WeakPolarHBondContact CD-OH 3.13Å; R427-Y429 HydrophobicContact CG-CD2 4.34Å; R427-Y429 HydrophobicContact CG-CE2 3.77Å; R427-Y429 WeakPolarHBondContact O-CD2 3.37Å; Y429-E433 HydrophobicContact CD1-CG 3.93Å; Y429-E433 HydrophobicContact CG-CG 4.22Å; Y429-F435 HydrophobicContact CD1-CE1 4.22Å; Y429-F435 AromaticContact CD2-CE1 3.65Å; Y429-F435 HydrophobicContact CD2-CE1 3.65Å; Y429-F435 AromaticContact CD2-CZ 3.84Å; Y429-F435 HydrophobicContact CD2-CZ 3.84Å; Y429-F435 HydrophobicContact CE1-CE1 4.45Å; Y429-F435 AromaticContact CE2-CE1 3.92Å; Y429-F435 HydrophobicContact CE2-CE1 3.92Å; Y429-F435 HydrophobicContact CE2-CZ 4.44Å; Y429-F435 AromaticContact CG-CE1 3.8Å; Y429-F435 HydrophobicContact CG-CE1 3.8Å; Y429-F435 HydrophobicContact CG-CZ 4.09Å
430	P	87.3	Confident	78.8	Confident	39 Å²	39	73.8 Å²	73.8	25%	0.253	33%	0.328	S	S	.	.			trans	-55.7	147.5	170.4	-27.4	38.4	0	0	0	113	D394 N432 E433	D394-P430 WeakPolarHBondContact OD1-CD 3.23Å; P430-N432 VanDerWaalsContact CB-OD1 3.28Å; P430-N432 WeakPolarHBondContact CB-OD1 3.31Å; P430-N432 PolarHBondContact O-N 2.76Å; P430-N432 VanDerWaalsContact O-N 3.08Å; P430-E433 VanDerWaalsContact O-CB 3.26Å; P430-E433 WeakPolarHBondContact O-CB 3.25Å; P430-E433 PolarHBondContact O-N 3.38Å
431	S	82.3	Confident	77.4	Confident	71 Å²	71	80.2 Å²	80.2	50%	0.497	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-16	-171.6	52.1	0	0	0	0	114.8	Q319	Q319-S431 WeakPolarHBondContact O-CB 3.5Å
432	N	80.4	Confident	76.3	Confident	129 Å²	129	82.3 Å²	82.3	69%	0.69	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-1.1	175.2	59.6	-24.1	0	0	0	114.1	P430	P430-N432 VanDerWaalsContact CB-OD1 3.28Å; P430-N432 WeakPolarHBondContact CB-OD1 3.31Å; P430-N432 PolarHBondContact O-N 2.76Å; P430-N432 VanDerWaalsContact O-N 3.08Å
433	E	80.1	Confident	75.9	Confident	83 Å²	83	83.7 Å²	83.7	39%	0.388	38%	0.376	S	S	.	.			trans	-69.9	137.6	-172.9	-176.5	62.3	178	0	0	113.5	R318 Y429 P430 F435	R318-E433 PolarHBondContact NE-O 2.97Å; R318-E433 VanDerWaalsContact NE-O 3.15Å; R318-E433 PolarHBondContact NH2-O 3.5Å; Y429-E433 HydrophobicContact CD1-CG 3.93Å; Y429-E433 HydrophobicContact CG-CG 4.22Å; P430-E433 VanDerWaalsContact O-CB 3.26Å; P430-E433 WeakPolarHBondContact O-CB 3.25Å; P430-E433 PolarHBondContact O-N 3.38Å; E433-F435 HydrophobicContact CB-CE1 4.37Å; E433-F435 HydrophobicContact CG-CD1 4.06Å; E433-F435 HydrophobicContact CG-CE1 3.63Å; E433-F435 HydrophobicContact CG-CZ 4.26Å
434	R	74.3	Confident	75.8	Confident	182 Å²	182	84.4 Å²	84.4	69%	0.687	38%	0.384	S	S	*	.			trans	-111.9	102.3	-177.5	-69.1	-171.6	179	-168.6	0.5	111.3	W436	R434-W436 PolarHBondContact O-NE1 2.92Å
435	F	74.3	Confident	75.7	Confident	34 Å²	34	86.2 Å²	86.2	15%	0.149	39%	0.393	C	S	.	.			trans	-75.1	128.5	175.8	-49.4	-56	0	0	0	111.6	P307 K316 R318 Y429 E433	P307-F435 HydrophobicContact CB-CB 4.31Å; P307-F435 HydrophobicContact CG-CB 3.64Å; P307-F435 HydrophobicContact CG-CD2 3.26Å; P307-F435 HydrophobicContact CG-CE2 4Å; P307-F435 HydrophobicContact CG-CG 3.57Å; K316-F435 HydrophobicContact CB-CD1 4.19Å; K316-F435 HydrophobicContact CB-CE1 3.81Å; K316-F435 HydrophobicContact CB-CE2 4.27Å; K316-F435 HydrophobicContact CB-CZ 3.84Å; K316-F435 HydrophobicContact CD-CD1 4.23Å; K316-F435 HydrophobicContact CD-CE1 4.41Å; K316-F435 WeakPolarHBondContact O-CE2 3.34Å; K316-F435 WeakPolarHBondContact O-CZ 3.3Å; R318-F435 HydrophobicContact CG-CE2 4.11Å; R318-F435 HydrophobicContact CG-CZ 4.25Å; Y429-F435 HydrophobicContact CD1-CE1 4.22Å; Y429-F435 AromaticContact CD2-CE1 3.65Å; Y429-F435 HydrophobicContact CD2-CE1 3.65Å; Y429-F435 AromaticContact CD2-CZ 3.84Å; Y429-F435 HydrophobicContact CD2-CZ 3.84Å; Y429-F435 HydrophobicContact CE1-CE1 4.45Å; Y429-F435 AromaticContact CE2-CE1 3.92Å; Y429-F435 HydrophobicContact CE2-CE1 3.92Å; Y429-F435 HydrophobicContact CE2-CZ 4.44Å; Y429-F435 AromaticContact CG-CE1 3.8Å; Y429-F435 HydrophobicContact CG-CE1 3.8Å; Y429-F435 HydrophobicContact CG-CZ 4.09Å; E433-F435 HydrophobicContact CB-CE1 4.37Å; E433-F435 HydrophobicContact CG-CD1 4.06Å; E433-F435 HydrophobicContact CG-CE1 3.63Å; E433-F435 HydrophobicContact CG-CZ 4.26Å
436	W	47.7	Very low	75.8	Confident	191 Å²	191	84.9 Å²	84.9	72%	0.723	39%	0.386	S	S	*	.			trans	-118.5	142.9	176.3	-55.5	93.5	0	0	0	109.9	R434	R434-W436 PolarHBondContact O-NE1 2.92Å
437	Y	49.2	Very low	75.8	Confident	233 Å²	233	84.9 Å²	84.9	91%	0.914	39%	0.386	S	S	*	.	S	Bend	trans	46.5	93.3	176.3	-58.6	-77.1	0	0	0	115.7
438	F	53.9	Low	75.8	Confident	99 Å²	99	84.1 Å²	84.1	43%	0.434	38%	0.383	S	S	.	.			trans	-131	159.1	-176.6	51	-92.1	0	0	0	112.9	P307	P307-F438 HydrophobicContact CB-CB 3.55Å; P307-F438 HydrophobicContact CB-CD1 3.55Å; P307-F438 HydrophobicContact CB-CD2 3.55Å; P307-F438 HydrophobicContact CB-CE1 4.03Å; P307-F438 HydrophobicContact CB-CE2 4.02Å; P307-F438 HydrophobicContact CB-CG 3.27Å; P307-F438 HydrophobicContact CB-CZ 4.24Å
439	S	58.3	Low	75.7	Confident	39 Å²	39	84.1 Å²	84.1	27%	0.273	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-70.1	138.6	175.3	-173.5	0	0	0	0	110.9	K308 K441	K308-S439 PolarHBondContact O-N 3.09Å; S439-K441 WeakPolarHBondContact OG-CB 3.46Å; S439-K441 PolarHBondContact OG-N 3.41Å; S439-K441 VanDerWaalsContact OG-N 3.12Å
440	R	57	Low	75.6	Confident	239 Å²	239	87.2 Å²	87.2	90%	0.902	40%	0.395	S	S	*	.			trans	-94.2	4.6	167.1	-69.4	-171.3	178	-170	-0.7	112.9	T442	R440-T442 PolarHBondContact O-N 2.9Å
441	K	63	Low	75.4	Confident	135 Å²	135	85.4 Å²	85.4	59%	0.587	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-63.5	126.7	177.4	-161.9	-175.9	177.4	-171.9	0	108.7	S439	S439-K441 WeakPolarHBondContact OG-CB 3.46Å; S439-K441 PolarHBondContact OG-N 3.41Å; S439-K441 VanDerWaalsContact OG-N 3.12Å
442	T	70.5	Confident	75.3	Confident	78 Å²	78	88.2 Å²	88.2	48%	0.479	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-58.4	150.9	168.6	36.3	0	0	0	0	109.7	R440	R440-T442 PolarHBondContact O-N 2.9Å
443	F	84.4	Confident	75.1	Confident	31 Å²	31	85.4 Å²	85.4	14%	0.136	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	126.3	165.9	176.2	-87.5	0	0	0	104.7	S291 L292 F315 L422 E423 E445	S291-F443 CarbonylContact C-O 3.58Å; S291-F443 WeakPolarHBondContact CA-O 3.4Å; S291-F443 VanDerWaalsContact CB-O 3.23Å; S291-F443 WeakPolarHBondContact CB-O 3.16Å; L292-F443 HydrophobicContact CB-CB 4.4Å; L292-F443 HydrophobicContact CB-CD1 3.86Å; L292-F443 PolarHBondContact N-O 2.88Å; F315-F443 HydrophobicContact CE2-CB 4.2Å; F315-F443 HydrophobicContact CE2-CG 4.4Å; F315-F443 HydrophobicContact CZ-CB 4.13Å; L422-F443 HydrophobicContact CB-CE1 4.49Å; L422-F443 HydrophobicContact CD2-CE1 4.16Å; E423-F443 VanDerWaalsContact O-CZ 3.25Å; E423-F443 WeakPolarHBondContact O-CZ 3.4Å; F443-E445 HydrophobicContact CE1-CG 4.03Å; F443-E445 HydrophobicContact CZ-CG 4.14Å
444	S	87.6	Confident	74.3	Confident	47 Å²	47	84.7 Å²	84.7	33%	0.329	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	125.4	-172.2	56.1	0	0	0	0	109.9	V290	V290-S444 CarbonylContact O-C 3.51Å; V290-S444 VanDerWaalsContact O-CA 3.3Å; V290-S444 WeakPolarHBondContact O-CA 3.46Å
445	E	88.4	Confident	73.2	Confident	46 Å²	46	85 Å²	85	22%	0.215	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	139.8	174.6	-71.3	-62.4	146.9	0	0	108.3	V290 L422 F443 F447	V290-E445 PolarHBondContact N-O 3.03Å; V290-E445 PolarHBondContact O-N 3.32Å; L422-E445 HydrophobicContact CD2-CB 4.22Å; L422-E445 HydrophobicContact CD2-CG 4.37Å; F443-E445 HydrophobicContact CE1-CG 4.03Å; F443-E445 HydrophobicContact CZ-CG 4.14Å; E445-F447 HydrophobicContact CB-CD2 4.37Å; E445-F447 HydrophobicContact CB-CE2 3.72Å; E445-F447 HydrophobicContact CB-CZ 4.41Å
446	T	92.2	Very high	71.6	Confident	18 Å²	18	92 Å²	92	11%	0.11	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	144	170.9	-46.8	0	0	0	0	109.4	T287 F288 R476 E477	T287-T446 HydrophobicContact CG2-CG2 3.4Å; T287-T446 VanDerWaalsContact CG2-CG2 3.4Å; F288-T446 CarbonylContact O-C 3.54Å; F288-T446 WeakPolarHBondContact O-CA 3.5Å; F288-T446 WeakPolarHBondContact O-CG2 3.44Å; T446-R476 CarbonylContact O-C 2.94Å; T446-R476 WeakPolarHBondContact O-CA 3.41Å; T446-E477 WeakPolarHBondContact CB-OE2 3.26Å; T446-E477 WeakPolarHBondContact O-CB 3.38Å; T446-E477 PolarHBondContact O-N 3.33Å; T446-E477 PolarHBondContact OG1-OE2 3.25Å
447	F	91.2	Very high	71	Confident	3 Å²	3	92.4 Å²	92.4	1%	0.013	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.9	-177.7	-70.4	-105.6	0	0	0	109.4	T287 F288 V290 F420 L421 L422 E445 L474 Q475 R476	T287-F447 WeakPolarHBondContact CA-O 3.29Å; F288-F447 PolarHBondContact N-O 2.81Å; F288-F447 PolarHBondContact O-N 3.45Å; V290-F447 HydrophobicContact CB-CD2 3.99Å; V290-F447 HydrophobicContact CB-CE2 3.79Å; V290-F447 HydrophobicContact CG2-CD2 3.72Å; V290-F447 HydrophobicContact CG2-CE2 3.96Å; F420-F447 HydrophobicContact CD1-CB 4.11Å; F420-F447 AromaticContact CD1-CD1 3.85Å; F420-F447 HydrophobicContact CD1-CD1 3.85Å; F420-F447 HydrophobicContact CD1-CD2 4.06Å; F420-F447 HydrophobicContact CD1-CE1 4.24Å; F420-F447 HydrophobicContact CD1-CE2 4.45Å; F420-F447 AromaticContact CD1-CG 3.76Å; F420-F447 HydrophobicContact CD1-CG 3.76Å; F420-F447 HydrophobicContact CE1-CB 3.93Å; F420-F447 HydrophobicContact CE1-CD1 4.44Å; F420-F447 HydrophobicContact CE1-CG 4.11Å; L421-F447 WeakPolarHBondContact O-CZ 3.44Å; L422-F447 HydrophobicContact CD2-CE2 4.17Å; L422-F447 HydrophobicContact CD2-CZ 4.34Å; E445-F447 HydrophobicContact CB-CD2 4.37Å; E445-F447 HydrophobicContact CB-CE2 3.72Å; E445-F447 HydrophobicContact CB-CZ 4.41Å; F447-L474 HydrophobicContact CB-CD1 3.98Å; F447-L474 HydrophobicContact CD1-CD1 4.16Å; F447-L474 HydrophobicContact CD1-CD2 4.3Å; F447-L474 HydrophobicContact CD1-CG 4.07Å; F447-Q475 CarbonylContact C-O 3.53Å; F447-Q475 VanDerWaalsContact CA-O 3.3Å; F447-Q475 WeakPolarHBondContact CA-O 3.48Å; F447-R476 HydrophobicContact CD1-CG 3.95Å; F447-R476 HydrophobicContact CE1-CG 3.65Å; F447-R476 HydrophobicContact CZ-CG 4.15Å
448	Y	89.8	Confident	70.1	Confident	35 Å²	35	85.3 Å²	85.3	14%	0.137	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	103.6	178.3	-61.6	-80.9	0	0	0	108.3	T287 L474 Q475 E477	T287-Y448 HydrophobicContact CG2-CD1 4.03Å; T287-Y448 HydrophobicContact CG2-CE1 3.71Å; Y448-L474 WeakPolarHBondContact O-CA 3.39Å; Y448-Q475 PolarHBondContact N-O 3.35Å; Y448-Q475 PolarHBondContact O-N 3.4Å; Y448-E477 HydrophobicContact CE2-CB 4.04Å
449	L	89.3	Confident	69.6	Low	0 Å²	0	86.9 Å²	86.9	0%	0	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	120.1	176.8	176.9	69.1	0	0	0	108.6	Y286 F288 L337 V418 L451 V471 S473 L474	Y286-L449 PolarHBondContact N-O 2.82Å; Y286-L449 PolarHBondContact O-N 3.39Å; F288-L449 HydrophobicContact CD2-CB 4.29Å; F288-L449 HydrophobicContact CE2-CB 4.07Å; F288-L449 HydrophobicContact CE2-CD2 3.8Å; F288-L449 HydrophobicContact CZ-CD2 4.45Å; L337-L449 HydrophobicContact CD1-CD2 3.96Å; V418-L449 HydrophobicContact CG1-CD1 4.04Å; V418-L449 HydrophobicContact CG1-CD2 4.46Å; V418-L449 HydrophobicContact CG2-CD1 4.25Å; V418-L449 HydrophobicContact CG2-CD2 4.23Å; L449-L451 HydrophobicContact CD1-CD2 3.96Å; L449-L451 HydrophobicContact CD2-CD1 4.35Å; L449-L451 HydrophobicContact CD2-CD2 4Å; L449-L451 HydrophobicContact CD2-CG 4.22Å; L449-L451 HydrophobicContact CG-CD2 3.85Å; L449-L451 HydrophobicContact CG-CG 4.12Å; L449-V471 HydrophobicContact CD1-CG1 3.77Å; L449-V471 HydrophobicContact CD1-CG2 4.4Å; L449-S473 CarbonylContact C-O 3.52Å; L449-S473 WeakPolarHBondContact CA-O 3.46Å; L449-L474 HydrophobicContact CB-CD1 3.83Å; L449-L474 HydrophobicContact CD1-CB 4.4Å; L449-L474 HydrophobicContact CD1-CD1 4.07Å
450	R	86.8	Confident	68.4	Low	100 Å²	100	91.1 Å²	91.1	38%	0.377	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.4	171.5	-156.3	177.4	-152.7	152.3	12.5	110.1	D282 D284 L285 V472 S473	D282-R450 IonicContact OD1-CZ 2.62Å; D282-R450 IonicContact OD1-NE 2.7Å; D282-R450 IonicContact OD1-NH2 2.68Å; D282-R450 PolarHBondContact OD1-NH2 2.78Å; D282-R450 IonicContact OD2-NH2 2.79Å; D282-R450 PolarHBondContact OD2-NH2 3.41Å; D284-R450 HydrophobicContact CB-CG 4.33Å; D284-R450 CarbonylContact O-C 3.5Å; D284-R450 WeakPolarHBondContact O-CA 3.42Å; L285-R450 HydrophobicContact CD1-CB 4.02Å; L285-R450 HydrophobicContact CD1-CG 4.19Å; R450-V472 HydrophobicContact CB-CB 4.32Å; R450-V472 PolarHBondContact O-N 3.45Å; R450-S473 WeakPolarHBondContact CB-OG 3.48Å; R450-S473 PolarHBondContact N-O 2.85Å; R450-S473 PolarHBondContact O-N 3.47Å
451	L	83.1	Confident	67.5	Low	0 Å²	0	89.7 Å²	89.7	0%	0	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.1	-177.3	-61.6	-176.6	0	0	0	111.4	D284 Y286 L337 V414 L449 Y469 E470 V471	D284-L451 WeakPolarHBondContact CB-O 3.42Å; D284-L451 VanDerWaalsContact CG-O 3.26Å; D284-L451 PolarHBondContact O-N 2.98Å; Y286-L451 HydrophobicContact CD2-CB 4.49Å; Y286-L451 HydrophobicContact CD2-CD1 4Å; Y286-L451 HydrophobicContact CD2-CG 4.03Å; Y286-L451 HydrophobicContact CE2-CB 3.95Å; Y286-L451 HydrophobicContact CE2-CD1 3.62Å; Y286-L451 HydrophobicContact CE2-CG 3.84Å; L337-L451 HydrophobicContact CD1-CD1 3.84Å; L337-L451 HydrophobicContact CD2-CD1 4.14Å; V414-L451 HydrophobicContact CG1-CD2 4.25Å; V414-L451 HydrophobicContact CG2-CD1 3.8Å; V414-L451 HydrophobicContact CG2-CD2 4.29Å; L449-L451 HydrophobicContact CD1-CD2 3.96Å; L449-L451 HydrophobicContact CD2-CD1 4.35Å; L449-L451 HydrophobicContact CD2-CD2 4Å; L449-L451 HydrophobicContact CD2-CG 4.22Å; L449-L451 HydrophobicContact CG-CD2 3.85Å; L449-L451 HydrophobicContact CG-CG 4.12Å; L451-Y469 HydrophobicContact CB-CD1 3.93Å; L451-Y469 HydrophobicContact CB-CG 4.25Å; L451-Y469 HydrophobicContact CD1-CG 4.17Å; L451-E470 CarbonylContact C-O 3.54Å; L451-E470 VanDerWaalsContact CA-O 3.24Å; L451-E470 WeakPolarHBondContact CA-O 3.14Å; L451-V471 HydrophobicContact CD2-CB 4.38Å; L451-V471 HydrophobicContact CD2-CG2 3.89Å
452	R	80.1	Confident	66.1	Low	130 Å²	130	89.8 Å²	89.8	49%	0.491	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132.1	173.3	174.4	-173.6	-66.9	147.4	-10.3	109.4	Y469 E470 V472	R452-Y469 CarbonylContact O-C 3.49Å; R452-Y469 WeakPolarHBondContact O-CA 3.31Å; R452-E470 HydrophobicContact CB-CB 4.46Å; R452-E470 WeakPolarHBondContact CD-OE2 3.22Å; R452-E470 IonicContact CZ-OE2 2.72Å; R452-E470 PolarHBondContact N-O 3.29Å; R452-E470 IonicContact NE-OE2 2.81Å; R452-E470 IonicContact NH1-OE2 3.14Å; R452-E470 PolarHBondContact NH1-OE2 3.29Å; R452-E470 PolarHBondContact O-N 2.99Å; R452-V472 HydrophobicContact CB-CG2 3.4Å
453	Q	75.6	Confident	64.4	Low	70 Å²	70	91.3 Å²	91.3	33%	0.327	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	124.7	172	-174.1	175.1	-18.2	0	0	111	A467 Y469	Q453-A467 HydrophobicContact CG-CB 4.19Å; Q453-Y469 HydrophobicContact CB-CD1 4.17Å; Q453-Y469 HydrophobicContact CB-CE1 3.83Å; Q453-Y469 HydrophobicContact CG-CE1 4.36Å
454	L	64.3	Low	62.4	Low	68 Å²	68	99.3 Å²	99.3	36%	0.356	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-80.6	131.7	173.3	-64.5	176.6	0	0	0	110.7	V415 V468 E470	V415-L454 HydrophobicContact CG2-CD1 4.16Å; L454-V468 HydrophobicContact CD1-CG1 4.2Å; L454-V468 PolarHBondContact N-O 2.91Å; L454-E470 HydrophobicContact CD1-CB 4.32Å; L454-E470 HydrophobicContact CD2-CB 4.1Å; L454-E470 HydrophobicContact CG-CB 4.1Å
455	Y	50.5	Low	60.3	Low	189 Å²	189	100.7 Å²	100.7	74%	0.741	51%	0.507	S	S	*	.			trans	-103.7	105.7	175.6	-72.8	-94.7	0	0	0	110.2	Q457	Y455-Q457 PolarHBondContact O-N 3.13Å
456	Q	41.5	Very low	58.2	Low	182 Å²	182	105 Å²	105	85%	0.85	53%	0.531	S	S	*	.			trans	-70.3	124.1	173.7	-74.3	-173.3	-10.7	0	0	111.3
457	Q	34.4	Very low	56.3	Low	198 Å²	198	105.2 Å²	105.2	93%	0.925	54%	0.535	S	S	*	.			trans	-88.2	104.6	170.6	-66	-173	6.3	0	0	110.3	Y455	Y455-Q457 PolarHBondContact O-N 3.13Å
458	A	31.3	Very low	55.2	Low	85 Å²	85	107.7 Å²	107.7	70%	0.702	55%	0.55	S	S	*	*			trans	-143.1	118.4	170.6	0	0	0	0	0	110.2	D460	A458-D460 PolarHBondContact O-N 3.33Å
459	P	42	Very low	54.7	Low	132 Å²	132	106.8 Å²	106.8	86%	0.857	55%	0.547	S	S	*	.			trans	-96.1	71.5	-171.3	37.1	-36	0	0	0	114.2
460	D	33.5	Very low	54.2	Low	127 Å²	127	110.1 Å²	110.1	68%	0.679	56%	0.562	S	S	*	*	S	Bend	trans	-164.5	125	137.3	-126	-29.5	0	0	0	113.8	A458	A458-D460 PolarHBondContact O-N 3.33Å
461	R	38.8	Very low	54.1	Low	209 Å²	209	107.4 Å²	107.4	79%	0.789	56%	0.556	S	S	*	*			trans	44.7	110.1	153.3	-67.8	158.7	-161.4	-108.2	-3.1	121.6
462	V	33.9	Very low	54.1	Low	137 Å²	137	110.3 Å²	110.3	83%	0.83	57%	0.574	S	S	*	*			trans	71.9	124.9	143.5	-173.9	0	0	0	0	114.9
463	S	33.3	Very low	54.2	Low	111 Å²	111	105.9 Å²	105.9	78%	0.776	56%	0.563	S	S	*	*			cis	-140.3	166.9	15.3	-112	0	0	0	0	111.9	S465	S463-S465 PolarHBondContact O-N 3.05Å
464	Q	43.9	Very low	54.8	Low	198 Å²	198	105 Å²	105	93%	0.925	56%	0.56	S	S	*	*			trans	-75.1	104.9	172.3	-71.8	-180	-33	0	0	112.3
465	S	43.3	Very low	55.7	Low	77 Å²	77	104.9 Å²	104.9	54%	0.538	56%	0.558	S	S	.	*			trans	178.2	105.4	136.6	62.1	0	0	0	0	111.7	S463	S463-S465 PolarHBondContact O-N 3.05Å
466	D	42.9	Very low	57.5	Low	135 Å²	135	98.2 Å²	98.2	72%	0.722	53%	0.532	S	S	*	.			trans	-167.7	96.7	137.3	-91.8	-17	0	0	0	105.9	V468	D466-V468 PolarHBondContact O-N 3.46Å; D466-V468 VanDerWaalsContact O-N 3.09Å
467	A	53.1	Low	59.3	Low	24 Å²	24	92.7 Å²	92.7	20%	0.198	51%	0.506	C	S	.	.			trans	-83.1	82.5	-176.2	0	0	0	0	0	109.3	Q453 Y469	Q453-A467 HydrophobicContact CG-CB 4.19Å; A467-Y469 HydrophobicContact CB-CE2 4.06Å; A467-Y469 WeakPolarHBondContact O-CD2 3.34Å; A467-Y469 VanDerWaalsContact O-CE2 3.23Å; A467-Y469 WeakPolarHBondContact O-CE2 3.26Å; A467-Y469 PolarHBondContact O-N 2.94Å
468	V	68.8	Low	60.9	Low	55 Å²	55	85.9 Å²	85.9	33%	0.333	48%	0.483	S	S	.	.			trans	-68.3	127	178.4	-178.2	0	0	0	0	109.7	V415 L454 D466	V415-V468 HydrophobicContact CG2-CG1 3.31Å; L454-V468 HydrophobicContact CD1-CG1 4.2Å; L454-V468 PolarHBondContact N-O 2.91Å; D466-V468 PolarHBondContact O-N 3.46Å; D466-V468 VanDerWaalsContact O-N 3.09Å
469	Y	77.6	Confident	62.6	Low	16 Å²	16	85.6 Å²	85.6	6%	0.063	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	128.3	-175.6	-72.2	-70.9	0	0	0	112.3	K335 E413 V414 V415 L451 R452 Q453 A467	K335-Y469 PolarHBondContact NZ-OH 3.29Å; E413-Y469 HydrophobicContact CB-CD2 3.98Å; E413-Y469 HydrophobicContact CB-CE2 4.48Å; E413-Y469 PolarHBondContact O-N 2.8Å; V414-Y469 WeakPolarHBondContact CA-O 3.47Å; V415-Y469 PolarHBondContact N-O 3.29Å; L451-Y469 HydrophobicContact CB-CD1 3.93Å; L451-Y469 HydrophobicContact CB-CG 4.25Å; L451-Y469 HydrophobicContact CD1-CG 4.17Å; R452-Y469 CarbonylContact O-C 3.49Å; R452-Y469 WeakPolarHBondContact O-CA 3.31Å; Q453-Y469 HydrophobicContact CB-CD1 4.17Å; Q453-Y469 HydrophobicContact CB-CE1 3.83Å; Q453-Y469 HydrophobicContact CG-CE1 4.36Å; A467-Y469 HydrophobicContact CB-CE2 4.06Å; A467-Y469 WeakPolarHBondContact O-CD2 3.34Å; A467-Y469 VanDerWaalsContact O-CE2 3.23Å; A467-Y469 WeakPolarHBondContact O-CE2 3.26Å; A467-Y469 PolarHBondContact O-N 2.94Å
470	E	80.6	Confident	63.4	Low	70 Å²	70	82.8 Å²	82.8	33%	0.327	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	143.2	169	175.2	178.2	-99.7	0	0	109.9	L451 R452 L454 V472	L451-E470 CarbonylContact C-O 3.54Å; L451-E470 VanDerWaalsContact CA-O 3.24Å; L451-E470 WeakPolarHBondContact CA-O 3.14Å; R452-E470 HydrophobicContact CB-CB 4.46Å; R452-E470 WeakPolarHBondContact CD-OE2 3.22Å; R452-E470 IonicContact CZ-OE2 2.72Å; R452-E470 PolarHBondContact N-O 3.29Å; R452-E470 IonicContact NE-OE2 2.81Å; R452-E470 IonicContact NH1-OE2 3.14Å; R452-E470 PolarHBondContact NH1-OE2 3.29Å; R452-E470 PolarHBondContact O-N 2.99Å; L454-E470 HydrophobicContact CD1-CB 4.32Å; L454-E470 HydrophobicContact CD2-CB 4.1Å; L454-E470 HydrophobicContact CG-CB 4.1Å; E470-V472 PolarHBondContact O-N 3.18Å
471	V	84.4	Confident	64.2	Low	42 Å²	42	80.1 Å²	80.1	26%	0.255	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	113.4	175	-179.6	0	0	0	0	109.4	V414 V418 L449 L451	V414-V471 HydrophobicContact CG1-CG2 3.51Å; V418-V471 HydrophobicContact CG2-CG2 4.27Å; L449-V471 HydrophobicContact CD1-CG1 3.77Å; L449-V471 HydrophobicContact CD1-CG2 4.4Å; L451-V471 HydrophobicContact CD2-CB 4.38Å; L451-V471 HydrophobicContact CD2-CG2 3.89Å
472	V	82.1	Confident	65	Low	61 Å²	61	73.8 Å²	73.8	37%	0.37	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-41.8	177.7	-178.3	0	0	0	0	111.1	R450 R452 E470	R450-V472 HydrophobicContact CB-CB 4.32Å; R450-V472 PolarHBondContact O-N 3.45Å; R452-V472 HydrophobicContact CB-CG2 3.4Å; E470-V472 PolarHBondContact O-N 3.18Å
473	S	83.2	Confident	65.5	Low	37 Å²	37	71.5 Å²	71.5	26%	0.259	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	156.8	177.3	63.9	0	0	0	0	112.4	L449 R450	L449-S473 CarbonylContact C-O 3.52Å; L449-S473 WeakPolarHBondContact CA-O 3.46Å; R450-S473 WeakPolarHBondContact CB-OG 3.48Å; R450-S473 PolarHBondContact N-O 2.85Å; R450-S473 PolarHBondContact O-N 3.47Å
474	L	87.1	Confident	65.9	Low	51 Å²	51	69.8 Å²	69.8	27%	0.267	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	94	167.7	-178.7	69.2	0	0	0	108.7	V418 R419 F420 F447 Y448 L449	V418-L474 HydrophobicContact CG1-CD1 4.38Å; V418-L474 HydrophobicContact CG1-CD2 3.87Å; R419-L474 WeakPolarHBondContact O-CD2 3.38Å; F420-L474 HydrophobicContact CD1-CD1 4.45Å; F420-L474 HydrophobicContact CD1-CD2 4.3Å; F420-L474 HydrophobicContact CE1-CD1 3.97Å; F420-L474 HydrophobicContact CE1-CD2 4.47Å; F447-L474 HydrophobicContact CB-CD1 3.98Å; F447-L474 HydrophobicContact CD1-CD1 4.16Å; F447-L474 HydrophobicContact CD1-CD2 4.3Å; F447-L474 HydrophobicContact CD1-CG 4.07Å; Y448-L474 WeakPolarHBondContact O-CA 3.39Å; L449-L474 HydrophobicContact CB-CD1 3.83Å; L449-L474 HydrophobicContact CD1-CB 4.4Å; L449-L474 HydrophobicContact CD1-CD1 4.07Å
475	Q	84.6	Confident	65.7	Low	66 Å²	66	69.4 Å²	69.4	31%	0.308	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	151.1	-179.7	-67.9	174.2	-67.4	0	0	111.3	F447 Y448 E483	F447-Q475 CarbonylContact C-O 3.53Å; F447-Q475 VanDerWaalsContact CA-O 3.3Å; F447-Q475 WeakPolarHBondContact CA-O 3.48Å; Y448-Q475 PolarHBondContact N-O 3.35Å; Y448-Q475 PolarHBondContact O-N 3.4Å; Q475-E483 PolarHBondContact NE2-OE1 3.2Å; Q475-E483 PolarHBondContact NE2-OE2 3.4Å
476	R	86.7	Confident	65.6	Low	50 Å²	50	72.4 Å²	72.4	19%	0.189	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	153.1	171.8	-55.1	179.6	-155.8	162.5	15.3	111.6	L421 E423 T446 F447 A478 E479 R480	L421-R476 PolarHBondContact O-NE 2.85Å; E423-R476 IonicContact OE2-NH1 2.62Å; T446-R476 CarbonylContact O-C 2.94Å; T446-R476 WeakPolarHBondContact O-CA 3.41Å; F447-R476 HydrophobicContact CD1-CG 3.95Å; F447-R476 HydrophobicContact CE1-CG 3.65Å; F447-R476 HydrophobicContact CZ-CG 4.15Å; R476-A478 VanDerWaalsContact C-N 3.27Å; R476-A478 PolarHBondContact O-N 3.36Å; R476-E479 HydrophobicContact CB-CB 4.44Å; R476-E479 HydrophobicContact CB-CG 4.15Å; R476-E479 WeakPolarHBondContact CB-OE2 3.47Å; R476-E479 WeakPolarHBondContact CD-OE1 3.41Å; R476-E479 WeakPolarHBondContact CG-OE2 3.33Å; R476-E479 IonicContact CZ-OE1 2.75Å; R476-E479 PolarHBondContact N-OE2 3.24Å; R476-E479 IonicContact NE-OE1 3.84Å; R476-E479 PolarHBondContact NE-OE1 3.12Å; R476-E479 WeakPolarHBondContact O-CB 3.4Å; R476-E479 PolarHBondContact O-N 3.27Å; R476-R480 PolarHBondContact O-N 3.35Å
477	E	80.6	Confident	65.2	Low	65 Å²	65	72.5 Å²	72.5	30%	0.304	36%	0.362	S	S	.	.	H	α-helix	trans	-62.5	-32.8	171.4	175.6	169.6	-132.4	0	0	112.3	T446 Y448 E479 N481	T446-E477 WeakPolarHBondContact CB-OE2 3.26Å; T446-E477 WeakPolarHBondContact O-CB 3.38Å; T446-E477 PolarHBondContact O-N 3.33Å; T446-E477 PolarHBondContact OG1-OE2 3.25Å; Y448-E477 HydrophobicContact CE2-CB 4.04Å; E477-E479 VanDerWaalsContact C-N 3.26Å; E477-E479 PolarHBondContact O-N 3.32Å; E477-N481 WeakPolarHBondContact CG-ND2 3.37Å; E477-N481 WeakPolarHBondContact O-CB 3.46Å; E477-N481 PolarHBondContact O-N 3.35Å; E477-N481 PolarHBondContact O-ND2 3.27Å
478	A	67.1	Low	64.4	Low	55 Å²	55	76.2 Å²	76.2	46%	0.455	38%	0.382	S	S	.	.	H	α-helix	trans	-66.3	-24.6	171.5	0	0	0	0	0	114	R476	R476-A478 VanDerWaalsContact C-N 3.27Å; R476-A478 PolarHBondContact O-N 3.36Å
479	E	68.4	Low	62.6	Low	79 Å²	79	79.3 Å²	79.3	37%	0.369	40%	0.401	S	S	.	.	H	α-helix	trans	-85.8	-51.9	177	-66.7	150.9	-175.1	0	0	109.4	R476 E477 N481 V482 E483	R476-E479 HydrophobicContact CB-CB 4.44Å; R476-E479 HydrophobicContact CB-CG 4.15Å; R476-E479 WeakPolarHBondContact CB-OE2 3.47Å; R476-E479 WeakPolarHBondContact CD-OE1 3.41Å; R476-E479 WeakPolarHBondContact CG-OE2 3.33Å; R476-E479 IonicContact CZ-OE1 2.75Å; R476-E479 PolarHBondContact N-OE2 3.24Å; R476-E479 IonicContact NE-OE1 3.84Å; R476-E479 PolarHBondContact NE-OE1 3.12Å; R476-E479 WeakPolarHBondContact O-CB 3.4Å; R476-E479 PolarHBondContact O-N 3.27Å; E477-E479 VanDerWaalsContact C-N 3.26Å; E477-E479 PolarHBondContact O-N 3.32Å; E479-N481 VanDerWaalsContact C-N 3.31Å; E479-N481 PolarHBondContact O-N 3.32Å; E479-V482 WeakPolarHBondContact O-CB 3.48Å; E479-V482 PolarHBondContact O-N 3.47Å; E479-E483 PolarHBondContact O-N 2.93Å
480	R	57.7	Low	60.5	Low	73 Å²	73	82.5 Å²	82.5	28%	0.275	43%	0.426	S	S	.	.	H	α-helix	trans	-59.6	-33.7	176.7	-177	177.6	167.9	170.1	2	113.7	R476 V482 E483 E484	R476-R480 PolarHBondContact O-N 3.35Å; R480-V482 PolarHBondContact O-N 3.06Å; R480-E483 PolarHBondContact O-N 2.97Å; R480-E484 HydrophobicContact CG-CG 4.27Å; R480-E484 IonicContact CZ-OE1 2.74Å; R480-E484 IonicContact NE-OE1 3.27Å; R480-E484 PolarHBondContact NE-OE1 3.21Å; R480-E484 IonicContact NH2-OE1 3.42Å; R480-E484 PolarHBondContact NH2-OE1 3.25Å; R480-E484 WeakPolarHBondContact O-CB 3.01Å; R480-E484 PolarHBondContact O-N 2.59Å
481	N	50.8	Low	58.1	Low	71 Å²	71	86.2 Å²	86.2	38%	0.38	44%	0.442	S	S	.	.	H	α-helix	trans	-71.7	-10	174.4	-85	-65.1	0	0	0	114	E477 E479 R485	E477-N481 WeakPolarHBondContact CG-ND2 3.37Å; E477-N481 WeakPolarHBondContact O-CB 3.46Å; E477-N481 PolarHBondContact O-N 3.35Å; E477-N481 PolarHBondContact O-ND2 3.27Å; E479-N481 VanDerWaalsContact C-N 3.31Å; E479-N481 PolarHBondContact O-N 3.32Å; N481-R485 VanDerWaalsContact O-CB 3.24Å; N481-R485 WeakPolarHBondContact O-CB 3.49Å; N481-R485 WeakPolarHBondContact O-CD 3.47Å; N481-R485 WeakPolarHBondContact O-CG 3.42Å; N481-R485 PolarHBondContact O-N 2.94Å
482	V	54.4	Low	55.5	Low	77 Å²	77	92.1 Å²	92.1	47%	0.467	47%	0.473	S	S	.	.	H	α-helix	trans	-81.6	-51.9	166.6	178.8	0	0	0	0	108.6	E479 R480 E484 R485 E486	E479-V482 WeakPolarHBondContact O-CB 3.48Å; E479-V482 PolarHBondContact O-N 3.47Å; R480-V482 PolarHBondContact O-N 3.06Å; V482-E484 PolarHBondContact O-N 3.25Å; V482-R485 PolarHBondContact O-N 3.19Å; V482-E486 WeakPolarHBondContact O-CG 3.28Å; V482-E486 PolarHBondContact O-N 3.41Å
483	E	44.3	Very low	52.9	Low	89 Å²	89	98.7 Å²	98.7	42%	0.416	50%	0.499	S	S	.	.	H	α-helix	trans	-53.5	-49.6	176.6	-59.9	169.5	172.1	0	0	111.9	Q475 E479 R480 R485 E486 Q487	Q475-E483 PolarHBondContact NE2-OE1 3.2Å; Q475-E483 PolarHBondContact NE2-OE2 3.4Å; E479-E483 PolarHBondContact O-N 2.93Å; R480-E483 PolarHBondContact O-N 2.97Å; E483-R485 PolarHBondContact O-N 3.1Å; E483-E486 PolarHBondContact O-N 2.95Å; E483-Q487 WeakPolarHBondContact O-CG 3.43Å; E483-Q487 PolarHBondContact O-N 3.31Å; E483-Q487 VanDerWaalsContact O-N 3.11Å
484	E	43.3	Very low	50.3	Low	75 Å²	75	106.1 Å²	106.1	35%	0.35	53%	0.53	S	S	.	.	H	α-helix	trans	-71.9	-25.9	178.1	-73.1	-173.8	-179.3	0	0	113.2	R480 V482 V488	R480-E484 HydrophobicContact CG-CG 4.27Å; R480-E484 IonicContact CZ-OE1 2.74Å; R480-E484 IonicContact NE-OE1 3.27Å; R480-E484 PolarHBondContact NE-OE1 3.21Å; R480-E484 IonicContact NH2-OE1 3.42Å; R480-E484 PolarHBondContact NH2-OE1 3.25Å; R480-E484 WeakPolarHBondContact O-CB 3.01Å; R480-E484 PolarHBondContact O-N 2.59Å; V482-E484 PolarHBondContact O-N 3.25Å; E484-V488 VanDerWaalsContact O-CB 3.27Å; E484-V488 WeakPolarHBondContact O-CB 3.3Å; E484-V488 WeakPolarHBondContact O-CG2 3.37Å; E484-V488 PolarHBondContact O-N 2.97Å
485	R	39.7	Very low	47.5	Very low	190 Å²	190	112.7 Å²	112.7	72%	0.717	56%	0.559	S	S	*	*	H	α-helix	trans	-73.5	-40.4	173.2	-88.1	-179.4	161.3	-172.9	-6.8	112.1	N481 V482 E483 Q487 V488 T489	N481-R485 VanDerWaalsContact O-CB 3.24Å; N481-R485 WeakPolarHBondContact O-CB 3.49Å; N481-R485 WeakPolarHBondContact O-CD 3.47Å; N481-R485 WeakPolarHBondContact O-CG 3.42Å; N481-R485 PolarHBondContact O-N 2.94Å; V482-R485 PolarHBondContact O-N 3.19Å; E483-R485 PolarHBondContact O-N 3.1Å; R485-Q487 VanDerWaalsContact C-N 3.25Å; R485-Q487 PolarHBondContact O-N 3.5Å; R485-V488 PolarHBondContact O-N 3.47Å; R485-T489 PolarHBondContact O-N 3.23Å; R485-T489 VanDerWaalsContact O-N 3.1Å; R485-T489 PolarHBondContact O-OG1 2.98Å
486	E	40.8	Very low	44.8	Very low	140 Å²	140	117.5 Å²	117.5	65%	0.654	59%	0.587	S	S	*	*	H	α-helix	trans	-64.7	-33.6	176.5	-70.2	173.7	162.9	0	0	110.6	V482 E483 T489	V482-E486 WeakPolarHBondContact O-CG 3.28Å; V482-E486 PolarHBondContact O-N 3.41Å; E483-E486 PolarHBondContact O-N 2.95Å; E486-T489 PolarHBondContact O-OG1 3.24Å
487	Q	35.2	Very low	42.2	Very low	137 Å²	137	122 Å²	122	64%	0.64	62%	0.62	S	S	*	*	H	α-helix	trans	-72.6	-50.2	169.9	-69.6	179.8	7	0	0	113.7	E483 R485 T489 S490	E483-Q487 WeakPolarHBondContact O-CG 3.43Å; E483-Q487 PolarHBondContact O-N 3.31Å; E483-Q487 VanDerWaalsContact O-N 3.11Å; R485-Q487 VanDerWaalsContact C-N 3.25Å; R485-Q487 PolarHBondContact O-N 3.5Å; Q487-T489 VanDerWaalsContact C-N 3.28Å; Q487-T489 PolarHBondContact O-N 3.14Å; Q487-S490 WeakPolarHBondContact O-CB 3.49Å; Q487-S490 PolarHBondContact O-N 3.04Å; Q487-S490 PolarHBondContact O-OG 2.92Å
488	V	34.7	Very low	39.7	Very low	102 Å²	102	126.4 Å²	126.4	62%	0.618	65%	0.645	S	S	*	*	H	α-helix	trans	-67.4	-24.8	-173.4	169.4	0	0	0	0	112.9	E484 R485 S490 H491	E484-V488 VanDerWaalsContact O-CB 3.27Å; E484-V488 WeakPolarHBondContact O-CB 3.3Å; E484-V488 WeakPolarHBondContact O-CG2 3.37Å; E484-V488 PolarHBondContact O-N 2.97Å; R485-V488 PolarHBondContact O-N 3.47Å; V488-S490 PolarHBondContact O-N 3.04Å; V488-S490 VanDerWaalsContact O-N 3.09Å; V488-H491 PolarHBondContact O-N 3.43Å
489	T	31.7	Very low	38.1	Very low	120 Å²	120	132.8 Å²	132.8	74%	0.736	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-6.6	171.5	42.7	0	0	0	0	114.9	R485 E486 Q487	R485-T489 PolarHBondContact O-N 3.23Å; R485-T489 VanDerWaalsContact O-N 3.1Å; R485-T489 PolarHBondContact O-OG1 2.98Å; E486-T489 PolarHBondContact O-OG1 3.24Å; Q487-T489 VanDerWaalsContact C-N 3.28Å; Q487-T489 PolarHBondContact O-N 3.14Å
490	S	33.1	Very low	36.1	Very low	83 Å²	83	132.7 Å²	132.7	58%	0.58	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-10.1	173.7	69.8	0	0	0	0	114.7	Q487 V488	Q487-S490 WeakPolarHBondContact O-CB 3.49Å; Q487-S490 PolarHBondContact O-N 3.04Å; Q487-S490 PolarHBondContact O-OG 2.92Å; V488-S490 PolarHBondContact O-N 3.04Å; V488-S490 VanDerWaalsContact O-N 3.09Å
491	H	30.6	Very low	34.7	Very low	147 Å²	147	138 Å²	138	68%	0.681	72%	0.717	S	S	*	*	S	Bend	trans	-138.4	85.9	-172.9	-76.7	-10.5	0	0	0	112.2	V488	V488-H491 PolarHBondContact O-N 3.43Å
492	N	29.3	Very low	34	Very low	167 Å²	167	140 Å²	140	89%	0.893	73%	0.733	S	S	*	*	S	Bend	trans	167.5	47.1	143	-85.6	-40.6	0	0	0	114.4
493	E	28.2	Very low	32.9	Very low	198 Å²	198	140.6 Å²	140.6	93%	0.925	74%	0.741	S	S	*	*			trans	-141.7	63.1	168.5	-73	-161.1	163.5	0	0	113.7
494	E	27.4	Very low	32	Very low	193 Å²	193	143.8 Å²	143.8	90%	0.902	76%	0.761	S	S	*	*			trans	-143.8	96.1	160.6	-77.4	-160.7	160.8	0	0	111.6
495	E	29.5	Very low	31.3	Very low	190 Å²	190	148.9 Å²	148.9	89%	0.888	79%	0.787	S	S	*	*			trans	-175	88.9	146.4	-111.9	-178.4	-171.6	0	0	110.9
496	D	26.3	Very low	31.1	Very low	167 Å²	167	147 Å²	147	89%	0.893	79%	0.791	S	S	*	*				172	151.7	126.5	-103.3	-27	0	0	0	112
497	V	33.9	Very low	30.4	Very low	144 Å²	144	149 Å²	149	87%	0.873	80%	0.798	S	S	*	*			trans	-141.2	128.9	-175.9	178	0	0	0	0	111.1
498	D	27.4	Very low	30	Very low	157 Å²	157	150.6 Å²	150.6	84%	0.84	80%	0.803	S	S	*	*			trans	-155.3	167.9	155.3	-151.8	0.2	0	0	0	113.2
499	E	32.9	Very low	29.8	Very low	189 Å²	189	151 Å²	151	88%	0.883	81%	0.807	S	S	*	*			trans	-84.1	154.1	-165.6	-55.8	-174.6	124.7	0	0	116.3
500	G	27.2	Very low	29.9	Very low	78 Å²	78	151.2 Å²	151.2	80%	0.804	81%	0.811	S	S	*	*			trans	169.6	105.6	163.8	0	0	0	0	0	117.6
501	M	28	Very low	29.6	Very low	185 Å²	185	156.7 Å²	156.7	91%	0.911	83%	0.827	S	S	*	*			trans	-100.6	163.1	165.9	-82.4	-77.2	164	0	0	110.2
502	P	36.6	Very low	29.5	Very low	111 Å²	111	155.7 Å²	155.7	72%	0.721	84%	0.836	S	S	*	*			cis	-141.1	-176	23.7	43.9	-24.9	0	0	0	117.7
503	S	30.4	Very low	29.4	Very low	91 Å²	91	155.1 Å²	155.1	64%	0.636	83%	0.833	S	S	*	*			trans	-25.2	134.8	165.8	55.2	0	0	0	0	119.8
504	D	26.7	Very low	29.7	Very low	156 Å²	156	152.7 Å²	152.7	83%	0.834	83%	0.826	S	S	*	*				176.5	170.7	101.1	-108.7	-27.8	0	0	0	114.1
505	M	28.4	Very low	30.2	Very low	181 Å²	181	152.4 Å²	152.4	89%	0.892	82%	0.822	S	S	*	*			trans	78.4	129.3	169.5	-76.6	-70.6	174.3	0	0	120.4
506	N	34.6	Very low	30.4	Very low	150 Å²	150	148 Å²	148	80%	0.802	81%	0.808	S	S	*	*			trans	-81.2	151.9	176.1	-53.9	-60.9	0	0	0	112.6
507	F	26.5	Very low	30.9	Very low	184 Å²	184	144.2 Å²	144.2	81%	0.807	79%	0.788	S	S	*	*			trans	-165.3	117.6	131	-128	-124	0	0	0	112.5
508	F	25.8	Very low	31.2	Very low	169 Å²	169	140.9 Å²	140.9	74%	0.741	77%	0.771	S	S	*	*			trans	55.4	139.6	160	-71.3	-107.2	0	0	0	120.8
509	P	31.8	Very low	32.2	Very low	110 Å²	110	137.9 Å²	137.9	71%	0.714	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-67	149.1	161.8	-12.1	28	0	0	0	111
510	P	32.8	Very low	33.1	Very low	125 Å²	125	132.2 Å²	132.2	81%	0.812	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-60.6	142.2	166.9	-20.1	32.8	0	0	0	111.3
511	E	27.3	Very low	35.1	Very low	198 Å²	198	131.6 Å²	131.6	93%	0.925	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-66.5	140.5	173.6	-64	179.7	132.2	0	0	110.3	D513	E511-D513 PolarHBondContact O-N 3.48Å
512	C	28.3	Very low	37.1	Very low	127 Å²	127	123.7 Å²	123.7	86%	0.858	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-69.9	126.4	-176.9	-57.8	0	0	0	0	111.1	D514	C512-D514 PolarHBondContact O-N 3.1Å; C512-D514 VanDerWaalsContact O-N 3.16Å
513	D	28.1	Very low	38.7	Very low	154 Å²	154	120.9 Å²	120.9	82%	0.824	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-59.9	116.6	169.4	-100.2	-34.2	0	0	0	110.4	E511 K515	E511-D513 PolarHBondContact O-N 3.48Å; D513-K515 VanDerWaalsContact C-N 3.31Å; D513-K515 PolarHBondContact O-N 3.36Å
514	D	34.1	Very low	40.6	Very low	148 Å²	148	117.2 Å²	117.2	79%	0.791	63%	0.631	S	S	*	*			trans	-75	75.5	-170.8	-173	12.7	0	0	0	112.5	C512 T516	C512-D514 PolarHBondContact O-N 3.1Å; C512-D514 VanDerWaalsContact O-N 3.16Å; D514-T516 PolarHBondContact O-N 2.96Å
515	K	37.2	Very low	42.6	Very low	187 Å²	187	110 Å²	110	81%	0.813	59%	0.594	S	S	*	*			trans	-77.4	66.6	173.1	-71.1	-170.2	179.3	179.9	0	112	D513 D517	D513-K515 VanDerWaalsContact C-N 3.31Å; D513-K515 PolarHBondContact O-N 3.36Å; K515-D517 PolarHBondContact O-N 2.95Å
516	T	34	Very low	44.7	Very low	97 Å²	97	103 Å²	103	60%	0.595	56%	0.561	S	S	*	*			trans	27.2	93.7	155.5	56.6	0	0	0	0	115.6	D514 S518	D514-T516 PolarHBondContact O-N 2.96Å; T516-S518 PolarHBondContact O-N 3.14Å
517	D	37.9	Very low	46.1	Very low	87 Å²	87	97.1 Å²	97.1	47%	0.465	54%	0.536	S	S	.	.			trans	-66	96.4	178.4	-165.6	12.8	0	0	0	111.2	K515 D519 Q786 K789	K515-D517 PolarHBondContact O-N 2.95Å; D517-D519 PolarHBondContact O-N 2.88Å; D517-Q786 PolarHBondContact OD2-NE2 3.46Å; D517-K789 IonicContact OD1-NZ 2.62Å; D517-K789 PolarHBondContact OD1-NZ 3.22Å
518	S	40.1	Very low	47.5	Very low	74 Å²	74	94.4 Å²	94.4	52%	0.517	53%	0.53	S	S	.	.			trans	-73.9	114.2	174.2	-172.2	0	0	0	0	109	T516 S520 K789	T516-S518 PolarHBondContact O-N 3.14Å; S518-S520 PolarHBondContact O-N 3.3Å; S518-K789 PolarHBondContact O-NZ 3.39Å
519	D	47.5	Very low	49.3	Very low	94 Å²	94	87.8 Å²	87.8	50%	0.503	50%	0.503	S	S	.	.			trans	-62.1	-2.7	-175.4	-103.2	-12.6	0	0	0	115.2	D517 E521 K781	D517-D519 PolarHBondContact O-N 2.88Å; D519-E521 PolarHBondContact O-N 3.12Å; D519-K781 WeakPolarHBondContact OD1-CE 3.48Å; D519-K781 IonicContact OD1-NZ 2.64Å; D519-K781 PolarHBondContact OD1-NZ 2.9Å; D519-K781 IonicContact OD2-NZ 2.74Å; D519-K781 PolarHBondContact OD2-NZ 3.12Å
520	S	52.5	Low	50.6	Low	70 Å²	70	85.9 Å²	85.9	49%	0.49	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-58.3	132.5	172.5	61.9	0	0	0	0	112.1	S518	S518-S520 PolarHBondContact O-N 3.3Å
521	E	67.6	Low	52.1	Low	65 Å²	65	87.6 Å²	87.6	30%	0.304	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-57.5	154.9	162.9	-74.7	-177.9	-100.9	0	0	111.4	D519 K735 R784 V785	D519-E521 PolarHBondContact O-N 3.12Å; E521-K735 IonicContact OE2-NZ 2.69Å; E521-K735 PolarHBondContact OE2-NZ 2.98Å; E521-R784 HydrophobicContact CG-CG 4.07Å; E521-R784 IonicContact OE1-CZ 3.52Å; E521-R784 IonicContact OE1-NE 2.69Å; E521-R784 PolarHBondContact OE1-NE 3.04Å; E521-R784 IonicContact OE1-NH2 3.86Å; E521-R784 PolarHBondContact OE1-NH2 3.38Å; E521-R784 VanDerWaalsContact OE2-CG 3.32Å; E521-R784 WeakPolarHBondContact OE2-CG 3.2Å; E521-R784 IonicContact OE2-NE 3.81Å; E521-R784 PolarHBondContact OE2-NE 3.36Å; E521-V785 HydrophobicContact CG-CG2 3.99Å
522	I	71.4	Confident	53.4	Low	19 Å²	19	84.7 Å²	84.7	10%	0.097	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-72.1	130	171.6	-60.9	179.7	0	0	0	109.2	S524 T526 P788 K789 R792	I522-S524 PolarHBondContact O-N 3.41Å; I522-T526 WeakPolarHBondContact CG2-OG1 3.39Å; I522-P788 HydrophobicContact CD1-CB 3.85Å; I522-K789 HydrophobicContact CD1-CB 4.17Å; I522-K789 HydrophobicContact CD1-CG 3.71Å; I522-K789 HydrophobicContact CG1-CG 3.88Å; I522-R792 HydrophobicContact CD1-CG 4.45Å
523	S	69.6	Low	55.3	Low	52 Å²	52	80.2 Å²	80.2	36%	0.364	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-62.9	130.1	161.6	-167.2	0	0	0	0	109.4	T526 A616	S523-T526 WeakPolarHBondContact O-CG2 3.3Å; S523-T526 PolarHBondContact O-OG1 3.19Å; S523-A616 WeakPolarHBondContact OG-CB 3.49Å
524	S	70.7	Confident	57.5	Low	14 Å²	14	76.7 Å²	76.7	10%	0.098	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	152.7	176	62.7	0	0	0	0	110.1	I522 R612 F614 P615	I522-S524 PolarHBondContact O-N 3.41Å; S524-R612 PolarHBondContact OG-O 3.13Å; S524-F614 WeakPolarHBondContact O-CA 3.4Å; S524-F614 PolarHBondContact OG-N 3.06Å; S524-F614 VanDerWaalsContact OG-N 3.13Å; S524-P615 WeakPolarHBondContact OG-CD 3.33Å
525	G	69.6	Low	59.3	Low	6 Å²	6	77.1 Å²	77.1	6%	0.062	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	13.5	-179.2	0	0	0	0	0	115	F614 L738	G525-F614 VanDerWaalsContact CA-CD1 3.45Å; G525-L738 WeakPolarHBondContact O-CD1 3.14Å
526	T	72.4	Confident	61	Low	33 Å²	33	76.3 Å²	76.3	20%	0.202	43%	0.427	C	S	.	.			trans	-100.8	164.1	175.6	58.3	0	0	0	0	112.6	I522 S523 A616 P737 L738	I522-T526 WeakPolarHBondContact CG2-OG1 3.39Å; S523-T526 WeakPolarHBondContact O-CG2 3.3Å; S523-T526 PolarHBondContact O-OG1 3.19Å; T526-A616 HydrophobicContact CG2-CB 3.88Å; T526-P737 CarbonylContact O-C 3.26Å; T526-P737 WeakPolarHBondContact O-CA 3.33Å; T526-P737 VanDerWaalsContact O-CB 3.29Å; T526-P737 WeakPolarHBondContact O-CB 3.39Å; T526-L738 PolarHBondContact O-N 3.5Å
527	G	62	Low	63.1	Low	26 Å²	26	75.2 Å²	75.2	27%	0.268	42%	0.417	S	S	.	.	S	Bend	trans	112.3	125.1	-176.1	0	0	0	0	0	110.3
528	D	57.9	Low	65.1	Low	128 Å²	128	74.5 Å²	74.5	68%	0.684	41%	0.412	S	S	*	.			trans	-71.3	145.2	-178.6	-179.5	36.8	0	0	0	111.8	C739	D528-C739 WeakPolarHBondContact O-CB 3.4Å
529	V	62.6	Low	67.1	Low	29 Å²	29	77.3 Å²	77.3	18%	0.176	42%	0.418	C	S	.	.			trans	-136.7	89.3	-177.6	-171.3	0	0	0	0	108.1	K531 E569 L738 C739 F742	V529-K531 PolarHBondContact O-N 2.93Å; V529-E569 HydrophobicContact CG1-CG 4.39Å; V529-E569 WeakPolarHBondContact CG1-OE1 3.32Å; V529-L738 HydrophobicContact CG2-CB 4.4Å; V529-C739 HydrophobicContact CG2-CB 4.02Å; V529-F742 HydrophobicContact CG1-CD2 4.31Å; V529-F742 HydrophobicContact CG1-CE2 4.32Å; V529-F742 HydrophobicContact CG2-CD2 4.38Å; V529-F742 HydrophobicContact CG2-CE2 4.06Å
530	S	60.2	Low	68.9	Low	71 Å²	71	75.3 Å²	75.3	50%	0.497	41%	0.411	S	S	.	.			trans	-56.1	130.9	174.8	167.8	0	0	0	0	110.6	D532	S530-D532 VanDerWaalsContact C-N 3.32Å; S530-D532 WeakPolarHBondContact OG-CB 3.49Å; S530-D532 PolarHBondContact OG-N 3.24Å; S530-D532 PolarHBondContact OG-OD2 3.42Å
531	K	62.5	Low	70.7	Confident	161 Å²	161	72.1 Å²	72.1	70%	0.7	39%	0.388	S	S	*	.			trans	-89.7	-3.9	178.8	-62.3	178.3	-178.9	175.8	0	111.8	V529 C533	V529-K531 PolarHBondContact O-N 2.93Å; K531-C533 PolarHBondContact O-N 3.24Å
532	D	56.1	Low	71.7	Confident	137 Å²	137	70.4 Å²	70.4	73%	0.733	39%	0.387	S	S	*	.			trans	-79.5	108.9	-176.9	-50.8	-71.2	0	0	0	110	S530 P534	S530-D532 VanDerWaalsContact C-N 3.32Å; S530-D532 WeakPolarHBondContact OG-CB 3.49Å; S530-D532 PolarHBondContact OG-N 3.24Å; S530-D532 PolarHBondContact OG-OD2 3.42Å; D532-P534 WeakPolarHBondContact O-CD 3.5Å
533	C	67.4	Low	72.4	Confident	32 Å²	32	71.3 Å²	71.3	22%	0.216	40%	0.402	C	S	.	.			trans	-104.4	114.9	175.7	-164.1	0	0	0	0	110.7	K531 E535 L538 P568	K531-C533 PolarHBondContact O-N 3.24Å; C533-E535 PolarHBondContact O-N 3.42Å; C533-L538 HydrophobicContact CB-CD1 4.22Å; C533-L538 HydrophobicContact CB-CD2 3.86Å; C533-L538 HydrophobicContact CB-CG 3.96Å; C533-L538 VanDerWaalsContact SG-CD2 3.55Å; C533-P568 HydrophobicContact CB-CB 4.36Å; C533-P568 VanDerWaalsContact SG-CB 3.59Å
534	P	74.1	Confident	73.4	Confident	81 Å²	81	69.3 Å²	69.3	53%	0.526	39%	0.387	S	S	.	.			trans	-54.1	133.7	173.8	-27.8	34.5	0	0	0	112.2	D532 K536 I537 L538	D532-P534 WeakPolarHBondContact O-CD 3.5Å; P534-K536 VanDerWaalsContact C-N 3.26Å; P534-K536 PolarHBondContact O-N 3.23Å; P534-K536 VanDerWaalsContact O-N 3.11Å; P534-I537 HydrophobicContact CB-CD1 4.37Å; P534-I537 HydrophobicContact CB-CG1 4.37Å; P534-I537 HydrophobicContact CG-CD1 4.21Å; P534-I537 WeakPolarHBondContact O-CA 3.34Å; P534-I537 WeakPolarHBondContact O-CB 3.26Å; P534-I537 PolarHBondContact O-N 3.39Å; P534-L538 PolarHBondContact O-N 3.48Å
535	E	72.4	Confident	74.4	Confident	157 Å²	157	69.2 Å²	69.2	73%	0.734	39%	0.385	S	S	*	.	H	α-helix	trans	-50.9	-42	-174.1	-170.9	172.4	-145	0	0	113.1	C533 I537 L538 E539	C533-E535 PolarHBondContact O-N 3.42Å; E535-I537 PolarHBondContact O-N 3.14Å; E535-L538 CarbonylContact O-C 3.52Å; E535-L538 WeakPolarHBondContact O-CA 3.45Å; E535-L538 WeakPolarHBondContact O-CB 3.48Å; E535-L538 PolarHBondContact O-N 3.07Å; E535-E539 WeakPolarHBondContact O-CG 3.44Å; E535-E539 PolarHBondContact O-N 2.92Å
536	K	73.6	Confident	75.4	Confident	169 Å²	169	74.2 Å²	74.2	74%	0.735	42%	0.415	S	S	*	.	H	α-helix	trans	-58.9	-29.9	176.2	-64.4	172.3	-177.3	167.3	0	114	P534 S540	P534-K536 VanDerWaalsContact C-N 3.26Å; P534-K536 PolarHBondContact O-N 3.23Å; P534-K536 VanDerWaalsContact O-N 3.11Å; K536-S540 PolarHBondContact O-N 2.84Å
537	I	77.7	Confident	76.2	Confident	75 Å²	75	79 Å²	79	39%	0.385	43%	0.429	S	S	.	.	H	α-helix	trans	-75.8	-45.6	175.1	-62.5	-178	0	0	0	109	P534 E535 E539 S540 W541 P568	P534-I537 HydrophobicContact CB-CD1 4.37Å; P534-I537 HydrophobicContact CB-CG1 4.37Å; P534-I537 HydrophobicContact CG-CD1 4.21Å; P534-I537 WeakPolarHBondContact O-CA 3.34Å; P534-I537 WeakPolarHBondContact O-CB 3.26Å; P534-I537 PolarHBondContact O-N 3.39Å; E535-I537 PolarHBondContact O-N 3.14Å; I537-E539 PolarHBondContact O-N 3.31Å; I537-S540 PolarHBondContact O-N 2.96Å; I537-S540 VanDerWaalsContact O-N 3.14Å; I537-S540 PolarHBondContact O-OG 3.23Å; I537-W541 PolarHBondContact O-N 3.14Å; I537-P568 HydrophobicContact CG2-CG 3.83Å
538	L	79.4	Confident	77.7	Confident	71 Å²	71	78 Å²	78	37%	0.372	42%	0.417	S	S	.	.	H	α-helix	trans	-59.1	-42.3	175	-64.2	176.4	0	0	0	112.4	C533 P534 E535 S540 W541 G542 L571	C533-L538 HydrophobicContact CB-CD1 4.22Å; C533-L538 HydrophobicContact CB-CD2 3.86Å; C533-L538 HydrophobicContact CB-CG 3.96Å; C533-L538 VanDerWaalsContact SG-CD2 3.55Å; P534-L538 PolarHBondContact O-N 3.48Å; E535-L538 CarbonylContact O-C 3.52Å; E535-L538 WeakPolarHBondContact O-CA 3.45Å; E535-L538 WeakPolarHBondContact O-CB 3.48Å; E535-L538 PolarHBondContact O-N 3.07Å; L538-S540 VanDerWaalsContact C-N 3.33Å; L538-S540 PolarHBondContact O-N 3.13Å; L538-W541 PolarHBondContact O-N 3.35Å; L538-G542 PolarHBondContact O-N 2.65Å; L538-L571 HydrophobicContact CD2-CD1 4.17Å
539	E	81.8	Confident	79.1	Confident	134 Å²	134	76.4 Å²	76.4	63%	0.626	41%	0.405	S	S	*	.	H	α-helix	trans	-55.2	-46.7	172.9	-72.3	-176.4	136.3	0	0	111.8	E535 I537 W541 G542 G543	E535-E539 WeakPolarHBondContact O-CG 3.44Å; E535-E539 PolarHBondContact O-N 2.92Å; I537-E539 PolarHBondContact O-N 3.31Å; E539-W541 PolarHBondContact O-N 2.86Å; E539-G542 PolarHBondContact O-N 2.99Å; E539-G543 PolarHBondContact O-N 3.02Å
540	S	85.5	Confident	80.3	Confident	51 Å²	51	78.3 Å²	78.3	36%	0.357	43%	0.431	S	S	.	.	H	α-helix	trans	-65.6	-39	-178.2	78.8	0	0	0	0	112.7	K536 I537 L538 I544	K536-S540 PolarHBondContact O-N 2.84Å; I537-S540 PolarHBondContact O-N 2.96Å; I537-S540 VanDerWaalsContact O-N 3.14Å; I537-S540 PolarHBondContact O-OG 3.23Å; L538-S540 VanDerWaalsContact C-N 3.33Å; L538-S540 PolarHBondContact O-N 3.13Å; S540-I544 WeakPolarHBondContact O-CG1 3.24Å
541	W	90.7	Very high	81.7	Confident	4 Å²	4	78.5 Å²	78.5	2%	0.015	43%	0.427	C	S	.	.	H	α-helix	trans	-73.6	-42.9	175.9	-82.7	99.3	0	0	0	112.4	I537 L538 E539 G543 I544 L545 L559 L562 V563 I567 P568 L571 V575	I537-W541 PolarHBondContact O-N 3.14Å; L538-W541 PolarHBondContact O-N 3.35Å; E539-W541 PolarHBondContact O-N 2.86Å; W541-G543 VanDerWaalsContact C-N 3.29Å; W541-G543 PolarHBondContact O-N 3.5Å; W541-I544 CarbonylContact O-C 3.59Å; W541-I544 WeakPolarHBondContact O-CA 3.48Å; W541-I544 WeakPolarHBondContact O-CB 3.3Å; W541-I544 PolarHBondContact O-N 2.86Å; W541-L545 WeakPolarHBondContact O-CG 3.37Å; W541-L545 PolarHBondContact O-N 3.25Å; W541-L559 HydrophobicContact CH2-CD1 4.29Å; W541-L559 HydrophobicContact CZ3-CD1 3.81Å; W541-L562 HydrophobicContact CD2-CB 4.37Å; W541-L562 HydrophobicContact CD2-CD1 3.99Å; W541-L562 HydrophobicContact CE3-CD1 4.31Å; W541-L562 HydrophobicContact CG-CD1 4.29Å; W541-L562 HydrophobicContact CH2-CB 3.74Å; W541-L562 HydrophobicContact CZ2-CB 3.4Å; W541-L562 VanDerWaalsContact CZ2-CB 3.4Å; W541-L562 HydrophobicContact CZ3-CB 4.36Å; W541-V563 HydrophobicContact CH2-CG2 3.89Å; W541-I567 HydrophobicContact CH2-CB 4.45Å; W541-I567 HydrophobicContact CH2-CG1 3.72Å; W541-I567 HydrophobicContact CH2-CG2 4.48Å; W541-I567 HydrophobicContact CZ2-CB 4.36Å; W541-I567 HydrophobicContact CZ2-CG1 3.99Å; W541-P568 HydrophobicContact CG-CG 4.39Å; W541-P568 VanDerWaalsContact NE1-CD 3.3Å; W541-L571 HydrophobicContact CB-CD1 3.59Å; W541-L571 HydrophobicContact CG-CD1 3.94Å; W541-V575 HydrophobicContact CE3-CG2 4.33Å; W541-V575 HydrophobicContact CZ3-CG1 4.17Å; W541-V575 HydrophobicContact CZ3-CG2 4.15Å
542	G	87.6	Confident	82.8	Confident	28 Å²	28	73.4 Å²	73.4	29%	0.289	41%	0.407	S	S	.	.	H	α-helix	trans	-55.9	-44.7	174.5	0	0	0	0	0	111.7	L538 E539 I544 L545 T546	L538-G542 PolarHBondContact O-N 2.65Å; E539-G542 PolarHBondContact O-N 2.99Å; G542-I544 PolarHBondContact O-N 3.38Å; G542-I544 VanDerWaalsContact O-N 3.14Å; G542-L545 PolarHBondContact O-N 3.01Å; G542-T546 PolarHBondContact O-N 2.99Å; G542-T546 PolarHBondContact O-OG1 3.15Å; G542-T546 VanDerWaalsContact O-OG1 3.07Å
543	G	87.4	Confident	84.1	Confident	39 Å²	39	72.3 Å²	72.3	40%	0.402	41%	0.41	S	S	.	.	H	α-helix	trans	-62.9	-15.1	173.4	0	0	0	0	0	115.2	E539 W541 R547	E539-G543 PolarHBondContact O-N 3.02Å; W541-G543 VanDerWaalsContact C-N 3.29Å; W541-G543 PolarHBondContact O-N 3.5Å; G543-R547 PolarHBondContact O-NE 2.88Å; G543-R547 PolarHBondContact O-NH2 2.76Å; G543-R547 VanDerWaalsContact O-NH2 3.09Å
544	I	90.4	Very high	85.1	Confident	9 Å²	9	74.6 Å²	74.6	5%	0.046	42%	0.423	C	S	.	.	H	α-helix	trans	-92.5	-48.5	169.8	-62.6	-120	0	0	0	110.2	S540 W541 G542 T546 R547 W548 P556 L559 L562	S540-I544 WeakPolarHBondContact O-CG1 3.24Å; W541-I544 CarbonylContact O-C 3.59Å; W541-I544 WeakPolarHBondContact O-CA 3.48Å; W541-I544 WeakPolarHBondContact O-CB 3.3Å; W541-I544 PolarHBondContact O-N 2.86Å; G542-I544 PolarHBondContact O-N 3.38Å; G542-I544 VanDerWaalsContact O-N 3.14Å; I544-T546 PolarHBondContact O-N 2.74Å; I544-R547 WeakPolarHBondContact O-CB 3.45Å; I544-R547 PolarHBondContact O-N 3.11Å; I544-R547 VanDerWaalsContact O-N 3.12Å; I544-W548 PolarHBondContact O-N 3.35Å; I544-P556 HydrophobicContact CG2-CB 4.12Å; I544-P556 HydrophobicContact CG2-CG 4.08Å; I544-L559 HydrophobicContact CG2-CB 4.49Å; I544-L559 HydrophobicContact CG2-CD1 4.09Å; I544-L562 HydrophobicContact CD1-CD1 3.72Å; I544-L562 HydrophobicContact CD1-CG 4.39Å; I544-L562 HydrophobicContact CG1-CD1 3.65Å
545	L	91.4	Very high	85.9	Confident	13 Å²	13	76 Å²	76	7%	0.068	42%	0.418	C	S	.	.	H	α-helix	trans	-59.6	-45.2	-178.4	-75.1	165	0	0	0	112.6	W541 G542 R547 W548 H549 L571 E574 V575 L578	W541-L545 WeakPolarHBondContact O-CG 3.37Å; W541-L545 PolarHBondContact O-N 3.25Å; G542-L545 PolarHBondContact O-N 3.01Å; L545-R547 VanDerWaalsContact C-N 3.25Å; L545-R547 PolarHBondContact O-N 2.74Å; L545-W548 PolarHBondContact O-N 3.22Å; L545-H549 PolarHBondContact O-N 2.88Å; L545-H549 PolarHBondContact O-ND1 3.42Å; L545-L571 HydrophobicContact CD1-CD1 4.18Å; L545-L571 HydrophobicContact CD1-CD2 4.22Å; L545-E574 VanDerWaalsContact CD1-OE2 3.32Å; L545-E574 WeakPolarHBondContact CD1-OE2 3.41Å; L545-E574 HydrophobicContact CD2-CG 4.27Å; L545-E574 WeakPolarHBondContact CD2-OE2 3.45Å; L545-V575 HydrophobicContact CD2-CG2 3.99Å; L545-L578 HydrophobicContact CD2-CD1 3.81Å
546	T	90.3	Very high	86.7	Confident	110 Å²	110	69.3 Å²	69.3	68%	0.675	39%	0.388	S	S	*	.	H	α-helix	trans	-60.6	-35.5	175.8	-53.3	0	0	0	0	112	G542 I544 G550	G542-T546 PolarHBondContact O-N 2.99Å; G542-T546 PolarHBondContact O-OG1 3.15Å; G542-T546 VanDerWaalsContact O-OG1 3.07Å; I544-T546 PolarHBondContact O-N 2.74Å; T546-G550 PolarHBondContact O-N 3.46Å
547	R	89.9	Confident	87.4	Confident	134 Å²	134	70.5 Å²	70.5	51%	0.506	39%	0.393	S	S	.	.	H	α-helix	trans	-74.5	-27.9	175.1	-73.8	-175.5	-69.3	139.8	4.2	112.8	G543 I544 L545	G543-R547 PolarHBondContact O-NE 2.88Å; G543-R547 PolarHBondContact O-NH2 2.76Å; G543-R547 VanDerWaalsContact O-NH2 3.09Å; I544-R547 WeakPolarHBondContact O-CB 3.45Å; I544-R547 PolarHBondContact O-N 3.11Å; I544-R547 VanDerWaalsContact O-N 3.12Å; L545-R547 VanDerWaalsContact C-N 3.25Å; L545-R547 PolarHBondContact O-N 2.74Å
548	W	91.9	Very high	87.8	Confident	4 Å²	4	68.9 Å²	68.9	2%	0.015	40%	0.395	C	S	.	.	H	α-helix	trans	-76.3	-43.7	176.9	-153.9	-15.7	0	0	0	111.5	I544 L545 G550 N551 L552 R555 P556 L559 V575 L578 L579	I544-W548 PolarHBondContact O-N 3.35Å; L545-W548 PolarHBondContact O-N 3.22Å; W548-G550 PolarHBondContact O-N 2.73Å; W548-N551 CarbonylContact O-C 3.57Å; W548-N551 WeakPolarHBondContact O-CA 3.48Å; W548-N551 PolarHBondContact O-N 3.02Å; W548-L552 PolarHBondContact NE1-O 3.12Å; W548-L552 PolarHBondContact O-N 3.04Å; W548-R555 HydrophobicContact CH2-CG 4.39Å; W548-R555 HydrophobicContact CZ2-CG 3.81Å; W548-P556 HydrophobicContact CB-CG 3.65Å; W548-P556 HydrophobicContact CD2-CG 4.15Å; W548-P556 HydrophobicContact CE3-CG 4.45Å; W548-P556 HydrophobicContact CG-CG 3.79Å; W548-L559 HydrophobicContact CE3-CD1 4.41Å; W548-L559 HydrophobicContact CE3-CD2 4.15Å; W548-L559 HydrophobicContact CH2-CD2 3.6Å; W548-L559 HydrophobicContact CZ2-CD2 4.34Å; W548-L559 HydrophobicContact CZ3-CD1 3.88Å; W548-L559 HydrophobicContact CZ3-CD2 3.47Å; W548-L559 VanDerWaalsContact CZ3-CD2 3.47Å; W548-L559 HydrophobicContact CZ3-CG 4.34Å; W548-V575 HydrophobicContact CZ3-CG1 4.39Å; W548-L578 HydrophobicContact CD2-CB 4.29Å; W548-L578 HydrophobicContact CD2-CD1 4.18Å; W548-L578 HydrophobicContact CE3-CB 4.25Å; W548-L578 HydrophobicContact CE3-CD1 4.04Å; W548-L578 HydrophobicContact CH2-CB 3.65Å; W548-L578 HydrophobicContact CZ2-CB 3.71Å; W548-L578 WeakPolarHBondContact CZ2-O 3.47Å; W548-L578 HydrophobicContact CZ3-CB 3.94Å; W548-L578 HydrophobicContact CZ3-CD1 4.39Å; W548-L579 HydrophobicContact CH2-CD2 3.76Å; W548-L579 HydrophobicContact CH2-CG 3.9Å
549	H	89.2	Confident	88.4	Confident	95 Å²	95	65.6 Å²	65.6	44%	0.44	38%	0.378	S	S	.	.	H	α-helix	trans	-60.8	-29.6	173.1	-71.5	95.3	0	0	0	112.8	L545 N551 E574	L545-H549 PolarHBondContact O-N 2.88Å; L545-H549 PolarHBondContact O-ND1 3.42Å; H549-N551 VanDerWaalsContact C-N 3.26Å; H549-N551 PolarHBondContact O-N 2.75Å; H549-E574 IonicContact CE1-OE1 3.2Å; H549-E574 PolarHBondContact CE1-OE1 2.89Å; H549-E574 IonicContact NE2-OE1 2.93Å
550	G	86.8	Confident	88.8	Confident	70 Å²	70	62 Å²	62	72%	0.722	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-15.3	170.2	0	0	0	0	0	115.4	T546 W548	T546-G550 PolarHBondContact O-N 3.46Å; W548-G550 PolarHBondContact O-N 2.73Å
551	N	89.3	Confident	89.1	Confident	75 Å²	75	63.4 Å²	63.4	40%	0.401	38%	0.376	S	S	.	.			trans	-162	81.4	174	-175.1	-2.8	0	0	0	111.5	W548 H549 S553 T554	W548-N551 CarbonylContact O-C 3.57Å; W548-N551 WeakPolarHBondContact O-CA 3.48Å; W548-N551 PolarHBondContact O-N 3.02Å; H549-N551 VanDerWaalsContact C-N 3.26Å; H549-N551 PolarHBondContact O-N 2.75Å; N551-S553 PolarHBondContact O-N 2.68Å; N551-S553 VanDerWaalsContact O-N 3.15Å; N551-S553 PolarHBondContact OD1-N 3.04Å; N551-T554 PolarHBondContact ND2-OG1 3.21Å; N551-T554 PolarHBondContact O-N 2.86Å
552	L	87	Confident	89.1	Confident	54 Å²	54	65 Å²	65	28%	0.283	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-28	-177.4	-64.7	172.9	0	0	0	113	W548 T554 L578	W548-L552 PolarHBondContact NE1-O 3.12Å; W548-L552 PolarHBondContact O-N 3.04Å; L552-T554 VanDerWaalsContact C-N 3.25Å; L552-T554 PolarHBondContact O-N 3.32Å; L552-L578 HydrophobicContact CD2-CD2 3.5Å
553	S	83	Confident	89.3	Confident	114 Å²	114	63.7 Å²	63.7	80%	0.797	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-10.1	-179.2	-47.9	0	0	0	0	114.8	N551	N551-S553 PolarHBondContact O-N 2.68Å; N551-S553 VanDerWaalsContact O-N 3.15Å; N551-S553 PolarHBondContact OD1-N 3.04Å
554	T	87.6	Confident	89.5	Confident	80 Å²	80	64.7 Å²	64.7	49%	0.491	37%	0.365	S	S	.	.	S	Bend	trans	-137.3	118.9	178.9	64.3	0	0	0	0	113.1	N551 L552	N551-T554 PolarHBondContact ND2-OG1 3.21Å; N551-T554 PolarHBondContact O-N 2.86Å; L552-T554 VanDerWaalsContact C-N 3.25Å; L552-T554 PolarHBondContact O-N 3.32Å
555	R	90.1	Very high	89.3	Confident	110 Å²	110	68.4 Å²	68.4	42%	0.415	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-57.3	127	175	-68.4	-177.9	177.2	-171.2	-4	111.2	W548 L559 L579 Y678 L749 C750	W548-R555 HydrophobicContact CH2-CG 4.39Å; W548-R555 HydrophobicContact CZ2-CG 3.81Å; R555-L559 HydrophobicContact CB-CD2 4.07Å; R555-L559 HydrophobicContact CG-CD2 4.27Å; R555-L579 PolarHBondContact NH2-O 3.45Å; R555-Y678 PolarHBondContact NH2-OH 2.94Å; R555-L749 PolarHBondContact NH1-O 2.85Å; R555-L749 PolarHBondContact NH2-O 2.88Å; R555-C750 PolarHBondContact NH1-O 2.91Å
556	P	90.4	Very high	89.2	Confident	17 Å²	17	68.4 Å²	68.4	11%	0.11	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-63.9	148.1	-175.5	-25.8	33.9	0	0	0	115.3	I544 W548 G558 L559	I544-P556 HydrophobicContact CG2-CB 4.12Å; I544-P556 HydrophobicContact CG2-CG 4.08Å; W548-P556 HydrophobicContact CB-CG 3.65Å; W548-P556 HydrophobicContact CD2-CG 4.15Å; W548-P556 HydrophobicContact CE3-CG 4.45Å; W548-P556 HydrophobicContact CG-CG 3.79Å; P556-G558 PolarHBondContact O-N 3.3Å; P556-L559 VanDerWaalsContact O-CB 3.31Å; P556-L559 WeakPolarHBondContact O-CB 3.37Å; P556-L559 PolarHBondContact O-N 2.9Å
557	K	88.2	Confident	89.3	Confident	193 Å²	193	63.4 Å²	63.4	84%	0.839	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	128.2	169.1	-66.1	-176.5	-178.5	178.9	0	110.3
558	G	86.9	Confident	89.3	Confident	42 Å²	42	57.7 Å²	57.7	43%	0.433	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.2	-22.6	-176.2	0	0	0	0	0	114	P556 S561	P556-G558 PolarHBondContact O-N 3.3Å; G558-S561 WeakPolarHBondContact O-CB 3.38Å; G558-S561 PolarHBondContact O-N 2.82Å
559	L	91.4	Very high	89	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.01	35%	0.353	C	S	.	.	H	α-helix	trans	-50.6	-49.8	-174.2	175.2	69.5	0	0	0	114.3	W541 I544 W548 R555 P556 S561 L562 V563 L579	W541-L559 HydrophobicContact CH2-CD1 4.29Å; W541-L559 HydrophobicContact CZ3-CD1 3.81Å; I544-L559 HydrophobicContact CG2-CB 4.49Å; I544-L559 HydrophobicContact CG2-CD1 4.09Å; W548-L559 HydrophobicContact CE3-CD1 4.41Å; W548-L559 HydrophobicContact CE3-CD2 4.15Å; W548-L559 HydrophobicContact CH2-CD2 3.6Å; W548-L559 HydrophobicContact CZ2-CD2 4.34Å; W548-L559 HydrophobicContact CZ3-CD1 3.88Å; W548-L559 HydrophobicContact CZ3-CD2 3.47Å; W548-L559 VanDerWaalsContact CZ3-CD2 3.47Å; W548-L559 HydrophobicContact CZ3-CG 4.34Å; R555-L559 HydrophobicContact CB-CD2 4.07Å; R555-L559 HydrophobicContact CG-CD2 4.27Å; P556-L559 VanDerWaalsContact O-CB 3.31Å; P556-L559 WeakPolarHBondContact O-CB 3.37Å; P556-L559 PolarHBondContact O-N 2.9Å; L559-S561 PolarHBondContact O-N 2.82Å; L559-S561 VanDerWaalsContact O-N 3.17Å; L559-L562 PolarHBondContact O-N 2.91Å; L559-V563 HydrophobicContact CD1-CG2 4.01Å; L559-V563 HydrophobicContact CG-CG2 4.19Å; L559-V563 WeakPolarHBondContact O-CG2 3.15Å; L559-V563 PolarHBondContact O-N 2.93Å; L559-V563 VanDerWaalsContact O-N 3.07Å; L559-L579 HydrophobicContact CD2-CD2 4.04Å
560	P	90.9	Very high	88.9	Confident	57 Å²	57	58.8 Å²	58.8	37%	0.37	36%	0.357	S	S	.	.	H	α-helix	trans	-59.3	-32.9	-178.6	-24.7	35.3	0	0	0	113.3	L562 V563 H564	P560-L562 VanDerWaalsContact C-N 3.31Å; P560-L562 PolarHBondContact O-N 2.83Å; P560-V563 PolarHBondContact O-N 2.87Å; P560-H564 WeakPolarHBondContact O-CB 3.23Å; P560-H564 PolarHBondContact O-CD2 2.8Å; P560-H564 PolarHBondContact O-N 2.63Å
561	S	90.1	Very high	89.1	Confident	81 Å²	81	56.8 Å²	56.8	57%	0.566	33%	0.33	S	S	*	.	H	α-helix	trans	-70.5	-25.5	179.6	-169	0	0	0	0	113.2	G558 L559	G558-S561 WeakPolarHBondContact O-CB 3.38Å; G558-S561 PolarHBondContact O-N 2.82Å; L559-S561 PolarHBondContact O-N 2.82Å; L559-S561 VanDerWaalsContact O-N 3.17Å
562	L	90.8	Very high	89.3	Confident	39 Å²	39	54.1 Å²	54.1	20%	0.204	31%	0.314	C	S	.	.	H	α-helix	trans	-82.5	-40.3	171.9	-61.4	-172.5	0	0	0	110.8	W541 I544 L559 P560 H564 S565 G566	W541-L562 HydrophobicContact CD2-CB 4.37Å; W541-L562 HydrophobicContact CD2-CD1 3.99Å; W541-L562 HydrophobicContact CE3-CD1 4.31Å; W541-L562 HydrophobicContact CG-CD1 4.29Å; W541-L562 HydrophobicContact CH2-CB 3.74Å; W541-L562 HydrophobicContact CZ2-CB 3.4Å; W541-L562 VanDerWaalsContact CZ2-CB 3.4Å; W541-L562 HydrophobicContact CZ3-CB 4.36Å; I544-L562 HydrophobicContact CD1-CD1 3.72Å; I544-L562 HydrophobicContact CD1-CG 4.39Å; I544-L562 HydrophobicContact CG1-CD1 3.65Å; L559-L562 PolarHBondContact O-N 2.91Å; P560-L562 VanDerWaalsContact C-N 3.31Å; P560-L562 PolarHBondContact O-N 2.83Å; L562-H564 VanDerWaalsContact C-N 3.26Å; L562-H564 PolarHBondContact O-N 2.89Å; L562-S565 WeakPolarHBondContact O-CB 3.08Å; L562-S565 PolarHBondContact O-N 2.9Å; L562-G566 PolarHBondContact O-N 2.88Å
563	V	92.6	Very high	89.6	Confident	0 Å²	0	53 Å²	53	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-59.8	-37.6	174.4	-178.5	0	0	0	0	111.3	W541 L559 P560 S565 G566 I567 H743 D746 L747 C750	W541-V563 HydrophobicContact CH2-CG2 3.89Å; L559-V563 HydrophobicContact CD1-CG2 4.01Å; L559-V563 HydrophobicContact CG-CG2 4.19Å; L559-V563 WeakPolarHBondContact O-CG2 3.15Å; L559-V563 PolarHBondContact O-N 2.93Å; L559-V563 VanDerWaalsContact O-N 3.07Å; P560-V563 PolarHBondContact O-N 2.87Å; V563-S565 VanDerWaalsContact C-N 3.27Å; V563-S565 PolarHBondContact O-N 2.79Å; V563-G566 WeakPolarHBondContact O-CA 3.21Å; V563-G566 PolarHBondContact O-N 3.07Å; V563-I567 HydrophobicContact CG2-CD1 4.45Å; V563-I567 HydrophobicContact CG2-CG1 4.46Å; V563-H743 PolarHBondContact O-NE2 2.78Å; V563-D746 HydrophobicContact CG1-CB 3.99Å; V563-D746 VanDerWaalsContact CG1-O 3.25Å; V563-D746 WeakPolarHBondContact CG1-O 3.31Å; V563-L747 HydrophobicContact CG1-CD2 4.17Å; V563-C750 HydrophobicContact CB-CB 4.31Å; V563-C750 HydrophobicContact CG1-CB 3.75Å; V563-C750 HydrophobicContact CG2-CB 4.29Å
564	H	90.8	Very high	90	Very high	59 Å²	59	50.8 Å²	50.8	27%	0.273	29%	0.29	S	S	.	.	H	α-helix	trans	-58.7	-36.8	173.9	-73.7	-170.6	0	0	0	112.5	P560 L562 G566 H743 E751	P560-H564 WeakPolarHBondContact O-CB 3.23Å; P560-H564 PolarHBondContact O-CD2 2.8Å; P560-H564 PolarHBondContact O-N 2.63Å; L562-H564 VanDerWaalsContact C-N 3.26Å; L562-H564 PolarHBondContact O-N 2.89Å; H564-G566 VanDerWaalsContact C-N 3.27Å; H564-G566 PolarHBondContact O-N 3.31Å; H564-H743 PolarHBondContact O-CE1 2.98Å; H564-H743 PolarHBondContact O-NE2 2.9Å; H564-H743 VanDerWaalsContact O-NE2 3.08Å; H564-E751 IonicContact CD2-OE1 2.75Å; H564-E751 IonicContact CE1-OE1 2.72Å; H564-E751 IonicContact NE2-OE1 3.13Å; H564-E751 PolarHBondContact NE2-OE1 2.94Å
565	S	87.4	Confident	90.3	Very high	87 Å²	87	47 Å²	47	61%	0.608	27%	0.266	S	S	*	.	H	α-helix	trans	-76.8	-9.6	173.8	-60.1	0	0	0	0	114.4	L562 V563	L562-S565 WeakPolarHBondContact O-CB 3.08Å; L562-S565 PolarHBondContact O-N 2.9Å; V563-S565 VanDerWaalsContact C-N 3.27Å; V563-S565 PolarHBondContact O-N 2.79Å
566	G	89.3	Confident	90.6	Very high	14 Å²	14	41.7 Å²	41.7	14%	0.144	25%	0.247	C	C	.	.			trans	99.4	142.1	-176.3	0	0	0	0	0	112.6	L562 V563 H564 H743	L562-G566 PolarHBondContact O-N 2.88Å; V563-G566 WeakPolarHBondContact O-CA 3.21Å; V563-G566 PolarHBondContact O-N 3.07Å; H564-G566 VanDerWaalsContact C-N 3.27Å; H564-G566 PolarHBondContact O-N 3.31Å; G566-H743 WeakPolarHBondContact CA-NE2 3.2Å; G566-H743 PolarHBondContact N-NE2 3.35Å
567	I	91.8	Very high	90.8	Very high	4 Å²	4	43 Å²	43	2%	0.021	25%	0.251	C	S	.	.			trans	-82.6	133.3	174	-56.3	174.8	0	0	0	108.6	W541 V563 L571 R572 V575 L579 D746	W541-I567 HydrophobicContact CH2-CB 4.45Å; W541-I567 HydrophobicContact CH2-CG1 3.72Å; W541-I567 HydrophobicContact CH2-CG2 4.48Å; W541-I567 HydrophobicContact CZ2-CB 4.36Å; W541-I567 HydrophobicContact CZ2-CG1 3.99Å; V563-I567 HydrophobicContact CG2-CD1 4.45Å; V563-I567 HydrophobicContact CG2-CG1 4.46Å; I567-L571 HydrophobicContact CG2-CB 4.22Å; I567-R572 HydrophobicContact CB-CG 3.92Å; I567-R572 HydrophobicContact CG2-CG 3.73Å; I567-R572 PolarHBondContact O-NE 3.45Å; I567-R572 PolarHBondContact O-NH1 2.86Å; I567-R572 PolarHBondContact O-NH2 3.18Å; I567-R572 VanDerWaalsContact O-NH2 3.09Å; I567-V575 HydrophobicContact CD1-CB 4.11Å; I567-V575 HydrophobicContact CD1-CG1 3.54Å; I567-V575 HydrophobicContact CG1-CG1 4.39Å; I567-V575 HydrophobicContact CG2-CB 4.17Å; I567-V575 HydrophobicContact CG2-CG2 4.19Å; I567-L579 HydrophobicContact CD1-CD1 4.3Å; I567-D746 HydrophobicContact CD1-CB 3.69Å; I567-D746 WeakPolarHBondContact CD1-OD1 3.48Å; I567-D746 HydrophobicContact CG1-CB 3.85Å; I567-D746 PolarHBondContact N-OD2 3.18Å
568	P	89.8	Confident	91.1	Very high	15 Å²	15	34.5 Å²	34.5	10%	0.097	22%	0.215	C	C	.	.			trans	-59.1	138	172.1	-27.4	36.6	0	0	0	112.4	C533 I537 W541 P570 L571 R572	C533-P568 HydrophobicContact CB-CB 4.36Å; C533-P568 VanDerWaalsContact SG-CB 3.59Å; I537-P568 HydrophobicContact CG2-CG 3.83Å; W541-P568 HydrophobicContact CG-CG 4.39Å; W541-P568 VanDerWaalsContact NE1-CD 3.3Å; P568-P570 VanDerWaalsContact C-CD 3.45Å; P568-L571 HydrophobicContact CB-CD1 4.24Å; P568-L571 HydrophobicContact CB-CG 4.3Å; P568-L571 HydrophobicContact CG-CD1 4.11Å; P568-L571 PolarHBondContact O-N 3.04Å; P568-R572 PolarHBondContact O-N 2.83Å
569	E	86	Confident	91.4	Very high	38 Å²	38	32.8 Å²	32.8	18%	0.178	20%	0.196	C	C	.	.	H	α-helix	trans	-47.2	-48	-178.4	-165.7	79.2	156.1	0	0	113.6	V529 L571 R572 H661 F742	V529-E569 HydrophobicContact CG1-CG 4.39Å; V529-E569 WeakPolarHBondContact CG1-OE1 3.32Å; E569-L571 PolarHBondContact O-N 2.77Å; E569-L571 VanDerWaalsContact O-N 3.11Å; E569-R572 PolarHBondContact O-N 3.41Å; E569-R572 IonicContact OE2-CZ 2.64Å; E569-R572 IonicContact OE2-NH1 2.74Å; E569-R572 PolarHBondContact OE2-NH1 2.94Å; E569-H661 IonicContact OE1-NE2 3.48Å; E569-H661 IonicContact OE2-NE2 2.7Å; E569-H661 PolarHBondContact OE2-NE2 3.39Å; E569-F742 WeakPolarHBondContact OE1-CE2 3.31Å
570	P	86.2	Confident	91.5	Very high	83 Å²	83	32.8 Å²	32.8	54%	0.539	20%	0.196	S	C	.	.	H	α-helix	trans	-68.3	-14.3	-178	-18.5	34	0	0	0	114.4	P568	P568-P570 VanDerWaalsContact C-CD 3.45Å
571	L	91.3	Very high	91.5	Very high	28 Å²	28	31.6 Å²	31.6	15%	0.147	19%	0.194	C	C	.	.	H	α-helix	trans	-103.3	-12.4	-177.3	-57.8	-178	0	0	0	113	L538 W541 L545 I567 P568 E569 A573 E574 V575	L538-L571 HydrophobicContact CD2-CD1 4.17Å; W541-L571 HydrophobicContact CB-CD1 3.59Å; W541-L571 HydrophobicContact CG-CD1 3.94Å; L545-L571 HydrophobicContact CD1-CD1 4.18Å; L545-L571 HydrophobicContact CD1-CD2 4.22Å; I567-L571 HydrophobicContact CG2-CB 4.22Å; P568-L571 HydrophobicContact CB-CD1 4.24Å; P568-L571 HydrophobicContact CB-CG 4.3Å; P568-L571 HydrophobicContact CG-CD1 4.11Å; P568-L571 PolarHBondContact O-N 3.04Å; E569-L571 PolarHBondContact O-N 2.77Å; E569-L571 VanDerWaalsContact O-N 3.11Å; L571-A573 VanDerWaalsContact C-N 3.3Å; L571-A573 PolarHBondContact O-N 3.47Å; L571-E574 PolarHBondContact O-N 3.38Å; L571-V575 HydrophobicContact CB-CG2 4.27Å; L571-V575 WeakPolarHBondContact O-CB 3.37Å; L571-V575 WeakPolarHBondContact O-CG2 3.47Å; L571-V575 PolarHBondContact O-N 3.2Å
572	R	93.9	Very high	91.2	Very high	19 Å²	19	28 Å²	28	7%	0.072	17%	0.169	C	C	.	.	H	α-helix	trans	-57.4	-42	-179.7	-79.9	-177.3	165.6	121.3	7.2	112.5	I567 P568 E569 E574 V575 W576 H661 D746	I567-R572 HydrophobicContact CB-CG 3.92Å; I567-R572 HydrophobicContact CG2-CG 3.73Å; I567-R572 PolarHBondContact O-NE 3.45Å; I567-R572 PolarHBondContact O-NH1 2.86Å; I567-R572 PolarHBondContact O-NH2 3.18Å; I567-R572 VanDerWaalsContact O-NH2 3.09Å; P568-R572 PolarHBondContact O-N 2.83Å; E569-R572 PolarHBondContact O-N 3.41Å; E569-R572 IonicContact OE2-CZ 2.64Å; E569-R572 IonicContact OE2-NH1 2.74Å; E569-R572 PolarHBondContact OE2-NH1 2.94Å; R572-E574 VanDerWaalsContact C-N 3.31Å; R572-E574 PolarHBondContact O-N 2.87Å; R572-V575 PolarHBondContact O-N 3.36Å; R572-W576 HydrophobicContact CB-CD2 4.25Å; R572-W576 HydrophobicContact CB-CZ2 4.23Å; R572-W576 HydrophobicContact CG-CZ2 4.04Å; R572-W576 WeakPolarHBondContact O-CB 3.42Å; R572-W576 PolarHBondContact O-N 3.17Å; R572-H661 VanDerWaalsContact CB-CD2 3.47Å; R572-H661 WeakPolarHBondContact CB-CD2 3.3Å; R572-H661 VanDerWaalsContact CD-NE2 3.29Å; R572-H661 WeakPolarHBondContact CD-NE2 3.38Å; R572-D746 IonicContact CZ-OD1 3.67Å; R572-D746 IonicContact CZ-OD2 3.63Å; R572-D746 IonicContact NE-OD1 2.72Å; R572-D746 PolarHBondContact NE-OD1 3.23Å; R572-D746 IonicContact NE-OD2 2.7Å; R572-D746 PolarHBondContact NE-OD2 3.19Å; R572-D746 IonicContact NH2-OD1 3.38Å; R572-D746 IonicContact NH2-OD2 3.3Å; R572-D746 PolarHBondContact NH2-OD2 2.8Å
573	A	92.4	Very high	90.4	Very high	30 Å²	30	29.9 Å²	29.9	25%	0.248	18%	0.177	C	C	.	.	H	α-helix	trans	-49.3	-50	176	0	0	0	0	0	112.9	L571 Q577 H661	L571-A573 VanDerWaalsContact C-N 3.3Å; L571-A573 PolarHBondContact O-N 3.47Å; A573-Q577 WeakPolarHBondContact O-CG 3.36Å; A573-Q577 PolarHBondContact O-NE2 2.99Å; A573-H661 WeakPolarHBondContact CB-O 3.32Å
574	E	92.5	Very high	89.1	Confident	68 Å²	68	36 Å²	36	32%	0.318	21%	0.209	S	C	.	.	H	α-helix	trans	-77.3	-51.6	-177.9	-178.9	-174.7	-143.1	0	0	111	L545 H549 L571 R572 W576 Q577 L578	L545-E574 VanDerWaalsContact CD1-OE2 3.32Å; L545-E574 WeakPolarHBondContact CD1-OE2 3.41Å; L545-E574 HydrophobicContact CD2-CG 4.27Å; L545-E574 WeakPolarHBondContact CD2-OE2 3.45Å; H549-E574 IonicContact CE1-OE1 3.2Å; H549-E574 PolarHBondContact CE1-OE1 2.89Å; H549-E574 IonicContact NE2-OE1 2.93Å; L571-E574 PolarHBondContact O-N 3.38Å; R572-E574 VanDerWaalsContact C-N 3.31Å; R572-E574 PolarHBondContact O-N 2.87Å; E574-W576 PolarHBondContact O-N 3.41Å; E574-Q577 PolarHBondContact O-N 2.75Å; E574-L578 HydrophobicContact CG-CD1 3.99Å; E574-L578 WeakPolarHBondContact O-CG 3.24Å; E574-L578 PolarHBondContact O-N 2.84Å
575	V	94.6	Very high	88.6	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.3	-36.5	-174.5	-178.8	0	0	0	0	111.8	W541 L545 W548 I567 L571 R572 L578 L579	W541-V575 HydrophobicContact CE3-CG2 4.33Å; W541-V575 HydrophobicContact CZ3-CG1 4.17Å; W541-V575 HydrophobicContact CZ3-CG2 4.15Å; L545-V575 HydrophobicContact CD2-CG2 3.99Å; W548-V575 HydrophobicContact CZ3-CG1 4.39Å; I567-V575 HydrophobicContact CD1-CB 4.11Å; I567-V575 HydrophobicContact CD1-CG1 3.54Å; I567-V575 HydrophobicContact CG1-CG1 4.39Å; I567-V575 HydrophobicContact CG2-CB 4.17Å; I567-V575 HydrophobicContact CG2-CG2 4.19Å; L571-V575 HydrophobicContact CB-CG2 4.27Å; L571-V575 WeakPolarHBondContact O-CB 3.37Å; L571-V575 WeakPolarHBondContact O-CG2 3.47Å; L571-V575 PolarHBondContact O-N 3.2Å; R572-V575 PolarHBondContact O-N 3.36Å; V575-L578 PolarHBondContact O-N 2.87Å; V575-L579 HydrophobicContact CG1-CD1 3.93Å; V575-L579 HydrophobicContact CG1-CG 4.18Å; V575-L579 WeakPolarHBondContact O-CB 3.32Å; V575-L579 VanDerWaalsContact O-CG 3.24Å; V575-L579 WeakPolarHBondContact O-CG 3.27Å; V575-L579 PolarHBondContact O-N 3.46Å
576	W	96.2	Very high	88.4	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.2	-42	176.2	-69.4	1.6	0	0	0	111.7	R572 E574 L579 A580 V657 L658 H661 M662 F742 T745 D746 L749	R572-W576 HydrophobicContact CB-CD2 4.25Å; R572-W576 HydrophobicContact CB-CZ2 4.23Å; R572-W576 HydrophobicContact CG-CZ2 4.04Å; R572-W576 WeakPolarHBondContact O-CB 3.42Å; R572-W576 PolarHBondContact O-N 3.17Å; E574-W576 PolarHBondContact O-N 3.41Å; W576-L579 PolarHBondContact O-N 2.84Å; W576-A580 VanDerWaalsContact O-CB 3.23Å; W576-A580 WeakPolarHBondContact O-CB 3.42Å; W576-A580 PolarHBondContact O-N 3.49Å; W576-V657 HydrophobicContact CH2-CG1 3.83Å; W576-V657 HydrophobicContact CZ3-CG1 4.06Å; W576-L658 HydrophobicContact CE3-CD2 3.84Å; W576-L658 HydrophobicContact CZ3-CD2 4.06Å; W576-H661 HydrophobicContact CE3-CB 4.38Å; W576-H661 AromaticContact CH2-CE1 3.42Å; W576-H661 VanDerWaalsContact CH2-CE1 3.42Å; W576-H661 WeakPolarHBondContact CH2-CE1 3.45Å; W576-H661 AromaticContact CH2-CG 4Å; W576-H661 AromaticContact CH2-ND1 3.42Å; W576-H661 WeakPolarHBondContact CH2-ND1 3.21Å; W576-H661 AromaticContact CH2-NE2 3.98Å; W576-H661 HydrophobicContact CZ3-CB 4.12Å; W576-H661 AromaticContact CZ3-CE1 3.86Å; W576-H661 AromaticContact CZ3-CG 3.75Å; W576-H661 AromaticContact CZ3-ND1 3.33Å; W576-H661 VanDerWaalsContact CZ3-ND1 3.33Å; W576-H661 WeakPolarHBondContact CZ3-ND1 3.35Å; W576-M662 HydrophobicContact CB-CE 4.24Å; W576-M662 HydrophobicContact CE3-CE 3.82Å; W576-F742 HydrophobicContact CZ2-CB 4.43Å; W576-T745 HydrophobicContact CD2-CG2 3.86Å; W576-T745 HydrophobicContact CE3-CG2 3.98Å; W576-T745 HydrophobicContact CH2-CG2 3.72Å; W576-T745 HydrophobicContact CZ2-CG2 3.57Å; W576-T745 HydrophobicContact CZ3-CG2 3.93Å; W576-D746 PolarHBondContact NE1-OD1 3.16Å; W576-L749 HydrophobicContact CB-CD1 3.55Å; W576-L749 HydrophobicContact CD2-CD1 4.16Å; W576-L749 HydrophobicContact CG-CD1 3.57Å
577	Q	94.2	Very high	88.3	Confident	43 Å²	43	42.9 Å²	42.9	20%	0.201	23%	0.233	C	C	.	.	H	α-helix	trans	-65.3	-39.2	174.6	-72.5	178.3	85.4	0	0	112.1	A573 E574 G581 C582 M662 V670	A573-Q577 WeakPolarHBondContact O-CG 3.36Å; A573-Q577 PolarHBondContact O-NE2 2.99Å; E574-Q577 PolarHBondContact O-N 2.75Å; Q577-G581 PolarHBondContact O-N 3.28Å; Q577-C582 HydrophobicContact CB-CB 4.18Å; Q577-C582 HydrophobicContact CG-CB 4.31Å; Q577-C582 PolarHBondContact O-N 2.86Å; Q577-M662 HydrophobicContact CG-SD 4.04Å; Q577-V670 HydrophobicContact CG-CG2 3.89Å
578	L	93.6	Very high	88.2	Confident	15 Å²	15	43.2 Å²	43.2	8%	0.079	24%	0.235	C	C	.	.	H	α-helix	trans	-66.4	-40.5	174.5	-70.8	175.3	0	0	0	112.5	L545 W548 L552 E574 V575	L545-L578 HydrophobicContact CD2-CD1 3.81Å; W548-L578 HydrophobicContact CD2-CB 4.29Å; W548-L578 HydrophobicContact CD2-CD1 4.18Å; W548-L578 HydrophobicContact CE3-CB 4.25Å; W548-L578 HydrophobicContact CE3-CD1 4.04Å; W548-L578 HydrophobicContact CH2-CB 3.65Å; W548-L578 HydrophobicContact CZ2-CB 3.71Å; W548-L578 WeakPolarHBondContact CZ2-O 3.47Å; W548-L578 HydrophobicContact CZ3-CB 3.94Å; W548-L578 HydrophobicContact CZ3-CD1 4.39Å; L552-L578 HydrophobicContact CD2-CD2 3.5Å; E574-L578 HydrophobicContact CG-CD1 3.99Å; E574-L578 WeakPolarHBondContact O-CG 3.24Å; E574-L578 PolarHBondContact O-N 2.84Å; V575-L578 PolarHBondContact O-N 2.87Å
579	L	94.3	Very high	88.2	Confident	6 Å²	6	43.6 Å²	43.6	3%	0.031	24%	0.236	C	C	.	.	H	α-helix	trans	-66.4	-42.9	174.8	-75.2	170.6	0	0	0	111.6	W548 R555 L559 I567 V575 W576 G581 Y678 L749 C750	W548-L579 HydrophobicContact CH2-CD2 3.76Å; W548-L579 HydrophobicContact CH2-CG 3.9Å; R555-L579 PolarHBondContact NH2-O 3.45Å; L559-L579 HydrophobicContact CD2-CD2 4.04Å; I567-L579 HydrophobicContact CD1-CD1 4.3Å; V575-L579 HydrophobicContact CG1-CD1 3.93Å; V575-L579 HydrophobicContact CG1-CG 4.18Å; V575-L579 WeakPolarHBondContact O-CB 3.32Å; V575-L579 VanDerWaalsContact O-CG 3.24Å; V575-L579 WeakPolarHBondContact O-CG 3.27Å; V575-L579 PolarHBondContact O-N 3.46Å; W576-L579 PolarHBondContact O-N 2.84Å; L579-G581 VanDerWaalsContact C-N 3.3Å; L579-G581 PolarHBondContact O-N 2.73Å; L579-Y678 PolarHBondContact O-OH 3.33Å; L579-L749 HydrophobicContact CB-CB 3.74Å; L579-L749 HydrophobicContact CD1-CB 3.73Å; L579-L749 HydrophobicContact CG-CB 4.34Å; L579-C750 HydrophobicContact CD1-CB 4.47Å; L579-C750 HydrophobicContact CD2-CB 4.28Å
580	A	93.3	Very high	88.5	Confident	3 Å²	3	46.5 Å²	46.5	3%	0.025	25%	0.25	C	C	.	.	H	α-helix	trans	-75.4	-12.7	179.3	0	0	0	0	0	114.3	W576 V670 K673 L749	W576-A580 VanDerWaalsContact O-CB 3.23Å; W576-A580 WeakPolarHBondContact O-CB 3.42Å; W576-A580 PolarHBondContact O-N 3.49Å; A580-V670 HydrophobicContact CB-CG1 4.17Å; A580-V670 HydrophobicContact CB-CG2 4.34Å; A580-K673 HydrophobicContact CB-CB 4.18Å; A580-K673 HydrophobicContact CB-CG 4.34Å; A580-K673 WeakPolarHBondContact O-CD 3.49Å; A580-L749 HydrophobicContact CB-CD2 4.35Å
581	G	90	Very high	88.8	Confident	32 Å²	32	46.7 Å²	46.7	33%	0.33	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	39.7	-176.1	0	0	0	0	0	112.8	Q577 L579	Q577-G581 PolarHBondContact O-N 3.28Å; L579-G581 VanDerWaalsContact C-N 3.3Å; L579-G581 PolarHBondContact O-N 2.73Å
582	C	84.5	Confident	89	Confident	6 Å²	6	45.4 Å²	45.4	4%	0.041	24%	0.237	C	C	.	.			trans	-96.1	2	-179.7	-70.3	0	0	0	0	114.5	Q577 D584 V670 K673	Q577-C582 HydrophobicContact CB-CB 4.18Å; Q577-C582 HydrophobicContact CG-CB 4.31Å; Q577-C582 PolarHBondContact O-N 2.86Å; C582-D584 PolarHBondContact O-N 3Å; C582-V670 HydrophobicContact CB-CG2 4.23Å; C582-K673 WeakPolarHBondContact SG-CG 3.44Å
583	H	73.6	Confident	89.1	Confident	78 Å²	78	49.7 Å²	49.7	36%	0.361	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	127.1	-179.4	54.1	-96.1	0	0	0	111.1	N585	H583-N585 PolarHBondContact O-N 2.65Å; H583-N585 VanDerWaalsContact O-N 3.14Å
584	D	65.6	Low	89.2	Confident	128 Å²	128	52.7 Å²	52.7	68%	0.684	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	32.7	175.5	-50.1	-32.5	0	0	0	115.7	C582 H586	C582-D584 PolarHBondContact O-N 3Å; D584-H586 PolarHBondContact O-CD2 2.86Å; D584-H586 PolarHBondContact O-N 3.23Å
585	N	80.1	Confident	89.4	Confident	45 Å²	45	49.9 Å²	49.9	24%	0.241	25%	0.251	C	S	.	.			trans	-75.8	60.9	-178.1	-168.7	13.7	0	0	0	113.4	H583 D587 L588 L589	H583-N585 PolarHBondContact O-N 2.65Å; H583-N585 VanDerWaalsContact O-N 3.14Å; N585-D587 VanDerWaalsContact C-N 3.29Å; N585-D587 PolarHBondContact O-N 3.43Å; N585-L588 VanDerWaalsContact ND2-CB 3.33Å; N585-L588 WeakPolarHBondContact ND2-CB 3.27Å; N585-L588 WeakPolarHBondContact ND2-CD2 3.4Å; N585-L588 PolarHBondContact O-N 2.69Å; N585-L588 VanDerWaalsContact O-N 3.14Å; N585-L589 PolarHBondContact O-N 3.31Å
586	H	82.8	Confident	89.5	Confident	132 Å²	132	52.5 Å²	52.5	61%	0.611	27%	0.265	S	S	*	.	H	α-helix	trans	-53.8	-37.8	-175.2	-76.5	-68.9	0	0	0	114.5	D584 L588 L589 E590	D584-H586 PolarHBondContact O-CD2 2.86Å; D584-H586 PolarHBondContact O-N 3.23Å; H586-L588 VanDerWaalsContact C-N 3.29Å; H586-L588 PolarHBondContact O-N 2.87Å; H586-L589 PolarHBondContact O-N 3.28Å; H586-E590 PolarHBondContact O-N 2.97Å
587	D	88.4	Confident	89.5	Confident	127 Å²	127	57.7 Å²	57.7	68%	0.679	30%	0.296	S	S	*	.	H	α-helix	trans	-60.8	-38.8	-179.6	-66.7	-25.5	0	0	0	111.9	N585 Q591	N585-D587 VanDerWaalsContact C-N 3.29Å; N585-D587 PolarHBondContact O-N 3.43Å; D587-Q591 WeakPolarHBondContact O-CB 3.19Å; D587-Q591 VanDerWaalsContact O-CG 3.22Å; D587-Q591 WeakPolarHBondContact O-CG 3.33Å; D587-Q591 PolarHBondContact O-N 2.81Å
588	L	89.1	Confident	89.4	Confident	12 Å²	12	60.1 Å²	60.1	6%	0.063	31%	0.306	C	S	.	.	H	α-helix	trans	-80.4	-29.2	-179	-166.4	61.4	0	0	0	112.4	N585 H586 Y592 Y641 F668 C669 V672	N585-L588 VanDerWaalsContact ND2-CB 3.33Å; N585-L588 WeakPolarHBondContact ND2-CB 3.27Å; N585-L588 WeakPolarHBondContact ND2-CD2 3.4Å; N585-L588 PolarHBondContact O-N 2.69Å; N585-L588 VanDerWaalsContact O-N 3.14Å; H586-L588 VanDerWaalsContact C-N 3.29Å; H586-L588 PolarHBondContact O-N 2.87Å; L588-Y592 WeakPolarHBondContact O-CB 3.43Å; L588-Y592 PolarHBondContact O-N 2.8Å; L588-Y641 HydrophobicContact CD1-CE2 3.76Å; L588-F668 HydrophobicContact CD1-CE1 3.85Å; L588-F668 HydrophobicContact CG-CD1 4.41Å; L588-F668 HydrophobicContact CG-CE1 3.95Å; L588-C669 HydrophobicContact CD2-CB 4.08Å; L588-V672 HydrophobicContact CD2-CB 4.12Å; L588-V672 HydrophobicContact CD2-CG1 4.09Å
589	L	90.3	Very high	89.4	Confident	22 Å²	22	65.7 Å²	65.7	12%	0.115	34%	0.336	C	S	.	.	H	α-helix	trans	-66.6	-42.4	171.3	-61.7	172	0	0	0	111.3	N585 H586 Y592 R593 E665	N585-L589 PolarHBondContact O-N 3.31Å; H586-L589 PolarHBondContact O-N 3.28Å; L589-Y592 WeakPolarHBondContact O-CB 3.31Å; L589-Y592 PolarHBondContact O-N 3.44Å; L589-R593 PolarHBondContact O-N 2.86Å; L589-E665 HydrophobicContact CD2-CB 3.48Å; L589-E665 VanDerWaalsContact CD2-CB 3.48Å
590	E	91.3	Very high	89.4	Confident	99 Å²	99	66.2 Å²	66.2	46%	0.463	34%	0.34	S	S	.	.	H	α-helix	trans	-73.2	-35.9	177.8	-165.4	63.8	-170.9	0	0	111.8	H586 Y592 R593 I594	H586-E590 PolarHBondContact O-N 2.97Å; E590-Y592 VanDerWaalsContact C-N 3.32Å; E590-Y592 PolarHBondContact O-N 3.07Å; E590-R593 PolarHBondContact O-N 3.13Å; E590-R593 IonicContact OE2-CZ 2.6Å; E590-R593 IonicContact OE2-NH1 2.94Å; E590-R593 PolarHBondContact OE2-NH1 3.16Å; E590-I594 WeakPolarHBondContact O-CG1 3.11Å; E590-I594 PolarHBondContact O-N 3.32Å
591	Q	93.3	Very high	89.2	Confident	87 Å²	87	71.2 Å²	71.2	41%	0.407	38%	0.382	S	S	.	.	H	α-helix	trans	-59.5	-42.3	168.3	-76.3	172.8	24.5	0	0	111.9	D587 R593 I594 L595	D587-Q591 WeakPolarHBondContact O-CB 3.19Å; D587-Q591 VanDerWaalsContact O-CG 3.22Å; D587-Q591 WeakPolarHBondContact O-CG 3.33Å; D587-Q591 PolarHBondContact O-N 2.81Å; Q591-R593 VanDerWaalsContact C-N 3.32Å; Q591-R593 PolarHBondContact O-N 2.88Å; Q591-I594 PolarHBondContact O-N 3.29Å; Q591-I594 VanDerWaalsContact O-N 3.09Å; Q591-L595 HydrophobicContact CB-CD1 4.3Å; Q591-L595 WeakPolarHBondContact O-CB 3.45Å; Q591-L595 WeakPolarHBondContact O-CD1 3.42Å; Q591-L595 WeakPolarHBondContact O-CG 3.12Å; Q591-L595 PolarHBondContact O-N 3.25Å
592	Y	96.2	Very high	89.4	Confident	1 Å²	1	72.3 Å²	72.3	0%	0.004	38%	0.378	C	S	.	.	H	α-helix	trans	-55	-46.5	177.9	-178	-109.6	0	0	0	112.3	L588 L589 E590 I594 L595 I596 K633 I634 A637 E664 E665 F668	L588-Y592 WeakPolarHBondContact O-CB 3.43Å; L588-Y592 PolarHBondContact O-N 2.8Å; L589-Y592 WeakPolarHBondContact O-CB 3.31Å; L589-Y592 PolarHBondContact O-N 3.44Å; E590-Y592 VanDerWaalsContact C-N 3.32Å; E590-Y592 PolarHBondContact O-N 3.07Å; Y592-I594 VanDerWaalsContact C-N 3.26Å; Y592-I594 PolarHBondContact O-N 2.8Å; Y592-L595 PolarHBondContact O-N 2.88Å; Y592-I596 HydrophobicContact CD1-CG2 4.43Å; Y592-I596 HydrophobicContact CD2-CG2 4.3Å; Y592-I596 HydrophobicContact CE1-CG2 3.9Å; Y592-I596 HydrophobicContact CE2-CG2 3.78Å; Y592-I596 PolarHBondContact O-N 3.12Å; Y592-K633 VanDerWaalsContact OH-CB 3.27Å; Y592-K633 WeakPolarHBondContact OH-CB 3.35Å; Y592-I634 PolarHBondContact OH-N 3.39Å; Y592-A637 HydrophobicContact CD2-CB 3.64Å; Y592-A637 HydrophobicContact CE2-CB 3.43Å; Y592-A637 VanDerWaalsContact CE2-CB 3.43Å; Y592-E664 HydrophobicContact CE1-CG 4.09Å; Y592-E664 WeakPolarHBondContact CE1-OE1 3.19Å; Y592-E664 VanDerWaalsContact OH-CG 3.28Å; Y592-E664 WeakPolarHBondContact OH-CG 3.46Å; Y592-E664 PolarHBondContact OH-OE1 2.96Å; Y592-E665 HydrophobicContact CD1-CB 4.21Å; Y592-E665 HydrophobicContact CD1-CG 3.99Å; Y592-E665 HydrophobicContact CE1-CG 4.28Å; Y592-F668 HydrophobicContact CD2-CB 3.64Å; Y592-F668 AromaticContact CD2-CD1 3.36Å; Y592-F668 HydrophobicContact CD2-CD1 3.36Å; Y592-F668 AromaticContact CD2-CD2 3.59Å; Y592-F668 HydrophobicContact CD2-CD2 3.59Å; Y592-F668 AromaticContact CD2-CE1 3.83Å; Y592-F668 HydrophobicContact CD2-CE1 3.83Å; Y592-F668 HydrophobicContact CD2-CE2 4.04Å; Y592-F668 AromaticContact CD2-CG 3.22Å; Y592-F668 HydrophobicContact CD2-CG 3.22Å; Y592-F668 HydrophobicContact CD2-CZ 4.15Å; Y592-F668 HydrophobicContact CE2-CB 3.67Å; Y592-F668 HydrophobicContact CE2-CD1 4.24Å; Y592-F668 AromaticContact CE2-CD2 3.79Å; Y592-F668 HydrophobicContact CE2-CD2 3.79Å; Y592-F668 HydrophobicContact CE2-CE2 4.5Å; Y592-F668 AromaticContact CE2-CG 3.64Å; Y592-F668 HydrophobicContact CE2-CG 3.64Å; Y592-F668 HydrophobicContact CG-CB 4.33Å; Y592-F668 AromaticContact CG-CD1 3.84Å; Y592-F668 HydrophobicContact CG-CD1 3.84Å; Y592-F668 HydrophobicContact CG-CE1 4.33Å; Y592-F668 HydrophobicContact CG-CG 4.08Å
593	R	94.9	Very high	89.7	Confident	109 Å²	109	74.6 Å²	74.6	41%	0.411	39%	0.388	S	S	.	.	H	α-helix	trans	-61.5	-31	177.8	-66.2	172.4	-171.9	147.6	5.2	113.7	L589 E590 Q591 I596 E665	L589-R593 PolarHBondContact O-N 2.86Å; E590-R593 PolarHBondContact O-N 3.13Å; E590-R593 IonicContact OE2-CZ 2.6Å; E590-R593 IonicContact OE2-NH1 2.94Å; E590-R593 PolarHBondContact OE2-NH1 3.16Å; Q591-R593 VanDerWaalsContact C-N 3.32Å; Q591-R593 PolarHBondContact O-N 2.88Å; R593-I596 WeakPolarHBondContact O-CG1 3.28Å; R593-E665 IonicContact CZ-OE1 2.85Å; R593-E665 IonicContact CZ-OE2 2.78Å; R593-E665 IonicContact NE-OE1 3.96Å; R593-E665 PolarHBondContact NE-OE1 3.28Å; R593-E665 VanDerWaalsContact NH2-CD 3.3Å; R593-E665 IonicContact NH2-OE1 3.01Å; R593-E665 PolarHBondContact NH2-OE1 2.69Å; R593-E665 IonicContact NH2-OE2 3.99Å; R593-E665 PolarHBondContact NH2-OE2 3.11Å
594	I	95.6	Very high	90.5	Very high	93 Å²	93	75.5 Å²	75.5	48%	0.477	40%	0.403	S	S	.	.	H	α-helix	trans	-81.6	-27.8	175.4	-62.3	166	0	0	0	111.4	E590 Q591 Y592 T597	E590-I594 WeakPolarHBondContact O-CG1 3.11Å; E590-I594 PolarHBondContact O-N 3.32Å; Q591-I594 PolarHBondContact O-N 3.29Å; Q591-I594 VanDerWaalsContact O-N 3.09Å; Y592-I594 VanDerWaalsContact C-N 3.26Å; Y592-I594 PolarHBondContact O-N 2.8Å; I594-T597 PolarHBondContact O-OG1 3.33Å
595	L	96.3	Very high	91.8	Very high	10 Å²	10	71.3 Å²	71.3	5%	0.052	38%	0.383	C	S	.	.	H	α-helix	trans	-77.8	-37.8	-179.7	-71.8	159.6	0	0	0	112.5	Q591 Y592 T597 K598 A637 V640 Y641 F668	Q591-L595 HydrophobicContact CB-CD1 4.3Å; Q591-L595 WeakPolarHBondContact O-CB 3.45Å; Q591-L595 WeakPolarHBondContact O-CD1 3.42Å; Q591-L595 WeakPolarHBondContact O-CG 3.12Å; Q591-L595 PolarHBondContact O-N 3.25Å; Y592-L595 PolarHBondContact O-N 2.88Å; L595-T597 PolarHBondContact O-N 3.42Å; L595-K598 PolarHBondContact O-N 2.85Å; L595-K598 VanDerWaalsContact O-N 3.13Å; L595-A637 HydrophobicContact CB-CB 3.79Å; L595-V640 HydrophobicContact CD2-CB 4.04Å; L595-V640 HydrophobicContact CD2-CG1 3.87Å; L595-Y641 HydrophobicContact CD1-CD2 3.9Å; L595-Y641 HydrophobicContact CD1-CG 4.43Å; L595-F668 HydrophobicContact CD1-CE1 4.4Å; L595-F668 HydrophobicContact CD1-CZ 3.81Å
596	I	96.1	Very high	92.6	Very high	55 Å²	55	69.2 Å²	69.2	28%	0.282	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-21.2	176.4	60.8	175.6	0	0	0	113.2	Y592 R593 K633 A637	Y592-I596 HydrophobicContact CD1-CG2 4.43Å; Y592-I596 HydrophobicContact CD2-CG2 4.3Å; Y592-I596 HydrophobicContact CE1-CG2 3.9Å; Y592-I596 HydrophobicContact CE2-CG2 3.78Å; Y592-I596 PolarHBondContact O-N 3.12Å; R593-I596 WeakPolarHBondContact O-CG1 3.28Å; I596-K633 HydrophobicContact CG2-CB 3.97Å; I596-K633 HydrophobicContact CG2-CG 4.5Å; I596-A637 HydrophobicContact CG2-CB 4.03Å
597	T	95.4	Very high	93.1	Very high	109 Å²	109	65.4 Å²	65.4	67%	0.669	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	6.1	175.2	62.3	0	0	0	0	114.1	I594 L595	I594-T597 PolarHBondContact O-OG1 3.33Å; L595-T597 PolarHBondContact O-N 3.42Å
598	K	93.7	Very high	93.4	Very high	93 Å²	93	66 Å²	66	40%	0.404	35%	0.35	S	S	.	.	S	Bend	trans	-107.2	142.7	173.8	-68.7	177.5	178.2	-175.5	0	110	L595 K636 V640	L595-K598 PolarHBondContact O-N 2.85Å; L595-K598 VanDerWaalsContact O-N 3.13Å; K598-K636 WeakPolarHBondContact O-CE 3.4Å; K598-V640 HydrophobicContact CB-CG1 3.98Å; K598-V640 HydrophobicContact CD-CG1 3.48Å; K598-V640 VanDerWaalsContact CD-CG1 3.48Å; K598-V640 HydrophobicContact CG-CG1 4.43Å
599	D	92.3	Very high	93.6	Very high	133 Å²	133	65.4 Å²	65.4	71%	0.711	35%	0.347	S	S	*	.			trans	-79.6	154.7	177.5	-62	-45.3	0	0	0	113.4	K636	D599-K636 IonicContact OD1-NZ 2.74Å; D599-K636 PolarHBondContact OD1-NZ 2.95Å
600	S	93.9	Very high	93.8	Very high	16 Å²	16	64.7 Å²	64.7	11%	0.112	34%	0.343	C	S	.	.			trans	-120.2	133.2	-177.4	173.2	0	0	0	0	111.7	Q602 E603 S639	S600-Q602 PolarHBondContact O-N 3.31Å; S600-Q602 PolarHBondContact OG-N 3.41Å; S600-Q602 VanDerWaalsContact OG-N 3.16Å; S600-E603 PolarHBondContact N-OE1 3.41Å; S600-E603 WeakPolarHBondContact O-CG 3.48Å; S600-S639 VanDerWaalsContact CB-OG 3.25Å; S600-S639 WeakPolarHBondContact CB-OG 3.44Å; S600-S639 PolarHBondContact OG-OG 3.21Å
601	A	90.8	Very high	93.8	Very high	109 Å²	109	64.9 Å²	64.9	90%	0.901	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-4	172.7	0	0	0	0	0	113.8
602	Q	92.5	Very high	93.7	Very high	54 Å²	54	65.9 Å²	65.9	25%	0.252	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	10.1	-172.5	-61.7	-179.7	-76.6	0	0	114.3	S600 S604 V605 I606 G646 Y647	S600-Q602 PolarHBondContact O-N 3.31Å; S600-Q602 PolarHBondContact OG-N 3.41Å; S600-Q602 VanDerWaalsContact OG-N 3.16Å; Q602-S604 VanDerWaalsContact C-N 3.3Å; Q602-S604 PolarHBondContact O-N 3.26Å; Q602-V605 WeakPolarHBondContact O-CA 3.42Å; Q602-V605 WeakPolarHBondContact O-CB 3.5Å; Q602-V605 PolarHBondContact O-N 3.48Å; Q602-I606 HydrophobicContact CB-CD1 4.36Å; Q602-I606 WeakPolarHBondContact O-CG1 3.39Å; Q602-I606 PolarHBondContact O-N 3.46Å; Q602-G646 VanDerWaalsContact OE1-CA 3.29Å; Q602-Y647 PolarHBondContact NE2-O 2.81Å
603	E	92.1	Very high	93.6	Very high	54 Å²	54	65.9 Å²	65.9	25%	0.252	34%	0.344	S	S	.	.	H	α-helix	trans	-53.4	-42.9	-175.5	-70.8	175.2	-163.2	0	0	113.2	S600 V605 I606 T607 Y632 K636	S600-E603 PolarHBondContact N-OE1 3.41Å; S600-E603 WeakPolarHBondContact O-CG 3.48Å; E603-V605 PolarHBondContact O-N 2.66Å; E603-I606 PolarHBondContact O-N 2.72Å; E603-I606 VanDerWaalsContact O-N 3.09Å; E603-T607 PolarHBondContact O-N 2.82Å; E603-T607 PolarHBondContact O-OG1 3.15Å; E603-T607 VanDerWaalsContact O-OG1 3.11Å; E603-Y632 HydrophobicContact CG-CE2 4.42Å; E603-Y632 VanDerWaalsContact CG-OH 3.31Å; E603-Y632 WeakPolarHBondContact CG-OH 3.39Å; E603-Y632 PolarHBondContact OE2-OH 2.96Å; E603-K636 HydrophobicContact CG-CD 4.42Å; E603-K636 WeakPolarHBondContact OE1-CE 3.27Å; E603-K636 IonicContact OE1-NZ 3.76Å; E603-K636 PolarHBondContact OE1-NZ 2.87Å; E603-K636 IonicContact OE2-NZ 3.22Å
604	S	91	Very high	93.4	Very high	97 Å²	97	60.7 Å²	60.7	68%	0.678	33%	0.325	S	S	*	.	H	α-helix	trans	-61.6	-27.1	176	62.9	0	0	0	0	114.3	Q602 R608	Q602-S604 VanDerWaalsContact C-N 3.3Å; Q602-S604 PolarHBondContact O-N 3.26Å; S604-R608 WeakPolarHBondContact O-CB 3.38Å
605	V	92.9	Very high	93	Very high	41 Å²	41	58.9 Å²	58.9	25%	0.248	32%	0.319	C	S	.	.	H	α-helix	trans	-80.4	-40.3	174.6	-175.7	0	0	0	0	110.4	Q602 E603 D609 Y647	Q602-V605 WeakPolarHBondContact O-CA 3.42Å; Q602-V605 WeakPolarHBondContact O-CB 3.5Å; Q602-V605 PolarHBondContact O-N 3.48Å; E603-V605 PolarHBondContact O-N 2.66Å; V605-D609 PolarHBondContact O-N 3.46Å; V605-Y647 HydrophobicContact CG1-CD1 4.04Å; V605-Y647 HydrophobicContact CG1-CE1 4.15Å
606	I	96.4	Very high	92.2	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-63.8	-55.4	178.4	-66.9	164.5	0	0	0	110.4	Q602 E603 R608 D609 I610 Y632 C635 Y647	Q602-I606 HydrophobicContact CB-CD1 4.36Å; Q602-I606 WeakPolarHBondContact O-CG1 3.39Å; Q602-I606 PolarHBondContact O-N 3.46Å; E603-I606 PolarHBondContact O-N 2.72Å; E603-I606 VanDerWaalsContact O-N 3.09Å; I606-R608 VanDerWaalsContact C-N 3.31Å; I606-R608 PolarHBondContact O-N 3.48Å; I606-D609 WeakPolarHBondContact O-CA 3.46Å; I606-D609 WeakPolarHBondContact O-CB 3.34Å; I606-D609 PolarHBondContact O-N 3.06Å; I606-I610 HydrophobicContact CG2-CD1 3.68Å; I606-I610 HydrophobicContact CG2-CG1 4.43Å; I606-I610 WeakPolarHBondContact O-CG1 3.38Å; I606-I610 PolarHBondContact O-N 3.05Å; I606-Y632 HydrophobicContact CG2-CD2 3.85Å; I606-Y632 HydrophobicContact CG2-CE2 4.28Å; I606-C635 HydrophobicContact CD1-CB 4.49Å; I606-C635 HydrophobicContact CG1-CB 4.32Å; I606-C635 HydrophobicContact CG2-CB 3.58Å; I606-Y647 HydrophobicContact CD1-CG 4.22Å; I606-Y647 HydrophobicContact CG1-CD1 3.73Å; I606-Y647 HydrophobicContact CG1-CD2 3.88Å; I606-Y647 HydrophobicContact CG1-CE1 4.3Å; I606-Y647 HydrophobicContact CG1-CE2 4.43Å; I606-Y647 HydrophobicContact CG1-CG 3.51Å
607	T	93.8	Very high	91.7	Very high	53 Å²	53	60.6 Å²	60.6	33%	0.325	33%	0.334	S	S	.	.	H	α-helix	trans	-57.1	-43	-179.4	-54.7	0	0	0	0	112	E603 D609 I610 H611	E603-T607 PolarHBondContact O-N 2.82Å; E603-T607 PolarHBondContact O-OG1 3.15Å; E603-T607 VanDerWaalsContact O-OG1 3.11Å; T607-D609 VanDerWaalsContact C-N 3.27Å; T607-D609 PolarHBondContact O-N 3.42Å; T607-I610 PolarHBondContact O-N 3.04Å; T607-H611 PolarHBondContact O-N 3.06Å; T607-H611 VanDerWaalsContact O-N 3.11Å
608	R	93.1	Very high	91.3	Very high	138 Å²	138	60.9 Å²	60.9	52%	0.521	33%	0.331	S	S	.	.	H	α-helix	trans	-63.6	-30.3	176	-174.9	-174	64.9	-172.1	-4.9	113.1	S604 I606 R612	S604-R608 WeakPolarHBondContact O-CB 3.38Å; I606-R608 VanDerWaalsContact C-N 3.31Å; I606-R608 PolarHBondContact O-N 3.48Å; R608-R612 WeakPolarHBondContact O-CG 3.46Å
609	D	94.4	Very high	91	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-78.8	-34.1	175	-90.3	14.6	0	0	0	112.2	V605 I606 T607 R612 T613 Y647 Q649 G650	V605-D609 PolarHBondContact O-N 3.46Å; I606-D609 WeakPolarHBondContact O-CA 3.46Å; I606-D609 WeakPolarHBondContact O-CB 3.34Å; I606-D609 PolarHBondContact O-N 3.06Å; T607-D609 VanDerWaalsContact C-N 3.27Å; T607-D609 PolarHBondContact O-N 3.42Å; D609-R612 WeakPolarHBondContact O-CG 3.48Å; D609-R612 PolarHBondContact O-N 3.09Å; D609-R612 IonicContact OD1-CZ 3.75Å; D609-R612 IonicContact OD1-NE 3.37Å; D609-R612 PolarHBondContact OD1-NE 2.64Å; D609-R612 IonicContact OD1-NH2 3.6Å; D609-R612 PolarHBondContact OD1-NH2 3.01Å; D609-R612 IonicContact OD2-NH2 3.92Å; D609-T613 PolarHBondContact O-N 3.06Å; D609-T613 VanDerWaalsContact O-N 3.16Å; D609-T613 PolarHBondContact O-OG1 2.89Å; D609-Y647 HydrophobicContact CB-CE1 4.22Å; D609-Y647 VanDerWaalsContact CB-OH 3.28Å; D609-Y647 WeakPolarHBondContact CB-OH 3.4Å; D609-Y647 WeakPolarHBondContact OD2-CE1 3.46Å; D609-Y647 PolarHBondContact OD2-OH 3.32Å; D609-Q649 WeakPolarHBondContact OD2-CA 3.41Å; D609-Q649 WeakPolarHBondContact OD2-CG 3.32Å; D609-G650 PolarHBondContact OD2-N 3.48Å
610	I	94.8	Very high	91	Very high	7 Å²	7	54.7 Å²	54.7	4%	0.036	30%	0.296	C	S	.	.	H	α-helix	trans	-65.1	-46.9	177	-69.7	169.2	0	0	0	111.2	I606 T607 R612 T613 Q628 L631 Y632	I606-I610 HydrophobicContact CG2-CD1 3.68Å; I606-I610 HydrophobicContact CG2-CG1 4.43Å; I606-I610 WeakPolarHBondContact O-CG1 3.38Å; I606-I610 PolarHBondContact O-N 3.05Å; T607-I610 PolarHBondContact O-N 3.04Å; I610-R612 PolarHBondContact O-N 3.43Å; I610-T613 PolarHBondContact O-N 3.27Å; I610-Q628 HydrophobicContact CG2-CB 3.95Å; I610-Q628 HydrophobicContact CG2-CG 3.97Å; I610-L631 HydrophobicContact CD1-CG 4.38Å; I610-L631 HydrophobicContact CG1-CD2 4.03Å; I610-L631 HydrophobicContact CG1-CG 4.06Å; I610-L631 HydrophobicContact CG2-CD2 4.31Å; I610-Y632 HydrophobicContact CD1-CD2 4.05Å; I610-Y632 HydrophobicContact CD1-CG 4.35Å
611	H	91.1	Very high	90.6	Very high	104 Å²	104	58.8 Å²	58.8	48%	0.481	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-12	178.1	-63.5	175.8	0	0	0	114.8	T607	T607-H611 PolarHBondContact O-N 3.06Å; T607-H611 VanDerWaalsContact O-N 3.11Å
612	R	91.5	Very high	90.3	Very high	108 Å²	108	59 Å²	59	41%	0.408	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	3.7	175.4	64.5	-174.4	-171.6	139.5	9.9	113.8	S524 R608 D609 I610 F653	S524-R612 PolarHBondContact OG-O 3.13Å; R608-R612 WeakPolarHBondContact O-CG 3.46Å; D609-R612 WeakPolarHBondContact O-CG 3.48Å; D609-R612 PolarHBondContact O-N 3.09Å; D609-R612 IonicContact OD1-CZ 3.75Å; D609-R612 IonicContact OD1-NE 3.37Å; D609-R612 PolarHBondContact OD1-NE 2.64Å; D609-R612 IonicContact OD1-NH2 3.6Å; D609-R612 PolarHBondContact OD1-NH2 3.01Å; D609-R612 IonicContact OD2-NH2 3.92Å; I610-R612 PolarHBondContact O-N 3.43Å; R612-F653 HydrophobicContact CG-CZ 4.39Å; R612-F653 WeakPolarHBondContact O-CE1 3.39Å; R612-F653 VanDerWaalsContact O-CZ 3.24Å; R612-F653 WeakPolarHBondContact O-CZ 3.44Å
613	T	93.9	Very high	89.9	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.006	31%	0.311	C	S	.	.	S	Bend	trans	-91.6	106.7	177.9	-62.5	0	0	0	0	109.7	D609 I610 P615 L631 S652 F653 A656	D609-T613 PolarHBondContact O-N 3.06Å; D609-T613 VanDerWaalsContact O-N 3.16Å; D609-T613 PolarHBondContact O-OG1 2.89Å; I610-T613 PolarHBondContact O-N 3.27Å; T613-P615 VanDerWaalsContact C-CD 3.46Å; T613-L631 HydrophobicContact CG2-CD2 3.85Å; T613-S652 VanDerWaalsContact OG1-CB 3.31Å; T613-S652 WeakPolarHBondContact OG1-CB 3.5Å; T613-S652 PolarHBondContact OG1-OG 3.26Å; T613-F653 HydrophobicContact CG2-CD1 3.99Å; T613-F653 HydrophobicContact CG2-CE1 4.46Å; T613-F653 HydrophobicContact CG2-CG 4.19Å; T613-A656 HydrophobicContact CG2-CB 3.57Å
614	F	90.9	Very high	89.3	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.337	C	S	.	.	S	Bend	trans	51.3	43.1	177.5	-52.9	-25.7	0	0	0	115.5	S524 G525 A616 H617 F620 F653 A656 V657 T733 L738	S524-F614 WeakPolarHBondContact O-CA 3.4Å; S524-F614 PolarHBondContact OG-N 3.06Å; S524-F614 VanDerWaalsContact OG-N 3.13Å; G525-F614 VanDerWaalsContact CA-CD1 3.45Å; F614-A616 PolarHBondContact O-N 3.12Å; F614-H617 HydrophobicContact CB-CB 3.99Å; F614-H617 WeakPolarHBondContact O-CB 3.33Å; F614-H617 PolarHBondContact O-N 2.87Å; F614-F620 HydrophobicContact CB-CB 4.48Å; F614-F620 HydrophobicContact CB-CD2 3.81Å; F614-F620 HydrophobicContact CB-CG 4.5Å; F614-F620 HydrophobicContact CD2-CD2 4.06Å; F614-F620 AromaticContact CD2-CE2 3.93Å; F614-F620 HydrophobicContact CD2-CE2 3.93Å; F614-F620 HydrophobicContact CG-CD2 4.47Å; F614-F653 HydrophobicContact CD1-CD1 4.02Å; F614-F653 HydrophobicContact CD1-CE1 4.47Å; F614-F653 AromaticContact CE1-CD1 3.72Å; F614-F653 HydrophobicContact CE1-CD1 3.72Å; F614-F653 HydrophobicContact CZ-CB 4.43Å; F614-F653 HydrophobicContact CZ-CD1 4.3Å; F614-A656 HydrophobicContact CD2-CB 3.63Å; F614-A656 HydrophobicContact CE2-CB 3.6Å; F614-V657 HydrophobicContact CE2-CG2 3.71Å; F614-V657 HydrophobicContact CZ-CG2 3.67Å; F614-T733 WeakPolarHBondContact CE1-O 3.35Å; F614-L738 HydrophobicContact CD1-CD2 4.43Å; F614-L738 HydrophobicContact CD2-CD2 4.33Å; F614-L738 HydrophobicContact CE1-CD2 3.98Å; F614-L738 HydrophobicContact CE2-CD2 3.88Å; F614-L738 HydrophobicContact CZ-CD2 3.69Å
615	P	85.7	Confident	89.2	Confident	55 Å²	55	61.3 Å²	61.3	36%	0.357	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-5.9	-174.5	33	-37.7	0	0	0	113.8	S524 T613	S524-P615 WeakPolarHBondContact OG-CD 3.33Å; T613-P615 VanDerWaalsContact C-CD 3.46Å
616	A	79.8	Confident	89	Confident	52 Å²	52	65.5 Å²	65.5	43%	0.43	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	3.3	171.5	0	0	0	0	0	113.6	S523 T526 F614	S523-A616 WeakPolarHBondContact OG-CB 3.49Å; T526-A616 HydrophobicContact CG2-CB 3.88Å; F614-A616 PolarHBondContact O-N 3.12Å
617	H	86.9	Confident	88.8	Confident	49 Å²	49	65.6 Å²	65.6	23%	0.227	34%	0.336	C	S	.	.	S	Bend	trans	-100.5	134.9	178.9	-176.6	-87.2	0	0	0	110.6	F614 Y619 F620 K621 L660	F614-H617 HydrophobicContact CB-CB 3.99Å; F614-H617 WeakPolarHBondContact O-CB 3.33Å; F614-H617 PolarHBondContact O-N 2.87Å; H617-Y619 VanDerWaalsContact C-N 3.26Å; H617-Y619 PolarHBondContact ND1-N 3.29Å; H617-Y619 PolarHBondContact O-N 2.82Å; H617-Y619 VanDerWaalsContact O-N 3.09Å; H617-F620 HydrophobicContact CB-CD2 4.41Å; H617-F620 AromaticContact ND1-CD2 3.91Å; H617-F620 PolarHBondContact O-N 2.76Å; H617-K621 PolarHBondContact O-N 3.12Å; H617-L660 WeakPolarHBondContact CE1-CD2 3.18Å
618	D	85.7	Confident	88.8	Confident	114 Å²	114	63.8 Å²	63.8	61%	0.61	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-38.5	-170.7	-78.7	-50.9	0	0	0	114.9	F620 K621	D618-F620 VanDerWaalsContact C-N 3.28Å; D618-F620 PolarHBondContact O-N 2.95Å; D618-K621 WeakPolarHBondContact O-CE 3.31Å; D618-K621 WeakPolarHBondContact OD1-CE 3.26Å; D618-K621 IonicContact OD1-NZ 3.78Å; D618-K621 PolarHBondContact OD1-NZ 3.37Å
619	Y	88.6	Confident	89	Confident	95 Å²	95	60.4 Å²	60.4	37%	0.373	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-13.5	-179.5	-168.5	-113.7	0	0	0	114.5	H617 G627 L659 L660	H617-Y619 VanDerWaalsContact C-N 3.26Å; H617-Y619 PolarHBondContact ND1-N 3.29Å; H617-Y619 PolarHBondContact O-N 2.82Å; H617-Y619 VanDerWaalsContact O-N 3.09Å; Y619-G627 VanDerWaalsContact CZ-CA 3.48Å; Y619-G627 WeakPolarHBondContact O-CA 3.22Å; Y619-L659 HydrophobicContact CE1-CD2 4.05Å; Y619-L659 HydrophobicContact CE1-CG 3.97Å; Y619-L660 HydrophobicContact CD1-CD2 3.97Å; Y619-L660 HydrophobicContact CG-CD2 4.35Å
620	F	91.5	Very high	89.1	Confident	2 Å²	2	61 Å²	61	1%	0.009	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.2	-3.6	-176.9	-59.2	-64.1	0	0	0	114.1	F614 H617 D618 E622 G627 Q628 L631 A656 L659 L660	F614-F620 HydrophobicContact CB-CB 4.48Å; F614-F620 HydrophobicContact CB-CD2 3.81Å; F614-F620 HydrophobicContact CB-CG 4.5Å; F614-F620 HydrophobicContact CD2-CD2 4.06Å; F614-F620 AromaticContact CD2-CE2 3.93Å; F614-F620 HydrophobicContact CD2-CE2 3.93Å; F614-F620 HydrophobicContact CG-CD2 4.47Å; H617-F620 HydrophobicContact CB-CD2 4.41Å; H617-F620 AromaticContact ND1-CD2 3.91Å; H617-F620 PolarHBondContact O-N 2.76Å; D618-F620 VanDerWaalsContact C-N 3.28Å; D618-F620 PolarHBondContact O-N 2.95Å; F620-E622 VanDerWaalsContact C-N 3.34Å; F620-E622 PolarHBondContact O-N 3.06Å; F620-G627 WeakPolarHBondContact CE1-O 3.46Å; F620-Q628 PolarHBondContact O-NE2 2.89Å; F620-L631 HydrophobicContact CD1-CD2 4.33Å; F620-L631 HydrophobicContact CE1-CB 4.3Å; F620-L631 HydrophobicContact CE1-CD2 4.15Å; F620-A656 HydrophobicContact CE1-CB 4.32Å; F620-A656 HydrophobicContact CE2-CB 3.8Å; F620-A656 HydrophobicContact CZ-CB 3.63Å; F620-L659 HydrophobicContact CE1-CD2 3.99Å; F620-L659 HydrophobicContact CZ-CD2 4.22Å; F620-L660 HydrophobicContact CD2-CD2 4.36Å; F620-L660 HydrophobicContact CE2-CD1 4.11Å; F620-L660 HydrophobicContact CE2-CD2 3.57Å; F620-L660 HydrophobicContact CE2-CG 3.73Å; F620-L660 HydrophobicContact CZ-CD2 4.11Å; F620-L660 HydrophobicContact CZ-CG 4.23Å
621	K	86	Confident	89.2	Confident	101 Å²	101	60.7 Å²	60.7	44%	0.439	32%	0.319	S	S	.	.	S	Bend	trans	-69.5	-28.1	-179.6	74.6	-173	167.5	-174.7	0	113.7	H617 D618	H617-K621 PolarHBondContact O-N 3.12Å; D618-K621 WeakPolarHBondContact O-CE 3.31Å; D618-K621 WeakPolarHBondContact OD1-CE 3.26Å; D618-K621 IonicContact OD1-NZ 3.78Å; D618-K621 PolarHBondContact OD1-NZ 3.37Å
622	E	84.7	Confident	89.5	Confident	114 Å²	114	58.4 Å²	58.4	53%	0.533	31%	0.306	S	S	.	.	S	Bend	trans	-85.4	113.2	-176.2	-78.4	162.1	-140.4	0	0	109.5	F620 G625 Q628	F620-E622 VanDerWaalsContact C-N 3.34Å; F620-E622 PolarHBondContact O-N 3.06Å; E622-G625 PolarHBondContact O-N 3.44Å; E622-Q628 VanDerWaalsContact O-CD 3.31Å; E622-Q628 WeakPolarHBondContact O-CG 3.46Å; E622-Q628 PolarHBondContact O-NE2 2.86Å
623	S	82.6	Confident	89.8	Confident	86 Å²	86	56 Å²	56	60%	0.601	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	135.1	170.8	-76.2	0	0	0	0	110.4	G625	S623-G625 PolarHBondContact O-N 3.32Å
624	D	80.1	Confident	90	Very high	149 Å²	149	55.9 Å²	55.9	80%	0.797	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	12.6	-177.1	-51.2	-47	0	0	0	115
625	G	88.2	Confident	90.4	Very high	18 Å²	18	55.9 Å²	55.9	19%	0.186	30%	0.298	C	S	.	.	S	Bend	trans	-79	161.7	172.4	0	0	0	0	0	113.4	E622 S623 G627 Q628 D629	E622-G625 PolarHBondContact O-N 3.44Å; S623-G625 PolarHBondContact O-N 3.32Å; G625-G627 PolarHBondContact O-N 3.29Å; G625-Q628 PolarHBondContact O-N 3.29Å; G625-D629 PolarHBondContact O-N 3.32Å; G625-D629 VanDerWaalsContact O-N 3.07Å
626	D	89.9	Confident	91	Very high	130 Å²	130	54.2 Å²	54.2	70%	0.695	29%	0.285	S	S	*	.	H	α-helix	trans	-44.7	-40	-172.2	-65.7	-18.1	0	0	0	114.8	S630	D626-S630 VanDerWaalsContact O-CB 3.27Å; D626-S630 WeakPolarHBondContact O-CB 3.33Å; D626-S630 PolarHBondContact O-N 3.38Å; D626-S630 PolarHBondContact O-OG 3.21Å
627	G	92	Very high	91.8	Very high	2 Å²	2	51.8 Å²	51.8	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-73.2	-33.9	179.8	0	0	0	0	0	114.1	Y619 F620 G625 L631	Y619-G627 VanDerWaalsContact CZ-CA 3.48Å; Y619-G627 WeakPolarHBondContact O-CA 3.22Å; F620-G627 WeakPolarHBondContact CE1-O 3.46Å; G625-G627 PolarHBondContact O-N 3.29Å; G627-L631 WeakPolarHBondContact O-CB 3.33Å; G627-L631 PolarHBondContact O-N 3.34Å; G627-L631 VanDerWaalsContact O-N 3.12Å
628	Q	94.4	Very high	92.4	Very high	15 Å²	15	49.4 Å²	49.4	7%	0.07	25%	0.254	C	S	.	.	H	α-helix	trans	-72.8	-38.9	172.2	-69	-163.5	14.8	0	0	111.3	I610 F620 E622 G625 L631 Y632	I610-Q628 HydrophobicContact CG2-CB 3.95Å; I610-Q628 HydrophobicContact CG2-CG 3.97Å; F620-Q628 PolarHBondContact O-NE2 2.89Å; E622-Q628 VanDerWaalsContact O-CD 3.31Å; E622-Q628 WeakPolarHBondContact O-CG 3.46Å; E622-Q628 PolarHBondContact O-NE2 2.86Å; G625-Q628 PolarHBondContact O-N 3.29Å; Q628-L631 PolarHBondContact O-N 3.12Å; Q628-Y632 WeakPolarHBondContact O-CB 3.42Å; Q628-Y632 PolarHBondContact O-N 2.77Å
629	D	95.9	Very high	92.9	Very high	66 Å²	66	44.5 Å²	44.5	35%	0.353	23%	0.228	S	C	.	.	H	α-helix	trans	-64.7	-48.9	175.4	171.6	50.2	0	0	0	112.2	G625 L631 Y632 K633	G625-D629 PolarHBondContact O-N 3.32Å; G625-D629 VanDerWaalsContact O-N 3.07Å; D629-L631 VanDerWaalsContact C-N 3.29Å; D629-L631 PolarHBondContact O-N 3.02Å; D629-Y632 WeakPolarHBondContact O-CB 3.22Å; D629-Y632 PolarHBondContact O-N 2.94Å; D629-Y632 VanDerWaalsContact O-N 3.11Å; D629-K633 WeakPolarHBondContact O-CG 3.43Å; D629-K633 PolarHBondContact O-N 2.97Å; D629-K633 VanDerWaalsContact OD1-CE 3.3Å; D629-K633 WeakPolarHBondContact OD1-CE 3.46Å; D629-K633 IonicContact OD1-NZ 3.74Å; D629-K633 WeakPolarHBondContact OD2-CE 3.28Å; D629-K633 IonicContact OD2-NZ 2.63Å; D629-K633 PolarHBondContact OD2-NZ 2.91Å
630	S	97.3	Very high	93.3	Very high	13 Å²	13	41.1 Å²	41.1	9%	0.091	22%	0.217	C	C	.	.	H	α-helix	trans	-58.2	-41.3	174.4	-60.4	0	0	0	0	111.8	D626 K633 I634 E664	D626-S630 VanDerWaalsContact O-CB 3.27Å; D626-S630 WeakPolarHBondContact O-CB 3.33Å; D626-S630 PolarHBondContact O-N 3.38Å; D626-S630 PolarHBondContact O-OG 3.21Å; S630-K633 PolarHBondContact O-N 2.95Å; S630-I634 WeakPolarHBondContact O-CD1 3.4Å; S630-I634 VanDerWaalsContact O-CG1 3.27Å; S630-I634 WeakPolarHBondContact O-CG1 3.47Å; S630-I634 PolarHBondContact O-N 2.98Å; S630-E664 WeakPolarHBondContact CA-OE2 3.28Å; S630-E664 PolarHBondContact OG-OE2 3.12Å
631	L	97.4	Very high	93.6	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-66	-40.1	175.8	-175.6	59.9	0	0	0	112.1	I610 T613 F620 G627 Q628 D629 I634 C635 A655 A656 L659	I610-L631 HydrophobicContact CD1-CG 4.38Å; I610-L631 HydrophobicContact CG1-CD2 4.03Å; I610-L631 HydrophobicContact CG1-CG 4.06Å; I610-L631 HydrophobicContact CG2-CD2 4.31Å; T613-L631 HydrophobicContact CG2-CD2 3.85Å; F620-L631 HydrophobicContact CD1-CD2 4.33Å; F620-L631 HydrophobicContact CE1-CB 4.3Å; F620-L631 HydrophobicContact CE1-CD2 4.15Å; G627-L631 WeakPolarHBondContact O-CB 3.33Å; G627-L631 PolarHBondContact O-N 3.34Å; G627-L631 VanDerWaalsContact O-N 3.12Å; Q628-L631 PolarHBondContact O-N 3.12Å; D629-L631 VanDerWaalsContact C-N 3.29Å; D629-L631 PolarHBondContact O-N 3.02Å; L631-I634 PolarHBondContact O-N 2.97Å; L631-C635 WeakPolarHBondContact O-CB 3.31Å; L631-C635 PolarHBondContact O-N 3.46Å; L631-C635 PolarHBondContact O-SG 3.22Å; L631-A655 HydrophobicContact CD1-CB 3.58Å; L631-A656 HydrophobicContact CD1-CB 4.06Å; L631-A656 HydrophobicContact CD2-CB 4.09Å; L631-L659 HydrophobicContact CB-CD2 4.16Å
632	Y	97.4	Very high	94.1	Very high	56 Å²	56	39.6 Å²	39.6	22%	0.22	21%	0.209	C	C	.	.	H	α-helix	trans	-60.1	-49.4	174.2	176.2	-98.3	0	0	0	111.7	E603 I606 I610 Q628 D629 I634 C635 K636	E603-Y632 HydrophobicContact CG-CE2 4.42Å; E603-Y632 VanDerWaalsContact CG-OH 3.31Å; E603-Y632 WeakPolarHBondContact CG-OH 3.39Å; E603-Y632 PolarHBondContact OE2-OH 2.96Å; I606-Y632 HydrophobicContact CG2-CD2 3.85Å; I606-Y632 HydrophobicContact CG2-CE2 4.28Å; I610-Y632 HydrophobicContact CD1-CD2 4.05Å; I610-Y632 HydrophobicContact CD1-CG 4.35Å; Q628-Y632 WeakPolarHBondContact O-CB 3.42Å; Q628-Y632 PolarHBondContact O-N 2.77Å; D629-Y632 WeakPolarHBondContact O-CB 3.22Å; D629-Y632 PolarHBondContact O-N 2.94Å; D629-Y632 VanDerWaalsContact O-N 3.11Å; Y632-I634 PolarHBondContact O-N 3.28Å; Y632-C635 PolarHBondContact O-N 2.97Å; Y632-K636 HydrophobicContact CE1-CD 3.8Å; Y632-K636 VanDerWaalsContact O-CB 3.28Å; Y632-K636 WeakPolarHBondContact O-CB 3.08Å; Y632-K636 PolarHBondContact O-N 2.98Å
633	K	97.9	Very high	94.4	Very high	56 Å²	56	42.4 Å²	42.4	24%	0.243	22%	0.223	C	C	.	.	H	α-helix	trans	-60.1	-43.7	177	-67.4	160	177.6	160.5	0	112.4	Y592 I596 D629 S630 K636 A637 E664	Y592-K633 VanDerWaalsContact OH-CB 3.27Å; Y592-K633 WeakPolarHBondContact OH-CB 3.35Å; I596-K633 HydrophobicContact CG2-CB 3.97Å; I596-K633 HydrophobicContact CG2-CG 4.5Å; D629-K633 WeakPolarHBondContact O-CG 3.43Å; D629-K633 PolarHBondContact O-N 2.97Å; D629-K633 VanDerWaalsContact OD1-CE 3.3Å; D629-K633 WeakPolarHBondContact OD1-CE 3.46Å; D629-K633 IonicContact OD1-NZ 3.74Å; D629-K633 WeakPolarHBondContact OD2-CE 3.28Å; D629-K633 IonicContact OD2-NZ 2.63Å; D629-K633 PolarHBondContact OD2-NZ 2.91Å; S630-K633 PolarHBondContact O-N 2.95Å; K633-K636 PolarHBondContact O-N 3.35Å; K633-A637 WeakPolarHBondContact O-CB 3.07Å; K633-A637 PolarHBondContact O-N 3.16Å; K633-E664 WeakPolarHBondContact CD-OE2 3.48Å; K633-E664 IonicContact NZ-OE2 3.29Å; K633-E664 PolarHBondContact NZ-OE2 2.88Å
634	I	98.2	Very high	94.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.5	-45.9	176.1	-66.8	164	0	0	0	111	Y592 S630 L631 Y632 Y638 A655 L659 E664 A667 F668 L671	Y592-I634 PolarHBondContact OH-N 3.39Å; S630-I634 WeakPolarHBondContact O-CD1 3.4Å; S630-I634 VanDerWaalsContact O-CG1 3.27Å; S630-I634 WeakPolarHBondContact O-CG1 3.47Å; S630-I634 PolarHBondContact O-N 2.98Å; L631-I634 PolarHBondContact O-N 2.97Å; Y632-I634 PolarHBondContact O-N 3.28Å; I634-Y638 WeakPolarHBondContact O-CB 3.37Å; I634-Y638 PolarHBondContact O-N 2.98Å; I634-A655 HydrophobicContact CG2-CB 3.92Å; I634-L659 HydrophobicContact CD1-CB 4.33Å; I634-L659 HydrophobicContact CD1-CD1 4.13Å; I634-L659 HydrophobicContact CD1-CD2 4.18Å; I634-L659 HydrophobicContact CD1-CG 4.45Å; I634-E664 HydrophobicContact CD1-CG 4.28Å; I634-E664 HydrophobicContact CG1-CG 4.09Å; I634-A667 HydrophobicContact CD1-CB 3.82Å; I634-F668 HydrophobicContact CG1-CB 4.43Å; I634-F668 HydrophobicContact CG2-CB 4.38Å; I634-L671 HydrophobicContact CG2-CD2 3.68Å
635	C	98.2	Very high	95.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-70.6	-39.7	179.6	-69.6	0	0	0	0	113.1	I606 L631 Y632 Y638 S639 Y647	I606-C635 HydrophobicContact CD1-CB 4.49Å; I606-C635 HydrophobicContact CG1-CB 4.32Å; I606-C635 HydrophobicContact CG2-CB 3.58Å; L631-C635 WeakPolarHBondContact O-CB 3.31Å; L631-C635 PolarHBondContact O-N 3.46Å; L631-C635 PolarHBondContact O-SG 3.22Å; Y632-C635 PolarHBondContact O-N 2.97Å; C635-Y638 PolarHBondContact O-N 2.68Å; C635-S639 WeakPolarHBondContact O-CB 3.35Å; C635-S639 PolarHBondContact O-N 3.08Å; C635-Y647 HydrophobicContact CB-CD2 3.91Å; C635-Y647 HydrophobicContact CB-CE2 3.94Å
636	K	97.7	Very high	95.7	Very high	20 Å²	20	38.1 Å²	38.1	9%	0.087	19%	0.186	C	C	.	.	H	α-helix	trans	-62	-51.2	173.7	177.9	162.4	170.8	159.5	0	110.3	K598 D599 E603 Y632 K633 Y638 S639 V640	K598-K636 WeakPolarHBondContact O-CE 3.4Å; D599-K636 IonicContact OD1-NZ 2.74Å; D599-K636 PolarHBondContact OD1-NZ 2.95Å; E603-K636 HydrophobicContact CG-CD 4.42Å; E603-K636 WeakPolarHBondContact OE1-CE 3.27Å; E603-K636 IonicContact OE1-NZ 3.76Å; E603-K636 PolarHBondContact OE1-NZ 2.87Å; E603-K636 IonicContact OE2-NZ 3.22Å; Y632-K636 HydrophobicContact CE1-CD 3.8Å; Y632-K636 VanDerWaalsContact O-CB 3.28Å; Y632-K636 WeakPolarHBondContact O-CB 3.08Å; Y632-K636 PolarHBondContact O-N 2.98Å; K633-K636 PolarHBondContact O-N 3.35Å; K636-Y638 PolarHBondContact O-N 2.92Å; K636-S639 WeakPolarHBondContact O-CB 3.28Å; K636-S639 PolarHBondContact O-N 2.8Å; K636-S639 VanDerWaalsContact O-N 3.13Å; K636-S639 PolarHBondContact O-OG 3.47Å; K636-V640 PolarHBondContact O-N 3.03Å
637	A	98.1	Very high	96.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60	-41.3	176.7	0	0	0	0	0	113	Y592 L595 I596 K633 S639 V640 Y641 F668	Y592-A637 HydrophobicContact CD2-CB 3.64Å; Y592-A637 HydrophobicContact CE2-CB 3.43Å; Y592-A637 VanDerWaalsContact CE2-CB 3.43Å; L595-A637 HydrophobicContact CB-CB 3.79Å; I596-A637 HydrophobicContact CG2-CB 4.03Å; K633-A637 WeakPolarHBondContact O-CB 3.07Å; K633-A637 PolarHBondContact O-N 3.16Å; A637-S639 PolarHBondContact O-N 3.17Å; A637-V640 PolarHBondContact O-N 3.4Å; A637-Y641 WeakPolarHBondContact O-CB 3.49Å; A637-Y641 PolarHBondContact O-N 3.44Å; A637-F668 HydrophobicContact CB-CD2 4.16Å; A637-F668 HydrophobicContact CB-CE2 3.92Å
638	Y	98.1	Very high	96.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.4	-42.9	174.9	-171.2	-81	0	0	0	111.7	I634 C635 K636 V640 Y641 D642 Q651 L671 V672 M675 Y676	I634-Y638 WeakPolarHBondContact O-CB 3.37Å; I634-Y638 PolarHBondContact O-N 2.98Å; C635-Y638 PolarHBondContact O-N 2.68Å; K636-Y638 PolarHBondContact O-N 2.92Å; Y638-V640 PolarHBondContact O-N 2.97Å; Y638-Y641 PolarHBondContact O-N 3.21Å; Y638-Y641 VanDerWaalsContact O-N 3.08Å; Y638-D642 HydrophobicContact CD1-CB 4.26Å; Y638-D642 HydrophobicContact CE1-CB 3.49Å; Y638-D642 VanDerWaalsContact CE1-CB 3.49Å; Y638-D642 PolarHBondContact O-N 3Å; Y638-D642 PolarHBondContact OH-OD2 2.92Å; Y638-Q651 VanDerWaalsContact CE1-NE2 3.32Å; Y638-L671 HydrophobicContact CD2-CD2 4.06Å; Y638-L671 HydrophobicContact CD2-CG 4.15Å; Y638-L671 HydrophobicContact CG-CD2 4.38Å; Y638-V672 HydrophobicContact CD2-CG2 4.19Å; Y638-V672 HydrophobicContact CE2-CG2 4.31Å; Y638-M675 HydrophobicContact CE1-CE 4.01Å; Y638-M675 HydrophobicContact CE2-CB 3.83Å; Y638-M675 HydrophobicContact CE2-CG 3.65Å; Y638-M675 VanDerWaalsContact OH-CB 3.22Å; Y638-M675 WeakPolarHBondContact OH-CB 3.34Å; Y638-M675 WeakPolarHBondContact OH-CE 3.35Å; Y638-Y676 HydrophobicContact CE2-CE2 4.46Å; Y638-Y676 WeakPolarHBondContact OH-CE2 3.36Å
639	S	97.5	Very high	95.7	Very high	10 Å²	10	37 Å²	37	7%	0.07	18%	0.177	C	C	.	.	H	α-helix	trans	-61.1	-27.1	-179.6	76.9	0	0	0	0	113.9	S600 C635 K636 A637	S600-S639 VanDerWaalsContact CB-OG 3.25Å; S600-S639 WeakPolarHBondContact CB-OG 3.44Å; S600-S639 PolarHBondContact OG-OG 3.21Å; C635-S639 WeakPolarHBondContact O-CB 3.35Å; C635-S639 PolarHBondContact O-N 3.08Å; K636-S639 WeakPolarHBondContact O-CB 3.28Å; K636-S639 PolarHBondContact O-N 2.8Å; K636-S639 VanDerWaalsContact O-N 3.13Å; K636-S639 PolarHBondContact O-OG 3.47Å; A637-S639 PolarHBondContact O-N 3.17Å
640	V	96.9	Very high	95.3	Very high	24 Å²	24	34.1 Å²	34.1	15%	0.145	16%	0.162	C	C	.	.	H	α-helix	trans	-94.8	-18.9	177.4	-174.9	0	0	0	0	112.1	L595 K598 K636 A637 Y638	L595-V640 HydrophobicContact CD2-CB 4.04Å; L595-V640 HydrophobicContact CD2-CG1 3.87Å; K598-V640 HydrophobicContact CB-CG1 3.98Å; K598-V640 HydrophobicContact CD-CG1 3.48Å; K598-V640 VanDerWaalsContact CD-CG1 3.48Å; K598-V640 HydrophobicContact CG-CG1 4.43Å; K636-V640 PolarHBondContact O-N 3.03Å; A637-V640 PolarHBondContact O-N 3.4Å; Y638-V640 PolarHBondContact O-N 2.97Å
641	Y	96.8	Very high	95.1	Very high	70 Å²	70	33.7 Å²	33.7	28%	0.275	16%	0.159	S	C	.	.	H	α-helix	trans	-79.3	-42.4	174.6	179.8	-93.5	0	0	0	112.4	L588 L595 A637 Y638 E643 F668 V672 Y676	L588-Y641 HydrophobicContact CD1-CE2 3.76Å; L595-Y641 HydrophobicContact CD1-CD2 3.9Å; L595-Y641 HydrophobicContact CD1-CG 4.43Å; A637-Y641 WeakPolarHBondContact O-CB 3.49Å; A637-Y641 PolarHBondContact O-N 3.44Å; Y638-Y641 PolarHBondContact O-N 3.21Å; Y638-Y641 VanDerWaalsContact O-N 3.08Å; Y641-E643 PolarHBondContact O-N 2.87Å; Y641-F668 HydrophobicContact CD2-CZ 4.26Å; Y641-F668 HydrophobicContact CG-CZ 4.25Å; Y641-V672 HydrophobicContact CD1-CG1 4.44Å; Y641-V672 HydrophobicContact CD1-CG2 4.11Å; Y641-V672 HydrophobicContact CE1-CB 4.49Å; Y641-V672 HydrophobicContact CE1-CG1 3.58Å; Y641-V672 HydrophobicContact CE1-CG2 4.05Å; Y641-Y676 HydrophobicContact CD1-CE2 4.05Å; Y641-Y676 HydrophobicContact CE1-CD2 4.31Å; Y641-Y676 AromaticContact CE1-CE2 3.63Å; Y641-Y676 HydrophobicContact CE1-CE2 3.63Å; Y641-Y676 AromaticContact CE1-CZ 3.76Å
642	D	95.8	Very high	95.1	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	16%	0.159	C	C	.	.			trans	-99.9	70.2	-178.6	-165.3	-17.7	0	0	0	111.3	Y638 E644 I645 G646 Y676 R681	Y638-D642 HydrophobicContact CD1-CB 4.26Å; Y638-D642 HydrophobicContact CE1-CB 3.49Å; Y638-D642 VanDerWaalsContact CE1-CB 3.49Å; Y638-D642 PolarHBondContact O-N 3Å; Y638-D642 PolarHBondContact OH-OD2 2.92Å; D642-E644 PolarHBondContact O-N 3.42Å; D642-I645 HydrophobicContact CB-CG1 4.36Å; D642-I645 VanDerWaalsContact CG-CG1 3.43Å; D642-I645 PolarHBondContact O-N 3.02Å; D642-I645 WeakPolarHBondContact OD2-CD1 3.44Å; D642-I645 VanDerWaalsContact OD2-CG1 3.25Å; D642-I645 WeakPolarHBondContact OD2-CG1 3.03Å; D642-G646 WeakPolarHBondContact O-CA 3.25Å; D642-G646 PolarHBondContact O-N 3.5Å; D642-Y676 HydrophobicContact CB-CE2 4.34Å; D642-Y676 WeakPolarHBondContact CB-OH 3.47Å; D642-Y676 PolarHBondContact OD1-OH 2.98Å; D642-Y676 PolarHBondContact OD2-OH 3.12Å; D642-R681 VanDerWaalsContact CG-NH2 3.34Å; D642-R681 IonicContact OD1-CZ 3.25Å; D642-R681 IonicContact OD1-NE 2.75Å; D642-R681 IonicContact OD1-NH2 3.82Å; D642-R681 PolarHBondContact OD1-NH2 3.13Å; D642-R681 IonicContact OD2-CZ 2.78Å; D642-R681 IonicContact OD2-NE 2.65Å; D642-R681 PolarHBondContact OD2-NE 2.81Å; D642-R681 IonicContact OD2-NH2 3.69Å; D642-R681 PolarHBondContact OD2-NH2 3.44Å
643	E	92.6	Very high	95	Very high	174 Å²	174	31.6 Å²	31.6	81%	0.813	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-14.8	-178	-60.6	179	174.8	0	0	114.7	Y641	Y641-E643 PolarHBondContact O-N 2.87Å
644	E	91.5	Very high	94.9	Very high	121 Å²	121	29.1 Å²	29.1	57%	0.565	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-28.9	-176.8	-168.3	-171.6	174	0	0	113.5	D642 R681 K685	D642-E644 PolarHBondContact O-N 3.42Å; E644-R681 IonicContact OE2-CZ 2.7Å; E644-R681 IonicContact OE2-NH1 3.96Å; E644-R681 PolarHBondContact OE2-NH1 2.93Å; E644-R681 VanDerWaalsContact OE2-NH1 3.1Å; E644-R681 IonicContact OE2-NH2 2.76Å; E644-R681 PolarHBondContact OE2-NH2 2.84Å; E644-K685 WeakPolarHBondContact OE1-CE 3.1Å; E644-K685 IonicContact OE1-NZ 2.97Å; E644-K685 PolarHBondContact OE1-NZ 3.42Å; E644-K685 WeakPolarHBondContact OE2-CE 3.3Å; E644-K685 IonicContact OE2-NZ 3.07Å; E644-K685 PolarHBondContact OE2-NZ 2.94Å
645	I	92.7	Very high	94.9	Very high	35 Å²	35	29.1 Å²	29.1	18%	0.179	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.3	-16.6	180	59.7	168.3	0	0	0	114.3	D642 M675 R681 K685	D642-I645 HydrophobicContact CB-CG1 4.36Å; D642-I645 VanDerWaalsContact CG-CG1 3.43Å; D642-I645 PolarHBondContact O-N 3.02Å; D642-I645 WeakPolarHBondContact OD2-CD1 3.44Å; D642-I645 VanDerWaalsContact OD2-CG1 3.25Å; D642-I645 WeakPolarHBondContact OD2-CG1 3.03Å; I645-M675 HydrophobicContact CD1-CE 4.06Å; I645-R681 HydrophobicContact CD1-CB 3.72Å; I645-K685 HydrophobicContact CG2-CG 4.12Å
646	G	94.2	Very high	94.9	Very high	7 Å²	7	29.1 Å²	29.1	7%	0.072	14%	0.14	C	C	.	.			trans	61.2	-155.1	-177.8	0	0	0	0	0	114.1	Q602 D642 C648	Q602-G646 VanDerWaalsContact OE1-CA 3.29Å; D642-G646 WeakPolarHBondContact O-CA 3.25Å; D642-G646 PolarHBondContact O-N 3.5Å; G646-C648 PolarHBondContact O-N 3.02Å
647	Y	96.4	Very high	94.8	Very high	6 Å²	6	28.1 Å²	28.1	2%	0.024	14%	0.136	C	C	.	.	S	Bend	trans	-65.2	126.8	169.2	177.1	-101.4	0	0	0	110.7	Q602 V605 I606 D609 C635 Q651 S652	Q602-Y647 PolarHBondContact NE2-O 2.81Å; V605-Y647 HydrophobicContact CG1-CD1 4.04Å; V605-Y647 HydrophobicContact CG1-CE1 4.15Å; I606-Y647 HydrophobicContact CD1-CG 4.22Å; I606-Y647 HydrophobicContact CG1-CD1 3.73Å; I606-Y647 HydrophobicContact CG1-CD2 3.88Å; I606-Y647 HydrophobicContact CG1-CE1 4.3Å; I606-Y647 HydrophobicContact CG1-CE2 4.43Å; I606-Y647 HydrophobicContact CG1-CG 3.51Å; D609-Y647 HydrophobicContact CB-CE1 4.22Å; D609-Y647 VanDerWaalsContact CB-OH 3.28Å; D609-Y647 WeakPolarHBondContact CB-OH 3.4Å; D609-Y647 WeakPolarHBondContact OD2-CE1 3.46Å; D609-Y647 PolarHBondContact OD2-OH 3.32Å; C635-Y647 HydrophobicContact CB-CD2 3.91Å; C635-Y647 HydrophobicContact CB-CE2 3.94Å; Y647-Q651 HydrophobicContact CD2-CB 4.37Å; Y647-Q651 HydrophobicContact CE2-CB 3.8Å; Y647-S652 WeakPolarHBondContact OH-CB 3.47Å; Y647-S652 PolarHBondContact OH-N 2.87Å; Y647-S652 VanDerWaalsContact OH-N 3.13Å; Y647-S652 PolarHBondContact OH-OG 2.75Å
648	C	92.3	Very high	94.8	Very high	8 Å²	8	28.1 Å²	28.1	5%	0.054	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-98.7	133.5	178.1	-75.7	0	0	0	0	111.5	G646 G650 Q651 Y684	G646-C648 PolarHBondContact O-N 3.02Å; C648-G650 PolarHBondContact O-N 3.05Å; C648-Q651 HydrophobicContact CB-CB 4.26Å; C648-Q651 WeakPolarHBondContact O-CB 3.39Å; C648-Q651 PolarHBondContact O-N 2.99Å; C648-Y684 HydrophobicContact CB-CD1 3.73Å; C648-Y684 HydrophobicContact CB-CD2 4.35Å; C648-Y684 HydrophobicContact CB-CE1 3.49Å; C648-Y684 VanDerWaalsContact CB-CE1 3.49Å; C648-Y684 HydrophobicContact CB-CE2 4.13Å; C648-Y684 HydrophobicContact CB-CG 4.14Å; C648-Y684 VanDerWaalsContact SG-CD1 3.56Å; C648-Y684 VanDerWaalsContact SG-CG 3.54Å
649	Q	87.3	Confident	94.7	Very high	109 Å²	109	28.7 Å²	28.7	51%	0.509	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	128.3	-177.7	-166.4	-179.8	15.8	0	0	111.4	D609	D609-Q649 WeakPolarHBondContact OD2-CA 3.41Å; D609-Q649 WeakPolarHBondContact OD2-CG 3.32Å
650	G	86.9	Confident	94.5	Very high	5 Å²	5	30.4 Å²	30.4	5%	0.052	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.4	0.1	-174.3	0	0	0	0	0	115.6	D609 C648 S652 F653	D609-G650 PolarHBondContact OD2-N 3.48Å; C648-G650 PolarHBondContact O-N 3.05Å; G650-S652 VanDerWaalsContact C-N 3.25Å; G650-S652 PolarHBondContact O-N 3.18Å; G650-F653 PolarHBondContact O-N 3.03Å
651	Q	94	Very high	94.4	Very high	5 Å²	5	30.4 Å²	30.4	2%	0.023	15%	0.146	C	C	.	.	H	α-helix	trans	-67.6	-27.3	175.7	-176.3	-179.9	4.2	0	0	112.1	Y638 Y647 C648 F653 L654 A655 L671	Y638-Q651 VanDerWaalsContact CE1-NE2 3.32Å; Y647-Q651 HydrophobicContact CD2-CB 4.37Å; Y647-Q651 HydrophobicContact CE2-CB 3.8Å; C648-Q651 HydrophobicContact CB-CB 4.26Å; C648-Q651 WeakPolarHBondContact O-CB 3.39Å; C648-Q651 PolarHBondContact O-N 2.99Å; Q651-F653 PolarHBondContact O-N 2.81Å; Q651-L654 PolarHBondContact O-N 3.08Å; Q651-L654 VanDerWaalsContact O-N 3.09Å; Q651-A655 PolarHBondContact O-N 3.45Å; Q651-L671 HydrophobicContact CG-CD1 4.25Å
652	S	96.2	Very high	94.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-51.3	-39.7	173	58.8	0	0	0	0	113.1	T613 Y647 G650 L654 A655 A656	T613-S652 VanDerWaalsContact OG1-CB 3.31Å; T613-S652 WeakPolarHBondContact OG1-CB 3.5Å; T613-S652 PolarHBondContact OG1-OG 3.26Å; Y647-S652 WeakPolarHBondContact OH-CB 3.47Å; Y647-S652 PolarHBondContact OH-N 2.87Å; Y647-S652 VanDerWaalsContact OH-N 3.13Å; Y647-S652 PolarHBondContact OH-OG 2.75Å; G650-S652 VanDerWaalsContact C-N 3.25Å; G650-S652 PolarHBondContact O-N 3.18Å; S652-L654 VanDerWaalsContact C-N 3.34Å; S652-L654 PolarHBondContact O-N 2.95Å; S652-A655 PolarHBondContact O-N 2.91Å; S652-A656 VanDerWaalsContact O-CB 3.28Å; S652-A656 WeakPolarHBondContact O-CB 3.25Å; S652-A656 PolarHBondContact O-N 2.85Å
653	F	96	Very high	94.1	Very high	13 Å²	13	31.5 Å²	31.5	6%	0.057	16%	0.161	C	C	.	.	H	α-helix	trans	-65.3	-35.4	179.2	-64.7	-92.2	0	0	0	112.8	R612 T613 F614 G650 Q651 V657 T733 A734	R612-F653 HydrophobicContact CG-CZ 4.39Å; R612-F653 WeakPolarHBondContact O-CE1 3.39Å; R612-F653 VanDerWaalsContact O-CZ 3.24Å; R612-F653 WeakPolarHBondContact O-CZ 3.44Å; T613-F653 HydrophobicContact CG2-CD1 3.99Å; T613-F653 HydrophobicContact CG2-CE1 4.46Å; T613-F653 HydrophobicContact CG2-CG 4.19Å; F614-F653 HydrophobicContact CD1-CD1 4.02Å; F614-F653 HydrophobicContact CD1-CE1 4.47Å; F614-F653 AromaticContact CE1-CD1 3.72Å; F614-F653 HydrophobicContact CE1-CD1 3.72Å; F614-F653 HydrophobicContact CZ-CB 4.43Å; F614-F653 HydrophobicContact CZ-CD1 4.3Å; G650-F653 PolarHBondContact O-N 3.03Å; Q651-F653 PolarHBondContact O-N 2.81Å; F653-V657 WeakPolarHBondContact O-CG2 3.39Å; F653-V657 PolarHBondContact O-N 3.35Å; F653-T733 WeakPolarHBondContact CB-OG1 3.21Å; F653-A734 HydrophobicContact CD1-CB 4.14Å; F653-A734 HydrophobicContact CD2-CB 3.9Å; F653-A734 HydrophobicContact CE1-CB 4.24Å; F653-A734 HydrophobicContact CE2-CB 4.04Å; F653-A734 HydrophobicContact CG-CB 3.95Å; F653-A734 HydrophobicContact CZ-CB 4.2Å
654	L	96.6	Very high	94.2	Very high	3 Å²	3	25 Å²	25	2%	0.016	13%	0.13	C	C	.	.	H	α-helix	trans	-71.2	-45.1	173.7	177.8	63	0	0	0	111.4	Q651 S652 A656 V657 L658 L671 I674 L680 L731	Q651-L654 PolarHBondContact O-N 3.08Å; Q651-L654 VanDerWaalsContact O-N 3.09Å; S652-L654 VanDerWaalsContact C-N 3.34Å; S652-L654 PolarHBondContact O-N 2.95Å; L654-A656 VanDerWaalsContact C-N 3.28Å; L654-A656 PolarHBondContact O-N 2.65Å; L654-V657 PolarHBondContact O-N 3.21Å; L654-L658 WeakPolarHBondContact O-CG 3.5Å; L654-L658 PolarHBondContact O-N 3.29Å; L654-L671 HydrophobicContact CD2-CD1 3.7Å; L654-L671 HydrophobicContact CG-CD1 3.99Å; L654-I674 HydrophobicContact CD1-CD1 4.24Å; L654-I674 HydrophobicContact CD2-CG2 3.95Å; L654-L680 HydrophobicContact CD2-CD2 3.74Å; L654-L731 HydrophobicContact CD1-CD1 3.86Å; L654-L731 HydrophobicContact CD2-CD1 3.99Å
655	A	97.8	Very high	94.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-58.9	-41.1	176.4	0	0	0	0	0	111.7	L631 I634 Q651 S652 L658 L659 L671	L631-A655 HydrophobicContact CD1-CB 3.58Å; I634-A655 HydrophobicContact CG2-CB 3.92Å; Q651-A655 PolarHBondContact O-N 3.45Å; S652-A655 PolarHBondContact O-N 2.91Å; A655-L658 PolarHBondContact O-N 2.87Å; A655-L659 WeakPolarHBondContact O-CB 3.45Å; A655-L659 PolarHBondContact O-N 3.32Å; A655-L671 HydrophobicContact CB-CD2 4.06Å
656	A	96.9	Very high	94.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.7	-42.3	175.7	0	0	0	0	0	112.8	T613 F614 F620 L631 S652 L654 L658 L659 L660	T613-A656 HydrophobicContact CG2-CB 3.57Å; F614-A656 HydrophobicContact CD2-CB 3.63Å; F614-A656 HydrophobicContact CE2-CB 3.6Å; F620-A656 HydrophobicContact CE1-CB 4.32Å; F620-A656 HydrophobicContact CE2-CB 3.8Å; F620-A656 HydrophobicContact CZ-CB 3.63Å; L631-A656 HydrophobicContact CD1-CB 4.06Å; L631-A656 HydrophobicContact CD2-CB 4.09Å; S652-A656 VanDerWaalsContact O-CB 3.28Å; S652-A656 WeakPolarHBondContact O-CB 3.25Å; S652-A656 PolarHBondContact O-N 2.85Å; L654-A656 VanDerWaalsContact C-N 3.28Å; L654-A656 PolarHBondContact O-N 2.65Å; A656-L658 VanDerWaalsContact C-N 3.28Å; A656-L658 PolarHBondContact O-N 2.9Å; A656-L659 PolarHBondContact O-N 3.29Å; A656-L660 WeakPolarHBondContact O-CG 3.45Å; A656-L660 PolarHBondContact O-N 2.84Å
657	V	96.3	Very high	94.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.1	-37.7	175.4	167.6	0	0	0	0	112.1	W576 F614 F653 L654 H661 T733 V741 F742	W576-V657 HydrophobicContact CH2-CG1 3.83Å; W576-V657 HydrophobicContact CZ3-CG1 4.06Å; F614-V657 HydrophobicContact CE2-CG2 3.71Å; F614-V657 HydrophobicContact CZ-CG2 3.67Å; F653-V657 WeakPolarHBondContact O-CG2 3.39Å; F653-V657 PolarHBondContact O-N 3.35Å; L654-V657 PolarHBondContact O-N 3.21Å; V657-H661 PolarHBondContact O-ND1 2.92Å; V657-T733 HydrophobicContact CG2-CG2 4.02Å; V657-V741 HydrophobicContact CG1-CG1 4.4Å; V657-V741 HydrophobicContact CG2-CG1 3.73Å; V657-F742 HydrophobicContact CG1-CD1 3.89Å; V657-F742 HydrophobicContact CG1-CE1 4.03Å; V657-F742 HydrophobicContact CG2-CE1 4.26Å
658	L	97.1	Very high	94.6	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-69.5	-47.7	175.5	-62.8	173	0	0	0	111.2	W576 L654 A655 A656 L660 H661 M662 A667 V670 L671 I674	W576-L658 HydrophobicContact CE3-CD2 3.84Å; W576-L658 HydrophobicContact CZ3-CD2 4.06Å; L654-L658 WeakPolarHBondContact O-CG 3.5Å; L654-L658 PolarHBondContact O-N 3.29Å; A655-L658 PolarHBondContact O-N 2.87Å; A656-L658 VanDerWaalsContact C-N 3.28Å; A656-L658 PolarHBondContact O-N 2.9Å; L658-L660 VanDerWaalsContact C-N 3.26Å; L658-L660 PolarHBondContact O-N 3.07Å; L658-H661 PolarHBondContact O-N 2.95Å; L658-M662 HydrophobicContact CB-CE 4.45Å; L658-M662 HydrophobicContact CD2-CE 4.11Å; L658-M662 PolarHBondContact O-N 2.91Å; L658-A667 HydrophobicContact CB-CB 3.94Å; L658-V670 HydrophobicContact CD1-CB 4.14Å; L658-V670 HydrophobicContact CD1-CG1 4.05Å; L658-V670 HydrophobicContact CD2-CB 4.22Å; L658-V670 HydrophobicContact CD2-CG1 3.59Å; L658-V670 HydrophobicContact CG-CG1 4.47Å; L658-L671 HydrophobicContact CD1-CB 3.88Å; L658-I674 HydrophobicContact CD1-CD1 4.28Å; L658-I674 HydrophobicContact CD2-CD1 4.31Å
659	L	96.7	Very high	94.8	Very high	12 Å²	12	20.9 Å²	20.9	6%	0.063	11%	0.108	C	C	.	.	H	α-helix	trans	-62.7	-27.5	-178.5	-179.1	62	0	0	0	113.6	Y619 F620 L631 I634 A655 A656 H661 A667	Y619-L659 HydrophobicContact CE1-CD2 4.05Å; Y619-L659 HydrophobicContact CE1-CG 3.97Å; F620-L659 HydrophobicContact CE1-CD2 3.99Å; F620-L659 HydrophobicContact CZ-CD2 4.22Å; L631-L659 HydrophobicContact CB-CD2 4.16Å; I634-L659 HydrophobicContact CD1-CB 4.33Å; I634-L659 HydrophobicContact CD1-CD1 4.13Å; I634-L659 HydrophobicContact CD1-CD2 4.18Å; I634-L659 HydrophobicContact CD1-CG 4.45Å; A655-L659 WeakPolarHBondContact O-CB 3.45Å; A655-L659 PolarHBondContact O-N 3.32Å; A656-L659 PolarHBondContact O-N 3.29Å; L659-H661 PolarHBondContact O-N 3.1Å; L659-A667 HydrophobicContact CB-CB 4.26Å
660	L	94.3	Very high	95.2	Very high	45 Å²	45	15.7 Å²	15.7	24%	0.236	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-18.6	171.4	-72.5	179.2	0	0	0	114.1	H617 Y619 F620 A656 L658 L738 F742	H617-L660 WeakPolarHBondContact CE1-CD2 3.18Å; Y619-L660 HydrophobicContact CD1-CD2 3.97Å; Y619-L660 HydrophobicContact CG-CD2 4.35Å; F620-L660 HydrophobicContact CD2-CD2 4.36Å; F620-L660 HydrophobicContact CE2-CD1 4.11Å; F620-L660 HydrophobicContact CE2-CD2 3.57Å; F620-L660 HydrophobicContact CE2-CG 3.73Å; F620-L660 HydrophobicContact CZ-CD2 4.11Å; F620-L660 HydrophobicContact CZ-CG 4.23Å; A656-L660 WeakPolarHBondContact O-CG 3.45Å; A656-L660 PolarHBondContact O-N 2.84Å; L658-L660 VanDerWaalsContact C-N 3.26Å; L658-L660 PolarHBondContact O-N 3.07Å; L660-L738 HydrophobicContact CD1-CD1 4.21Å; L660-F742 HydrophobicContact CD1-CE1 4.45Å; L660-F742 HydrophobicContact CD1-CZ 4.05Å
661	H	93.5	Very high	95.7	Very high	25 Å²	25	15.5 Å²	15.5	12%	0.116	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-25.5	-175.6	-65.1	91	0	0	0	114	E569 R572 A573 W576 V657 L658 L659 F742	E569-H661 IonicContact OE1-NE2 3.48Å; E569-H661 IonicContact OE2-NE2 2.7Å; E569-H661 PolarHBondContact OE2-NE2 3.39Å; R572-H661 VanDerWaalsContact CB-CD2 3.47Å; R572-H661 WeakPolarHBondContact CB-CD2 3.3Å; R572-H661 VanDerWaalsContact CD-NE2 3.29Å; R572-H661 WeakPolarHBondContact CD-NE2 3.38Å; A573-H661 WeakPolarHBondContact CB-O 3.32Å; W576-H661 HydrophobicContact CE3-CB 4.38Å; W576-H661 AromaticContact CH2-CE1 3.42Å; W576-H661 VanDerWaalsContact CH2-CE1 3.42Å; W576-H661 WeakPolarHBondContact CH2-CE1 3.45Å; W576-H661 AromaticContact CH2-CG 4Å; W576-H661 AromaticContact CH2-ND1 3.42Å; W576-H661 WeakPolarHBondContact CH2-ND1 3.21Å; W576-H661 AromaticContact CH2-NE2 3.98Å; W576-H661 HydrophobicContact CZ3-CB 4.12Å; W576-H661 AromaticContact CZ3-CE1 3.86Å; W576-H661 AromaticContact CZ3-CG 3.75Å; W576-H661 AromaticContact CZ3-ND1 3.33Å; W576-H661 VanDerWaalsContact CZ3-ND1 3.33Å; W576-H661 WeakPolarHBondContact CZ3-ND1 3.35Å; V657-H661 PolarHBondContact O-ND1 2.92Å; L658-H661 PolarHBondContact O-N 2.95Å; L659-H661 PolarHBondContact O-N 3.1Å; H661-F742 AromaticContact CE1-CD1 3.71Å; H661-F742 AromaticContact CE1-CD2 3.58Å; H661-F742 AromaticContact CE1-CE1 3.62Å; H661-F742 AromaticContact CE1-CE2 3.48Å; H661-F742 VanDerWaalsContact CE1-CE2 3.48Å; H661-F742 WeakPolarHBondContact CE1-CE2 3.48Å; H661-F742 AromaticContact CE1-CG 3.7Å; H661-F742 AromaticContact CE1-CZ 3.51Å; H661-F742 AromaticContact NE2-CD2 3.61Å; H661-F742 AromaticContact NE2-CE2 3.68Å
662	M	93.2	Very high	95.9	Very high	7 Å²	7	15.5 Å²	15.5	3%	0.034	8%	0.082	C	C	.	.	S	Bend	trans	-144	156.1	-176.3	72.9	-164.4	75.5	0	0	111.4	W576 Q577 L658 Q666 A667 V670	W576-M662 HydrophobicContact CB-CE 4.24Å; W576-M662 HydrophobicContact CE3-CE 3.82Å; Q577-M662 HydrophobicContact CG-SD 4.04Å; L658-M662 HydrophobicContact CB-CE 4.45Å; L658-M662 HydrophobicContact CD2-CE 4.11Å; L658-M662 PolarHBondContact O-N 2.91Å; M662-Q666 HydrophobicContact CB-CB 4.2Å; M662-Q666 HydrophobicContact CG-CB 3.9Å; M662-Q666 HydrophobicContact SD-CB 3.99Å; M662-A667 HydrophobicContact CG-CB 3.93Å; M662-V670 HydrophobicContact CE-CG2 4.23Å; M662-V670 HydrophobicContact SD-CB 4.2Å; M662-V670 HydrophobicContact SD-CG2 3.66Å
663	P	93.6	Very high	95.8	Very high	86 Å²	86	17 Å²	17	56%	0.558	9%	0.089	S	C	*	.			trans	-66.4	164.8	-176.1	-12.9	26.7	0	0	0	113.2	E665 Q666 A667	P663-E665 PolarHBondContact O-N 3.31Å; P663-Q666 VanDerWaalsContact CB-OE1 3.31Å; P663-Q666 PolarHBondContact O-N 2.77Å; P663-Q666 PolarHBondContact O-OE1 3.13Å; P663-A667 PolarHBondContact O-N 3.47Å
664	E	95.3	Very high	95.9	Very high	38 Å²	38	16.4 Å²	16.4	18%	0.178	9%	0.086	C	C	.	.	H	α-helix	trans	-43.2	-54.8	-172.4	-167.4	-172.3	94	0	0	114	Y592 S630 K633 I634 Q666 A667 F668	Y592-E664 HydrophobicContact CE1-CG 4.09Å; Y592-E664 WeakPolarHBondContact CE1-OE1 3.19Å; Y592-E664 VanDerWaalsContact OH-CG 3.28Å; Y592-E664 WeakPolarHBondContact OH-CG 3.46Å; Y592-E664 PolarHBondContact OH-OE1 2.96Å; S630-E664 WeakPolarHBondContact CA-OE2 3.28Å; S630-E664 PolarHBondContact OG-OE2 3.12Å; K633-E664 WeakPolarHBondContact CD-OE2 3.48Å; K633-E664 IonicContact NZ-OE2 3.29Å; K633-E664 PolarHBondContact NZ-OE2 2.88Å; I634-E664 HydrophobicContact CD1-CG 4.28Å; I634-E664 HydrophobicContact CG1-CG 4.09Å; E664-Q666 PolarHBondContact O-N 3.11Å; E664-A667 PolarHBondContact O-N 2.68Å; E664-F668 PolarHBondContact O-N 2.81Å; E664-F668 VanDerWaalsContact O-N 3.1Å
665	E	94.1	Very high	95.9	Very high	43 Å²	43	16.2 Å²	16.2	20%	0.201	9%	0.085	C	C	.	.	H	α-helix	trans	-66	-36.7	-177.2	-46.6	-172.9	141.6	0	0	112.8	L589 Y592 R593 P663 C669	L589-E665 HydrophobicContact CD2-CB 3.48Å; L589-E665 VanDerWaalsContact CD2-CB 3.48Å; Y592-E665 HydrophobicContact CD1-CB 4.21Å; Y592-E665 HydrophobicContact CD1-CG 3.99Å; Y592-E665 HydrophobicContact CE1-CG 4.28Å; R593-E665 IonicContact CZ-OE1 2.85Å; R593-E665 IonicContact CZ-OE2 2.78Å; R593-E665 IonicContact NE-OE1 3.96Å; R593-E665 PolarHBondContact NE-OE1 3.28Å; R593-E665 VanDerWaalsContact NH2-CD 3.3Å; R593-E665 IonicContact NH2-OE1 3.01Å; R593-E665 PolarHBondContact NH2-OE1 2.69Å; R593-E665 IonicContact NH2-OE2 3.99Å; R593-E665 PolarHBondContact NH2-OE2 3.11Å; P663-E665 PolarHBondContact O-N 3.31Å; E665-C669 PolarHBondContact O-N 3.04Å; E665-C669 VanDerWaalsContact O-N 3.14Å; E665-C669 PolarHBondContact O-SG 3.26Å
666	Q	94.6	Very high	95.7	Very high	44 Å²	44	20.3 Å²	20.3	21%	0.206	10%	0.101	C	C	.	.	H	α-helix	trans	-74.5	-37.6	178.5	-68.4	72.2	34.3	0	0	111.3	M662 P663 E664 F668 C669 V670	M662-Q666 HydrophobicContact CB-CB 4.2Å; M662-Q666 HydrophobicContact CG-CB 3.9Å; M662-Q666 HydrophobicContact SD-CB 3.99Å; P663-Q666 VanDerWaalsContact CB-OE1 3.31Å; P663-Q666 PolarHBondContact O-N 2.77Å; P663-Q666 PolarHBondContact O-OE1 3.13Å; E664-Q666 PolarHBondContact O-N 3.11Å; Q666-F668 VanDerWaalsContact C-N 3.33Å; Q666-F668 PolarHBondContact O-N 2.92Å; Q666-C669 WeakPolarHBondContact O-CB 3.38Å; Q666-C669 PolarHBondContact O-N 2.93Å; Q666-C669 VanDerWaalsContact O-N 3.14Å; Q666-V670 PolarHBondContact O-N 2.81Å
667	A	96.9	Very high	95.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-62.3	-41	175.7	0	0	0	0	0	111	I634 L658 L659 M662 P663 E664 L671	I634-A667 HydrophobicContact CD1-CB 3.82Å; L658-A667 HydrophobicContact CB-CB 3.94Å; L659-A667 HydrophobicContact CB-CB 4.26Å; M662-A667 HydrophobicContact CG-CB 3.93Å; P663-A667 PolarHBondContact O-N 3.47Å; E664-A667 PolarHBondContact O-N 2.68Å; A667-L671 VanDerWaalsContact O-CB 3.3Å; A667-L671 WeakPolarHBondContact O-CB 3.17Å; A667-L671 PolarHBondContact O-N 2.9Å
668	F	97.3	Very high	95.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.2	-46.5	169.6	172.4	-100	0	0	0	112.4	L588 Y592 L595 I634 A637 Y641 E664 Q666 V670 L671 V672	L588-F668 HydrophobicContact CD1-CE1 3.85Å; L588-F668 HydrophobicContact CG-CD1 4.41Å; L588-F668 HydrophobicContact CG-CE1 3.95Å; Y592-F668 HydrophobicContact CD2-CB 3.64Å; Y592-F668 AromaticContact CD2-CD1 3.36Å; Y592-F668 HydrophobicContact CD2-CD1 3.36Å; Y592-F668 AromaticContact CD2-CD2 3.59Å; Y592-F668 HydrophobicContact CD2-CD2 3.59Å; Y592-F668 AromaticContact CD2-CE1 3.83Å; Y592-F668 HydrophobicContact CD2-CE1 3.83Å; Y592-F668 HydrophobicContact CD2-CE2 4.04Å; Y592-F668 AromaticContact CD2-CG 3.22Å; Y592-F668 HydrophobicContact CD2-CG 3.22Å; Y592-F668 HydrophobicContact CD2-CZ 4.15Å; Y592-F668 HydrophobicContact CE2-CB 3.67Å; Y592-F668 HydrophobicContact CE2-CD1 4.24Å; Y592-F668 AromaticContact CE2-CD2 3.79Å; Y592-F668 HydrophobicContact CE2-CD2 3.79Å; Y592-F668 HydrophobicContact CE2-CE2 4.5Å; Y592-F668 AromaticContact CE2-CG 3.64Å; Y592-F668 HydrophobicContact CE2-CG 3.64Å; Y592-F668 HydrophobicContact CG-CB 4.33Å; Y592-F668 AromaticContact CG-CD1 3.84Å; Y592-F668 HydrophobicContact CG-CD1 3.84Å; Y592-F668 HydrophobicContact CG-CE1 4.33Å; Y592-F668 HydrophobicContact CG-CG 4.08Å; L595-F668 HydrophobicContact CD1-CE1 4.4Å; L595-F668 HydrophobicContact CD1-CZ 3.81Å; I634-F668 HydrophobicContact CG1-CB 4.43Å; I634-F668 HydrophobicContact CG2-CB 4.38Å; A637-F668 HydrophobicContact CB-CD2 4.16Å; A637-F668 HydrophobicContact CB-CE2 3.92Å; Y641-F668 HydrophobicContact CD2-CZ 4.26Å; Y641-F668 HydrophobicContact CG-CZ 4.25Å; E664-F668 PolarHBondContact O-N 2.81Å; E664-F668 VanDerWaalsContact O-N 3.1Å; Q666-F668 VanDerWaalsContact C-N 3.33Å; Q666-F668 PolarHBondContact O-N 2.92Å; F668-V670 PolarHBondContact O-N 2.86Å; F668-L671 WeakPolarHBondContact O-CB 3.38Å; F668-L671 PolarHBondContact O-N 3.29Å; F668-V672 HydrophobicContact CD1-CG2 4.45Å; F668-V672 HydrophobicContact CD2-CG2 4.33Å; F668-V672 HydrophobicContact CE1-CG2 4.02Å; F668-V672 HydrophobicContact CE2-CG2 3.87Å; F668-V672 HydrophobicContact CZ-CG2 3.7Å; F668-V672 WeakPolarHBondContact O-CG2 3.38Å; F668-V672 PolarHBondContact O-N 2.96Å
669	C	96.2	Very high	95.4	Very high	4 Å²	4	29.9 Å²	29.9	3%	0.027	15%	0.153	C	C	.	.	H	α-helix	trans	-59	-44.9	179.1	-71.4	0	0	0	0	112.7	L588 E665 Q666 K673	L588-C669 HydrophobicContact CD2-CB 4.08Å; E665-C669 PolarHBondContact O-N 3.04Å; E665-C669 VanDerWaalsContact O-N 3.14Å; E665-C669 PolarHBondContact O-SG 3.26Å; Q666-C669 WeakPolarHBondContact O-CB 3.38Å; Q666-C669 PolarHBondContact O-N 2.93Å; Q666-C669 VanDerWaalsContact O-N 3.14Å; C669-K673 WeakPolarHBondContact O-CG 3.34Å; C669-K673 PolarHBondContact O-N 2.97Å
670	V	96.5	Very high	95.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-70.1	-35.8	177.7	178.1	0	0	0	0	111.4	Q577 A580 C582 L658 M662 Q666 F668 K673 I674	Q577-V670 HydrophobicContact CG-CG2 3.89Å; A580-V670 HydrophobicContact CB-CG1 4.17Å; A580-V670 HydrophobicContact CB-CG2 4.34Å; C582-V670 HydrophobicContact CB-CG2 4.23Å; L658-V670 HydrophobicContact CD1-CB 4.14Å; L658-V670 HydrophobicContact CD1-CG1 4.05Å; L658-V670 HydrophobicContact CD2-CB 4.22Å; L658-V670 HydrophobicContact CD2-CG1 3.59Å; L658-V670 HydrophobicContact CG-CG1 4.47Å; M662-V670 HydrophobicContact CE-CG2 4.23Å; M662-V670 HydrophobicContact SD-CB 4.2Å; M662-V670 HydrophobicContact SD-CG2 3.66Å; Q666-V670 PolarHBondContact O-N 2.81Å; F668-V670 PolarHBondContact O-N 2.86Å; V670-K673 WeakPolarHBondContact O-CB 3.41Å; V670-K673 PolarHBondContact O-N 3.33Å; V670-I674 HydrophobicContact CG1-CD1 4.01Å; V670-I674 HydrophobicContact CG1-CG1 4.38Å; V670-I674 WeakPolarHBondContact O-CG1 3.49Å; V670-I674 PolarHBondContact O-N 3.29Å
671	L	97.5	Very high	95.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-59.6	-47.1	174.2	-179.4	64.4	0	0	0	111.6	I634 Y638 Q651 L654 A655 L658 A667 F668 K673 I674 M675	I634-L671 HydrophobicContact CG2-CD2 3.68Å; Y638-L671 HydrophobicContact CD2-CD2 4.06Å; Y638-L671 HydrophobicContact CD2-CG 4.15Å; Y638-L671 HydrophobicContact CG-CD2 4.38Å; Q651-L671 HydrophobicContact CG-CD1 4.25Å; L654-L671 HydrophobicContact CD2-CD1 3.7Å; L654-L671 HydrophobicContact CG-CD1 3.99Å; A655-L671 HydrophobicContact CB-CD2 4.06Å; L658-L671 HydrophobicContact CD1-CB 3.88Å; A667-L671 VanDerWaalsContact O-CB 3.3Å; A667-L671 WeakPolarHBondContact O-CB 3.17Å; A667-L671 PolarHBondContact O-N 2.9Å; F668-L671 WeakPolarHBondContact O-CB 3.38Å; F668-L671 PolarHBondContact O-N 3.29Å; L671-K673 VanDerWaalsContact C-N 3.32Å; L671-K673 PolarHBondContact O-N 3.09Å; L671-I674 PolarHBondContact O-N 2.9Å; L671-M675 HydrophobicContact CD1-CG 4.39Å; L671-M675 WeakPolarHBondContact O-CB 3.33Å; L671-M675 WeakPolarHBondContact O-CG 3.44Å; L671-M675 PolarHBondContact O-N 2.93Å
672	V	96.8	Very high	95.5	Very high	6 Å²	6	28.4 Å²	28.4	4%	0.036	15%	0.148	C	C	.	.	H	α-helix	trans	-59.2	-42.4	176	170	0	0	0	0	111.1	L588 Y638 Y641 F668 M675 Y676	L588-V672 HydrophobicContact CD2-CB 4.12Å; L588-V672 HydrophobicContact CD2-CG1 4.09Å; Y638-V672 HydrophobicContact CD2-CG2 4.19Å; Y638-V672 HydrophobicContact CE2-CG2 4.31Å; Y641-V672 HydrophobicContact CD1-CG1 4.44Å; Y641-V672 HydrophobicContact CD1-CG2 4.11Å; Y641-V672 HydrophobicContact CE1-CB 4.49Å; Y641-V672 HydrophobicContact CE1-CG1 3.58Å; Y641-V672 HydrophobicContact CE1-CG2 4.05Å; F668-V672 HydrophobicContact CD1-CG2 4.45Å; F668-V672 HydrophobicContact CD2-CG2 4.33Å; F668-V672 HydrophobicContact CE1-CG2 4.02Å; F668-V672 HydrophobicContact CE2-CG2 3.87Å; F668-V672 HydrophobicContact CZ-CG2 3.7Å; F668-V672 WeakPolarHBondContact O-CG2 3.38Å; F668-V672 PolarHBondContact O-N 2.96Å; V672-M675 PolarHBondContact O-N 2.79Å; V672-Y676 HydrophobicContact CG1-CD2 4.24Å; V672-Y676 WeakPolarHBondContact O-CB 3.47Å; V672-Y676 WeakPolarHBondContact O-CD2 3.49Å; V672-Y676 PolarHBondContact O-N 3.37Å
673	K	95.8	Very high	95.5	Very high	31 Å²	31	28.2 Å²	28.2	14%	0.135	15%	0.147	C	C	.	.	H	α-helix	trans	-61.3	-46.7	174.5	-69.8	-67.4	-167.6	163.2	0	112.6	A580 C582 C669 V670 L671 M675 Y676 E677 Y678	A580-K673 HydrophobicContact CB-CB 4.18Å; A580-K673 HydrophobicContact CB-CG 4.34Å; A580-K673 WeakPolarHBondContact O-CD 3.49Å; C582-K673 WeakPolarHBondContact SG-CG 3.44Å; C669-K673 WeakPolarHBondContact O-CG 3.34Å; C669-K673 PolarHBondContact O-N 2.97Å; V670-K673 WeakPolarHBondContact O-CB 3.41Å; V670-K673 PolarHBondContact O-N 3.33Å; L671-K673 VanDerWaalsContact C-N 3.32Å; L671-K673 PolarHBondContact O-N 3.09Å; K673-M675 VanDerWaalsContact C-N 3.29Å; K673-M675 PolarHBondContact O-N 3.4Å; K673-Y676 PolarHBondContact O-N 3.33Å; K673-E677 HydrophobicContact CD-CG 4.22Å; K673-E677 WeakPolarHBondContact CD-OE1 3.49Å; K673-E677 WeakPolarHBondContact CD-OE2 3.5Å; K673-E677 IonicContact NZ-OE1 2.71Å; K673-E677 PolarHBondContact NZ-OE1 3.11Å; K673-E677 IonicContact NZ-OE2 2.67Å; K673-E677 PolarHBondContact NZ-OE2 2.84Å; K673-E677 WeakPolarHBondContact O-CA 3.46Å; K673-E677 PolarHBondContact O-N 3.05Å; K673-Y678 PolarHBondContact O-N 3.22Å; K673-Y678 VanDerWaalsContact O-N 3.14Å
674	I	96.8	Very high	95.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.2	-40.6	179.1	-66.3	170	0	0	0	110.7	L654 L658 V670 L671 Y678 G679 L680 L731 L748 L749	L654-I674 HydrophobicContact CD1-CD1 4.24Å; L654-I674 HydrophobicContact CD2-CG2 3.95Å; L658-I674 HydrophobicContact CD1-CD1 4.28Å; L658-I674 HydrophobicContact CD2-CD1 4.31Å; V670-I674 HydrophobicContact CG1-CD1 4.01Å; V670-I674 HydrophobicContact CG1-CG1 4.38Å; V670-I674 WeakPolarHBondContact O-CG1 3.49Å; V670-I674 PolarHBondContact O-N 3.29Å; L671-I674 PolarHBondContact O-N 2.9Å; I674-Y678 WeakPolarHBondContact O-CB 3.5Å; I674-G679 PolarHBondContact O-N 3.31Å; I674-L680 HydrophobicContact CG2-CB 4.22Å; I674-L680 HydrophobicContact CG2-CD2 4Å; I674-L680 WeakPolarHBondContact O-CB 3.46Å; I674-L680 PolarHBondContact O-N 3.11Å; I674-L731 HydrophobicContact CG2-CD1 4.13Å; I674-L748 HydrophobicContact CG2-CD2 4.48Å; I674-L749 HydrophobicContact CD1-CD2 4.09Å; I674-L749 HydrophobicContact CG1-CD2 3.82Å
675	M	96.3	Very high	95.1	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.7	-48.5	178.7	-69.7	-64.4	-81.9	0	0	112.4	Y638 I645 L671 V672 K673 G679 L680 R681	Y638-M675 HydrophobicContact CE1-CE 4.01Å; Y638-M675 HydrophobicContact CE2-CB 3.83Å; Y638-M675 HydrophobicContact CE2-CG 3.65Å; Y638-M675 VanDerWaalsContact OH-CB 3.22Å; Y638-M675 WeakPolarHBondContact OH-CB 3.34Å; Y638-M675 WeakPolarHBondContact OH-CE 3.35Å; I645-M675 HydrophobicContact CD1-CE 4.06Å; L671-M675 HydrophobicContact CD1-CG 4.39Å; L671-M675 WeakPolarHBondContact O-CB 3.33Å; L671-M675 WeakPolarHBondContact O-CG 3.44Å; L671-M675 PolarHBondContact O-N 2.93Å; V672-M675 PolarHBondContact O-N 2.79Å; K673-M675 VanDerWaalsContact C-N 3.29Å; K673-M675 PolarHBondContact O-N 3.4Å; M675-G679 CarbonylContact O-C 3.59Å; M675-L680 PolarHBondContact O-N 2.66Å; M675-L680 HydrophobicContact SD-CB 3.97Å; M675-L680 HydrophobicContact SD-CD2 3.76Å; M675-L680 HydrophobicContact SD-CG 3.8Å; M675-R681 HydrophobicContact CB-CB 4.24Å; M675-R681 HydrophobicContact CE-CB 3.96Å; M675-R681 WeakPolarHBondContact O-CB 3.19Å; M675-R681 WeakPolarHBondContact O-CG 3.45Å; M675-R681 PolarHBondContact O-N 2.89Å
676	Y	94.8	Very high	94.8	Very high	86 Å²	86	30.1 Å²	30.1	34%	0.337	15%	0.151	S	C	.	.	H	α-helix	trans	-91.5	-50	-173	-77.3	-109.9	0	0	0	114.6	Y638 Y641 D642 V672 K673	Y638-Y676 HydrophobicContact CE2-CE2 4.46Å; Y638-Y676 WeakPolarHBondContact OH-CE2 3.36Å; Y641-Y676 HydrophobicContact CD1-CE2 4.05Å; Y641-Y676 HydrophobicContact CE1-CD2 4.31Å; Y641-Y676 AromaticContact CE1-CE2 3.63Å; Y641-Y676 HydrophobicContact CE1-CE2 3.63Å; Y641-Y676 AromaticContact CE1-CZ 3.76Å; D642-Y676 HydrophobicContact CB-CE2 4.34Å; D642-Y676 WeakPolarHBondContact CB-OH 3.47Å; D642-Y676 PolarHBondContact OD1-OH 2.98Å; D642-Y676 PolarHBondContact OD2-OH 3.12Å; V672-Y676 HydrophobicContact CG1-CD2 4.24Å; V672-Y676 WeakPolarHBondContact O-CB 3.47Å; V672-Y676 WeakPolarHBondContact O-CD2 3.49Å; V672-Y676 PolarHBondContact O-N 3.37Å; K673-Y676 PolarHBondContact O-N 3.33Å
677	E	94.3	Very high	94.3	Very high	132 Å²	132	33.8 Å²	33.8	62%	0.617	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	-36.8	-171.9	-69.9	-178.8	-161.6	0	0	112.8	K673 G679	K673-E677 HydrophobicContact CD-CG 4.22Å; K673-E677 WeakPolarHBondContact CD-OE1 3.49Å; K673-E677 WeakPolarHBondContact CD-OE2 3.5Å; K673-E677 IonicContact NZ-OE1 2.71Å; K673-E677 PolarHBondContact NZ-OE1 3.11Å; K673-E677 IonicContact NZ-OE2 2.67Å; K673-E677 PolarHBondContact NZ-OE2 2.84Å; K673-E677 WeakPolarHBondContact O-CA 3.46Å; K673-E677 PolarHBondContact O-N 3.05Å; E677-G679 VanDerWaalsContact C-N 3.27Å
678	Y	95.1	Very high	94	Very high	39 Å²	39	38 Å²	38	15%	0.153	19%	0.19	C	C	.	.	S	Bend	trans	-80.9	-13.1	170.2	-66.2	-103.7	0	0	0	112	R555 L579 K673 I674 L748 L749 L753	R555-Y678 PolarHBondContact NH2-OH 2.94Å; L579-Y678 PolarHBondContact O-OH 3.33Å; K673-Y678 PolarHBondContact O-N 3.22Å; K673-Y678 VanDerWaalsContact O-N 3.14Å; I674-Y678 WeakPolarHBondContact O-CB 3.5Å; Y678-L748 WeakPolarHBondContact CE1-O 3.47Å; Y678-L749 HydrophobicContact CD2-CD2 4.48Å; Y678-L749 HydrophobicContact CE1-CD2 4.15Å; Y678-L749 HydrophobicContact CE2-CD2 3.99Å; Y678-L749 PolarHBondContact OH-O 2.7Å; Y678-L753 WeakPolarHBondContact O-CD1 3.42Å; Y678-L753 WeakPolarHBondContact O-CG 3.37Å
679	G	94.4	Very high	93.7	Very high	30 Å²	30	41.1 Å²	41.1	31%	0.309	21%	0.205	S	C	.	.			trans	86	13.1	167.8	0	0	0	0	0	115.8	I674 M675 E677 R681 G682	I674-G679 PolarHBondContact O-N 3.31Å; M675-G679 CarbonylContact O-C 3.59Å; E677-G679 VanDerWaalsContact C-N 3.27Å; G679-R681 PolarHBondContact O-N 2.65Å; G679-G682 PolarHBondContact O-N 2.71Å
680	L	96	Very high	93.6	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.016	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-58.6	-33.9	-178.2	179.7	61	0	0	0	112.4	L654 I674 M675 G682 L683 Y684 L731 L753	L654-L680 HydrophobicContact CD2-CD2 3.74Å; I674-L680 HydrophobicContact CG2-CB 4.22Å; I674-L680 HydrophobicContact CG2-CD2 4Å; I674-L680 WeakPolarHBondContact O-CB 3.46Å; I674-L680 PolarHBondContact O-N 3.11Å; M675-L680 PolarHBondContact O-N 2.66Å; M675-L680 HydrophobicContact SD-CB 3.97Å; M675-L680 HydrophobicContact SD-CD2 3.76Å; M675-L680 HydrophobicContact SD-CG 3.8Å; L680-G682 PolarHBondContact O-N 3.34Å; L680-G682 VanDerWaalsContact O-N 3.12Å; L680-L683 HydrophobicContact CD1-CD1 3.82Å; L680-L683 HydrophobicContact CD1-CG 4.34Å; L680-L683 PolarHBondContact O-N 2.78Å; L680-L683 VanDerWaalsContact O-N 3.12Å; L680-Y684 HydrophobicContact CG-CE2 4.39Å; L680-L731 HydrophobicContact CD1-CD2 4.23Å; L680-L731 HydrophobicContact CD1-CG 4.46Å; L680-L731 HydrophobicContact CD2-CD1 3.79Å; L680-L731 HydrophobicContact CD2-CG 4.13Å; L680-L753 HydrophobicContact CD1-CD2 4.47Å
681	R	95.6	Very high	93.6	Very high	30 Å²	30	44.6 Å²	44.6	11%	0.113	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-59.2	-26	176.9	80	-173.8	-69.6	-93	-13.5	113.4	D642 E644 I645 M675 G679 L683 Y684	D642-R681 VanDerWaalsContact CG-NH2 3.34Å; D642-R681 IonicContact OD1-CZ 3.25Å; D642-R681 IonicContact OD1-NE 2.75Å; D642-R681 IonicContact OD1-NH2 3.82Å; D642-R681 PolarHBondContact OD1-NH2 3.13Å; D642-R681 IonicContact OD2-CZ 2.78Å; D642-R681 IonicContact OD2-NE 2.65Å; D642-R681 PolarHBondContact OD2-NE 2.81Å; D642-R681 IonicContact OD2-NH2 3.69Å; D642-R681 PolarHBondContact OD2-NH2 3.44Å; E644-R681 IonicContact OE2-CZ 2.7Å; E644-R681 IonicContact OE2-NH1 3.96Å; E644-R681 PolarHBondContact OE2-NH1 2.93Å; E644-R681 VanDerWaalsContact OE2-NH1 3.1Å; E644-R681 IonicContact OE2-NH2 2.76Å; E644-R681 PolarHBondContact OE2-NH2 2.84Å; I645-R681 HydrophobicContact CD1-CB 3.72Å; M675-R681 HydrophobicContact CB-CB 4.24Å; M675-R681 HydrophobicContact CE-CB 3.96Å; M675-R681 WeakPolarHBondContact O-CB 3.19Å; M675-R681 WeakPolarHBondContact O-CG 3.45Å; M675-R681 PolarHBondContact O-N 2.89Å; G679-R681 PolarHBondContact O-N 2.65Å; R681-L683 VanDerWaalsContact C-N 3.27Å; R681-L683 PolarHBondContact O-N 3.5Å; R681-Y684 PolarHBondContact O-N 3.25Å
682	G	94.1	Very high	93.5	Very high	18 Å²	18	48.5 Å²	48.5	19%	0.186	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-60.7	-34.1	177.4	0	0	0	0	0	113.2	G679 L680 Y684 K685 D690	G679-G682 PolarHBondContact O-N 2.71Å; L680-G682 PolarHBondContact O-N 3.34Å; L680-G682 VanDerWaalsContact O-N 3.12Å; G682-Y684 PolarHBondContact O-N 3.01Å; G682-K685 PolarHBondContact O-N 3.45Å; G682-D690 VanDerWaalsContact O-CB 3.31Å; G682-D690 WeakPolarHBondContact O-CB 3.34Å
683	L	94.3	Very high	93.5	Very high	3 Å²	3	48.5 Å²	48.5	2%	0.016	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-65.6	-23.4	-178.3	-55.2	-167.9	0	0	0	113.5	L680 R681 F688 D690 L691 K694 F728 L729	L680-L683 HydrophobicContact CD1-CD1 3.82Å; L680-L683 HydrophobicContact CD1-CG 4.34Å; L680-L683 PolarHBondContact O-N 2.78Å; L680-L683 VanDerWaalsContact O-N 3.12Å; R681-L683 VanDerWaalsContact C-N 3.27Å; R681-L683 PolarHBondContact O-N 3.5Å; L683-F688 WeakPolarHBondContact O-CD1 3.39Å; L683-D690 HydrophobicContact CD2-CB 4.39Å; L683-L691 HydrophobicContact CB-CB 4.38Å; L683-L691 HydrophobicContact CD1-CD1 4.3Å; L683-K694 HydrophobicContact CD2-CD 4.32Å; L683-K694 VanDerWaalsContact CD2-CE 3.47Å; L683-K694 HydrophobicContact CD2-CG 3.84Å; L683-F728 HydrophobicContact CD1-CB 4.05Å; L683-L729 HydrophobicContact CB-CD2 3.73Å; L683-L729 HydrophobicContact CD1-CD2 4.35Å
684	Y	91.4	Very high	93.5	Very high	28 Å²	28	48.3 Å²	48.3	11%	0.11	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-92	-13	-178.4	-65.7	-87.3	0	0	0	113.3	C648 L680 R681 G682 F688 L729	C648-Y684 HydrophobicContact CB-CD1 3.73Å; C648-Y684 HydrophobicContact CB-CD2 4.35Å; C648-Y684 HydrophobicContact CB-CE1 3.49Å; C648-Y684 VanDerWaalsContact CB-CE1 3.49Å; C648-Y684 HydrophobicContact CB-CE2 4.13Å; C648-Y684 HydrophobicContact CB-CG 4.14Å; C648-Y684 VanDerWaalsContact SG-CD1 3.56Å; C648-Y684 VanDerWaalsContact SG-CG 3.54Å; L680-Y684 HydrophobicContact CG-CE2 4.39Å; R681-Y684 PolarHBondContact O-N 3.25Å; G682-Y684 PolarHBondContact O-N 3.01Å; Y684-F688 AromaticContact CD1-CE1 3.85Å; Y684-F688 HydrophobicContact CD1-CE1 3.85Å; Y684-L729 HydrophobicContact CD1-CD2 4.14Å; Y684-L729 HydrophobicContact CD2-CD2 4.3Å; Y684-L729 HydrophobicContact CE1-CB 4.39Å; Y684-L729 HydrophobicContact CE1-CD1 4.28Å; Y684-L729 HydrophobicContact CE1-CD2 3.81Å; Y684-L729 HydrophobicContact CE1-CG 4.39Å; Y684-L729 HydrophobicContact CE2-CD2 4Å; Y684-L729 HydrophobicContact CG-CD2 4.39Å; Y684-L729 PolarHBondContact OH-O 2.86Å; Y684-L729 VanDerWaalsContact OH-O 3.12Å
685	K	89.4	Confident	93.6	Very high	49 Å²	49	48.7 Å²	48.7	21%	0.213	24%	0.242	C	C	.	.	S	Bend	trans	-75.7	161.6	-177.7	-67.9	-168.8	173.2	-154.3	0	112.8	E644 I645 G682 N687 F688	E644-K685 WeakPolarHBondContact OE1-CE 3.1Å; E644-K685 IonicContact OE1-NZ 2.97Å; E644-K685 PolarHBondContact OE1-NZ 3.42Å; E644-K685 WeakPolarHBondContact OE2-CE 3.3Å; E644-K685 IonicContact OE2-NZ 3.07Å; E644-K685 PolarHBondContact OE2-NZ 2.94Å; I645-K685 HydrophobicContact CG2-CG 4.12Å; G682-K685 PolarHBondContact O-N 3.45Å; K685-N687 VanDerWaalsContact C-N 3.3Å; K685-N687 PolarHBondContact O-N 3.44Å; K685-F688 WeakPolarHBondContact O-CA 3.4Å; K685-F688 PolarHBondContact O-N 3.33Å
686	N	86.4	Confident	93.6	Very high	130 Å²	130	51 Å²	51	70%	0.695	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	51.2	44.9	166.4	-58.5	-27.6	0	0	0	113.6	F688 E689	N686-F688 VanDerWaalsContact C-N 3.31Å; N686-F688 PolarHBondContact O-N 3.25Å; N686-E689 HydrophobicContact CB-CB 4.25Å; N686-E689 PolarHBondContact O-N 2.67Å
687	N	84.6	Confident	93.7	Very high	120 Å²	120	47.2 Å²	47.2	64%	0.642	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	54.3	43.1	-174.4	-58.4	1.9	0	0	0	113.3	K685 E689	K685-N687 VanDerWaalsContact C-N 3.3Å; K685-N687 PolarHBondContact O-N 3.44Å; N687-E689 VanDerWaalsContact C-N 3.33Å; N687-E689 PolarHBondContact O-N 3.2Å
688	F	91	Very high	93.9	Very high	88 Å²	88	41 Å²	41	39%	0.386	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	66.9	20	176.5	-49.7	-85.2	0	0	0	115.8	L683 Y684 K685 N686 D690 L691 H692 L729	L683-F688 WeakPolarHBondContact O-CD1 3.39Å; Y684-F688 AromaticContact CD1-CE1 3.85Å; Y684-F688 HydrophobicContact CD1-CE1 3.85Å; K685-F688 WeakPolarHBondContact O-CA 3.4Å; K685-F688 PolarHBondContact O-N 3.33Å; N686-F688 VanDerWaalsContact C-N 3.31Å; N686-F688 PolarHBondContact O-N 3.25Å; F688-D690 PolarHBondContact O-N 2.74Å; F688-L691 HydrophobicContact CB-CB 4.1Å; F688-L691 HydrophobicContact CB-CD2 4.13Å; F688-L691 HydrophobicContact CD1-CD2 4.1Å; F688-L691 HydrophobicContact CG-CD2 4.43Å; F688-L691 WeakPolarHBondContact O-CA 3.37Å; F688-L691 WeakPolarHBondContact O-CB 3.43Å; F688-L691 PolarHBondContact O-N 3.01Å; F688-H692 PolarHBondContact O-CD2 3.13Å; F688-H692 PolarHBondContact O-N 2.85Å; F688-L729 HydrophobicContact CE1-CD1 4.3Å
689	E	91.6	Very high	94	Very high	67 Å²	67	41 Å²	41	31%	0.313	21%	0.209	S	C	.	.	H	α-helix	trans	-50.7	-42.5	177.9	-175.5	74.6	-145.7	0	0	112.4	N686 N687 L691 H692 C693 Y821	N686-E689 HydrophobicContact CB-CB 4.25Å; N686-E689 PolarHBondContact O-N 2.67Å; N687-E689 VanDerWaalsContact C-N 3.33Å; N687-E689 PolarHBondContact O-N 3.2Å; E689-L691 VanDerWaalsContact C-N 3.31Å; E689-L691 PolarHBondContact O-N 2.97Å; E689-H692 PolarHBondContact O-N 2.99Å; E689-C693 PolarHBondContact O-N 3.49Å; E689-Y821 WeakPolarHBondContact OE1-CE1 3.41Å; E689-Y821 PolarHBondContact OE1-OH 3.46Å
690	D	93.8	Very high	94.1	Very high	71 Å²	71	42 Å²	42	38%	0.38	21%	0.205	S	C	.	.	H	α-helix	trans	-68.6	-29	-179.7	-121.6	67.8	0	0	0	113.3	G682 L683 F688 C693 K694	G682-D690 VanDerWaalsContact O-CB 3.31Å; G682-D690 WeakPolarHBondContact O-CB 3.34Å; L683-D690 HydrophobicContact CD2-CB 4.39Å; F688-D690 PolarHBondContact O-N 2.74Å; D690-C693 WeakPolarHBondContact O-CB 3.43Å; D690-K694 WeakPolarHBondContact O-CD 3.27Å; D690-K694 WeakPolarHBondContact O-CE 3.28Å; D690-K694 VanDerWaalsContact O-CG 3.26Å; D690-K694 WeakPolarHBondContact O-CG 3.46Å; D690-K694 PolarHBondContact O-N 3.44Å; D690-K694 PolarHBondContact O-NZ 3.09Å; D690-K694 IonicContact OD2-NZ 2.72Å; D690-K694 PolarHBondContact OD2-NZ 3.38Å
691	L	95.6	Very high	94.2	Very high	6 Å²	6	41.9 Å²	41.9	3%	0.031	20%	0.204	C	C	.	.	H	α-helix	trans	-76	-42.6	173.7	179	73.1	0	0	0	111.2	L683 F688 E689 C693 K694 F695 F728 L729	L683-L691 HydrophobicContact CB-CB 4.38Å; L683-L691 HydrophobicContact CD1-CD1 4.3Å; F688-L691 HydrophobicContact CB-CB 4.1Å; F688-L691 HydrophobicContact CB-CD2 4.13Å; F688-L691 HydrophobicContact CD1-CD2 4.1Å; F688-L691 HydrophobicContact CG-CD2 4.43Å; F688-L691 WeakPolarHBondContact O-CA 3.37Å; F688-L691 WeakPolarHBondContact O-CB 3.43Å; F688-L691 PolarHBondContact O-N 3.01Å; E689-L691 VanDerWaalsContact C-N 3.31Å; E689-L691 PolarHBondContact O-N 2.97Å; L691-C693 PolarHBondContact O-N 3.38Å; L691-K694 CarbonylContact O-C 3.5Å; L691-K694 WeakPolarHBondContact O-CA 3.49Å; L691-K694 WeakPolarHBondContact O-CB 3.28Å; L691-K694 PolarHBondContact O-N 3.46Å; L691-F695 HydrophobicContact CD1-CE1 4.03Å; L691-F695 HydrophobicContact CD1-CZ 3.85Å; L691-F695 HydrophobicContact CD2-CE2 3.98Å; L691-F695 HydrophobicContact CD2-CZ 3.66Å; L691-F695 HydrophobicContact CG-CE1 4.09Å; L691-F695 HydrophobicContact CG-CE2 3.77Å; L691-F695 HydrophobicContact CG-CZ 3.47Å; L691-F695 VanDerWaalsContact CG-CZ 3.47Å; L691-F695 PolarHBondContact O-N 3.36Å; L691-F728 HydrophobicContact CD1-CB 3.52Å; L691-F728 HydrophobicContact CD1-CG 4.22Å; L691-L729 HydrophobicContact CD1-CD2 3.99Å; L691-L729 HydrophobicContact CD1-CG 4.06Å; L691-L729 HydrophobicContact CD2-CD1 3.91Å; L691-L729 HydrophobicContact CD2-CD2 3.98Å; L691-L729 HydrophobicContact CD2-CG 3.94Å; L691-L729 HydrophobicContact CG-CD2 4.47Å
692	H	95.1	Very high	94.3	Very high	82 Å²	82	40.5 Å²	40.5	38%	0.38	20%	0.199	S	C	.	.	H	α-helix	trans	-60.6	-36.3	172.5	-72.9	-72.4	0	0	0	111.7	F688 E689 K694 F695 Y696 Y821	F688-H692 PolarHBondContact O-CD2 3.13Å; F688-H692 PolarHBondContact O-N 2.85Å; E689-H692 PolarHBondContact O-N 2.99Å; H692-K694 VanDerWaalsContact C-N 3.32Å; H692-K694 PolarHBondContact O-N 3.22Å; H692-F695 AromaticContact ND1-CD2 3.87Å; H692-F695 PolarHBondContact O-N 3.47Å; H692-Y696 PolarHBondContact O-N 2.89Å; H692-Y821 WeakPolarHBondContact CB-OH 3.42Å
693	C	96.6	Very high	94.4	Very high	5 Å²	5	43 Å²	43	3%	0.034	21%	0.206	C	C	.	.	H	α-helix	trans	-60	-38.3	167.9	-176.9	0	0	0	0	112.4	E689 D690 L691 Y696 Q697 Y821	E689-C693 PolarHBondContact O-N 3.49Å; D690-C693 WeakPolarHBondContact O-CB 3.43Å; L691-C693 PolarHBondContact O-N 3.38Å; C693-Y696 PolarHBondContact O-N 2.95Å; C693-Q697 VanDerWaalsContact O-CG 3.31Å; C693-Q697 WeakPolarHBondContact O-CG 3.35Å; C693-Q697 PolarHBondContact O-N 3.34Å; C693-Y821 HydrophobicContact CB-CD1 3.54Å; C693-Y821 HydrophobicContact CB-CE1 3.7Å; C693-Y821 HydrophobicContact CB-CG 4.19Å
694	K	97.4	Very high	94.5	Very high	27 Å²	27	47.2 Å²	47.2	12%	0.117	23%	0.226	C	C	.	.	H	α-helix	trans	-69.3	-36.3	175.6	-49.7	-36.7	171.7	-124.1	0	112.1	L683 D690 L691 H692 Q697 L698 F728 F757	L683-K694 HydrophobicContact CD2-CD 4.32Å; L683-K694 VanDerWaalsContact CD2-CE 3.47Å; L683-K694 HydrophobicContact CD2-CG 3.84Å; D690-K694 WeakPolarHBondContact O-CD 3.27Å; D690-K694 WeakPolarHBondContact O-CE 3.28Å; D690-K694 VanDerWaalsContact O-CG 3.26Å; D690-K694 WeakPolarHBondContact O-CG 3.46Å; D690-K694 PolarHBondContact O-N 3.44Å; D690-K694 PolarHBondContact O-NZ 3.09Å; D690-K694 IonicContact OD2-NZ 2.72Å; D690-K694 PolarHBondContact OD2-NZ 3.38Å; L691-K694 CarbonylContact O-C 3.5Å; L691-K694 WeakPolarHBondContact O-CA 3.49Å; L691-K694 WeakPolarHBondContact O-CB 3.28Å; L691-K694 PolarHBondContact O-N 3.46Å; H692-K694 VanDerWaalsContact C-N 3.32Å; H692-K694 PolarHBondContact O-N 3.22Å; K694-Q697 VanDerWaalsContact CD-OE1 3.26Å; K694-Q697 PolarHBondContact O-N 3.34Å; K694-L698 WeakPolarHBondContact O-CB 3.48Å; K694-L698 PolarHBondContact O-N 3.29Å; K694-F728 HydrophobicContact CB-CD1 3.99Å; K694-F728 HydrophobicContact CB-CD2 4.48Å; K694-F728 HydrophobicContact CB-CE1 3.82Å; K694-F728 HydrophobicContact CB-CE2 4.32Å; K694-F728 HydrophobicContact CB-CG 4.33Å; K694-F728 HydrophobicContact CB-CZ 3.99Å; K694-F728 HydrophobicContact CG-CD1 4.24Å; K694-F728 HydrophobicContact CG-CE1 4.35Å; K694-F757 HydrophobicContact CB-CE1 4.46Å; K694-F757 HydrophobicContact CB-CZ 3.9Å; K694-F757 HydrophobicContact CD-CZ 4.2Å; K694-F757 HydrophobicContact CG-CZ 4.38Å; K694-F757 WeakPolarHBondContact O-CE1 3.49Å
695	F	97.6	Very high	94.7	Very high	9 Å²	9	49.4 Å²	49.4	4%	0.039	24%	0.237	C	C	.	.	H	α-helix	trans	-60.5	-47.7	172.5	-60.2	-33.5	0	0	0	111.3	L691 H692 Q697 L698 E699 A720 H721 A724 S725 F728	L691-F695 HydrophobicContact CD1-CE1 4.03Å; L691-F695 HydrophobicContact CD1-CZ 3.85Å; L691-F695 HydrophobicContact CD2-CE2 3.98Å; L691-F695 HydrophobicContact CD2-CZ 3.66Å; L691-F695 HydrophobicContact CG-CE1 4.09Å; L691-F695 HydrophobicContact CG-CE2 3.77Å; L691-F695 HydrophobicContact CG-CZ 3.47Å; L691-F695 VanDerWaalsContact CG-CZ 3.47Å; L691-F695 PolarHBondContact O-N 3.36Å; H692-F695 AromaticContact ND1-CD2 3.87Å; H692-F695 PolarHBondContact O-N 3.47Å; F695-Q697 VanDerWaalsContact C-N 3.33Å; F695-Q697 PolarHBondContact O-N 3.04Å; F695-L698 PolarHBondContact O-N 3.08Å; F695-L698 VanDerWaalsContact O-N 3.12Å; F695-E699 PolarHBondContact O-N 2.65Å; F695-A720 HydrophobicContact CB-CB 4.01Å; F695-A720 HydrophobicContact CD1-CB 4.23Å; F695-A720 HydrophobicContact CG-CB 4.34Å; F695-H721 HydrophobicContact CD2-CB 3.63Å; F695-H721 HydrophobicContact CE2-CB 3.48Å; F695-H721 VanDerWaalsContact CE2-CB 3.48Å; F695-H721 HydrophobicContact CG-CB 4.38Å; F695-H721 HydrophobicContact CZ-CB 4.1Å; F695-A724 HydrophobicContact CD1-CB 4.34Å; F695-A724 HydrophobicContact CE1-CB 4.19Å; F695-S725 VanDerWaalsContact CZ-OG 3.25Å; F695-S725 WeakPolarHBondContact CZ-OG 3.43Å; F695-F728 HydrophobicContact CD1-CD2 4.3Å; F695-F728 HydrophobicContact CD1-CE2 4.36Å; F695-F728 HydrophobicContact CE1-CD2 4.07Å
696	Y	97.1	Very high	95	Very high	48 Å²	48	47.6 Å²	47.6	19%	0.188	23%	0.229	C	C	.	.	H	α-helix	trans	-59.5	-41.7	174.8	-174.7	-90.1	0	0	0	112.4	H692 C693 K700 F817 E820 Y821 L824	H692-Y696 PolarHBondContact O-N 2.89Å; C693-Y696 PolarHBondContact O-N 2.95Å; Y696-K700 HydrophobicContact CD1-CG 4.04Å; Y696-K700 HydrophobicContact CE1-CD 4.4Å; Y696-K700 HydrophobicContact CE1-CG 3.74Å; Y696-K700 WeakPolarHBondContact O-CB 3.49Å; Y696-K700 VanDerWaalsContact O-CG 3.26Å; Y696-K700 WeakPolarHBondContact O-CG 3.04Å; Y696-K700 PolarHBondContact O-N 3.27Å; Y696-K700 WeakPolarHBondContact OH-CE 3.44Å; Y696-F817 HydrophobicContact CD1-CB 4.4Å; Y696-F817 HydrophobicContact CE1-CB 4.38Å; Y696-F817 WeakPolarHBondContact CE1-O 3.25Å; Y696-E820 HydrophobicContact CE1-CB 4.19Å; Y696-Y821 HydrophobicContact CD1-CD2 4.31Å; Y696-Y821 HydrophobicContact CD1-CG 4.48Å; Y696-Y821 AromaticContact CD2-CD2 3.98Å; Y696-Y821 HydrophobicContact CD2-CD2 3.98Å; Y696-Y821 AromaticContact CG-CD2 3.72Å; Y696-Y821 HydrophobicContact CG-CD2 3.72Å; Y696-Y821 HydrophobicContact CG-CG 4.31Å; Y696-L824 HydrophobicContact CE2-CD2 4.06Å
697	Q	97.7	Very high	95.5	Very high	7 Å²	7	44.8 Å²	44.8	3%	0.033	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-41.7	174.1	-75.7	174.6	-29.9	0	0	112.3	C693 K694 F695 L701 F757 L814 F817	C693-Q697 VanDerWaalsContact O-CG 3.31Å; C693-Q697 WeakPolarHBondContact O-CG 3.35Å; C693-Q697 PolarHBondContact O-N 3.34Å; K694-Q697 VanDerWaalsContact CD-OE1 3.26Å; K694-Q697 PolarHBondContact O-N 3.34Å; F695-Q697 VanDerWaalsContact C-N 3.33Å; F695-Q697 PolarHBondContact O-N 3.04Å; Q697-L701 WeakPolarHBondContact O-CD1 3.47Å; Q697-L701 VanDerWaalsContact O-CG 3.26Å; Q697-L701 WeakPolarHBondContact O-CG 3.37Å; Q697-L701 PolarHBondContact O-N 2.79Å; Q697-F757 HydrophobicContact CB-CE1 3.55Å; Q697-F757 HydrophobicContact CB-CZ 3.67Å; Q697-F757 HydrophobicContact CG-CZ 4.49Å; Q697-F757 VanDerWaalsContact OE1-CZ 3.23Å; Q697-L814 HydrophobicContact CB-CD2 4.05Å; Q697-L814 HydrophobicContact CG-CD2 4.24Å; Q697-L814 PolarHBondContact NE2-O 2.98Å; Q697-F817 HydrophobicContact CG-CB 3.93Å
698	L	97.9	Very high	96.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-66.8	-48.3	178.2	178.9	59.7	0	0	0	111.1	K694 F695 K700 L701 M702 A720 A724 F728 F757 A760 L761 L764	K694-L698 WeakPolarHBondContact O-CB 3.48Å; K694-L698 PolarHBondContact O-N 3.29Å; F695-L698 PolarHBondContact O-N 3.08Å; F695-L698 VanDerWaalsContact O-N 3.12Å; L698-K700 VanDerWaalsContact C-N 3.3Å; L698-K700 PolarHBondContact O-N 3.19Å; L698-L701 CarbonylContact O-C 3.59Å; L698-L701 WeakPolarHBondContact O-CB 3.46Å; L698-L701 PolarHBondContact O-N 3.42Å; L698-M702 HydrophobicContact CD1-CG 4.47Å; L698-M702 HydrophobicContact CG-SD 4.27Å; L698-M702 WeakPolarHBondContact O-CG 3.35Å; L698-M702 PolarHBondContact O-N 2.64Å; L698-A720 HydrophobicContact CD2-CB 4.42Å; L698-A724 HydrophobicContact CD2-CB 3.91Å; L698-F728 HydrophobicContact CB-CZ 4.44Å; L698-F728 HydrophobicContact CD2-CE2 4.07Å; L698-F728 HydrophobicContact CD2-CZ 4.45Å; L698-F757 HydrophobicContact CB-CD1 4.23Å; L698-F757 HydrophobicContact CB-CE1 4.09Å; L698-F757 HydrophobicContact CD1-CD1 4.43Å; L698-A760 HydrophobicContact CD1-CB 3.91Å; L698-A760 HydrophobicContact CD2-CB 4.28Å; L698-L761 HydrophobicContact CD1-CD2 4.15Å; L698-L761 HydrophobicContact CD1-CG 4.28Å; L698-L764 HydrophobicContact CD1-CD1 4.33Å
699	E	97.1	Very high	96.4	Very high	40 Å²	40	38.4 Å²	38.4	19%	0.187	19%	0.188	C	C	.	.	H	α-helix	trans	-62.2	-36.4	178.2	-70.7	-179.6	-170.3	0	0	112.2	F695 M702 Q703 A720	F695-E699 PolarHBondContact O-N 2.65Å; E699-M702 PolarHBondContact O-N 3.36Å; E699-Q703 WeakPolarHBondContact O-CB 3.19Å; E699-Q703 PolarHBondContact O-N 3.24Å; E699-A720 HydrophobicContact CG-CB 3.78Å; E699-A720 WeakPolarHBondContact OE1-CB 3.37Å; E699-A720 PolarHBondContact OE1-N 3.42Å
700	K	97.1	Very high	96.7	Very high	51 Å²	51	37.9 Å²	37.9	22%	0.222	18%	0.183	C	C	.	.	H	α-helix	trans	-67.2	-35.4	172.7	-72.8	-70.8	163.1	-145.2	0	113	Y696 L698 E704 F817	Y696-K700 HydrophobicContact CD1-CG 4.04Å; Y696-K700 HydrophobicContact CE1-CD 4.4Å; Y696-K700 HydrophobicContact CE1-CG 3.74Å; Y696-K700 WeakPolarHBondContact O-CB 3.49Å; Y696-K700 VanDerWaalsContact O-CG 3.26Å; Y696-K700 WeakPolarHBondContact O-CG 3.04Å; Y696-K700 PolarHBondContact O-N 3.27Å; Y696-K700 WeakPolarHBondContact OH-CE 3.44Å; L698-K700 VanDerWaalsContact C-N 3.3Å; L698-K700 PolarHBondContact O-N 3.19Å; K700-E704 WeakPolarHBondContact O-CG 3.19Å; K700-E704 PolarHBondContact O-N 3.3Å; K700-E704 VanDerWaalsContact O-N 3.17Å; K700-F817 HydrophobicContact CB-CD1 3.8Å; K700-F817 HydrophobicContact CB-CD2 3.77Å; K700-F817 HydrophobicContact CB-CE1 3.83Å; K700-F817 HydrophobicContact CB-CE2 3.8Å; K700-F817 HydrophobicContact CB-CG 3.79Å; K700-F817 HydrophobicContact CB-CZ 3.83Å; K700-F817 HydrophobicContact CD-CD1 4.39Å; K700-F817 HydrophobicContact CD-CE1 4.4Å; K700-F817 HydrophobicContact CG-CD1 3.97Å; K700-F817 HydrophobicContact CG-CE1 4.28Å; K700-F817 HydrophobicContact CG-CG 4.18Å
701	L	97.3	Very high	96.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-71.2	-36.4	173.5	-70.6	163.6	0	0	0	112	Q697 L698 E704 Q705 F757 L761 V809 L814 F817	Q697-L701 WeakPolarHBondContact O-CD1 3.47Å; Q697-L701 VanDerWaalsContact O-CG 3.26Å; Q697-L701 WeakPolarHBondContact O-CG 3.37Å; Q697-L701 PolarHBondContact O-N 2.79Å; L698-L701 CarbonylContact O-C 3.59Å; L698-L701 WeakPolarHBondContact O-CB 3.46Å; L698-L701 PolarHBondContact O-N 3.42Å; L701-E704 PolarHBondContact O-N 3.23Å; L701-Q705 WeakPolarHBondContact O-CB 3.47Å; L701-Q705 WeakPolarHBondContact O-CG 3.34Å; L701-Q705 PolarHBondContact O-N 3.2Å; L701-F757 HydrophobicContact CD1-CB 4.15Å; L701-F757 HydrophobicContact CD1-CD1 3.77Å; L701-F757 HydrophobicContact CD1-CG 4.13Å; L701-L761 HydrophobicContact CB-CD1 3.97Å; L701-L761 HydrophobicContact CB-CD2 4.04Å; L701-L761 HydrophobicContact CD1-CD1 4.24Å; L701-V809 HydrophobicContact CD1-CG1 3.79Å; L701-V809 HydrophobicContact CD2-CG1 4.25Å; L701-L814 HydrophobicContact CD1-CD2 3.89Å; L701-F817 HydrophobicContact CD2-CE2 4.04Å; L701-F817 HydrophobicContact CG-CE2 4.12Å
702	M	97.3	Very high	97	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-63.1	-46.4	170.7	-67.6	172.5	69.8	0	0	111	L698 E699 E704 Q705 L706 L709 W710 F713 Y723 L761 L764	L698-M702 HydrophobicContact CD1-CG 4.47Å; L698-M702 HydrophobicContact CG-SD 4.27Å; L698-M702 WeakPolarHBondContact O-CG 3.35Å; L698-M702 PolarHBondContact O-N 2.64Å; E699-M702 PolarHBondContact O-N 3.36Å; M702-E704 PolarHBondContact O-N 2.9Å; M702-Q705 PolarHBondContact O-N 3.33Å; M702-L706 CarbonylContact O-C 3.58Å; M702-L706 WeakPolarHBondContact O-CA 3.42Å; M702-L706 PolarHBondContact O-N 3.18Å; M702-L709 HydrophobicContact CE-CD2 4.37Å; M702-L709 HydrophobicContact CE-CG 4.36Å; M702-W710 HydrophobicContact CB-CB 4.14Å; M702-W710 HydrophobicContact CB-CG 4.48Å; M702-F713 HydrophobicContact CE-CD2 3.77Å; M702-F713 HydrophobicContact CE-CE2 3.93Å; M702-Y723 PolarHBondContact SD-OH 2.98Å; M702-Y723 VanDerWaalsContact SD-OH 3.41Å; M702-L761 HydrophobicContact CG-CD2 4.17Å; M702-L764 HydrophobicContact CE-CD1 4.02Å; M702-L764 HydrophobicContact CE-CD2 4.3Å; M702-L764 HydrophobicContact CG-CD1 4.01Å; M702-L764 HydrophobicContact SD-CD1 3.66Å
703	Q	97	Very high	97.1	Very high	71 Å²	71	34 Å²	34	33%	0.332	17%	0.168	S	C	.	.	H	α-helix	trans	-58.1	-31.1	176.4	-173.6	170.8	48.8	0	0	112.9	E699 W710	E699-Q703 WeakPolarHBondContact O-CB 3.19Å; E699-Q703 PolarHBondContact O-N 3.24Å; Q703-W710 HydrophobicContact CB-CD2 3.86Å; Q703-W710 HydrophobicContact CB-CE3 4.43Å; Q703-W710 HydrophobicContact CB-CG 3.93Å; Q703-W710 HydrophobicContact CG-CD2 3.95Å; Q703-W710 HydrophobicContact CG-CE3 4.04Å; Q703-W710 HydrophobicContact CG-CZ2 4.4Å; Q703-W710 HydrophobicContact CG-CZ3 4.33Å; Q703-W710 VanDerWaalsContact NE2-CZ2 3.29Å
704	E	95.5	Very high	97.1	Very high	92 Å²	92	38 Å²	38	43%	0.43	19%	0.187	S	C	.	.	H	α-helix	trans	-85.9	-31.5	175.9	-73.6	-170.5	143.1	0	0	115	K700 L701 M702 K813	K700-E704 WeakPolarHBondContact O-CG 3.19Å; K700-E704 PolarHBondContact O-N 3.3Å; K700-E704 VanDerWaalsContact O-N 3.17Å; L701-E704 PolarHBondContact O-N 3.23Å; M702-E704 PolarHBondContact O-N 2.9Å; E704-K813 IonicContact OE1-NZ 3.67Å; E704-K813 PolarHBondContact OE1-NZ 2.86Å; E704-K813 VanDerWaalsContact OE2-CD 3.3Å; E704-K813 WeakPolarHBondContact OE2-CD 3.27Å; E704-K813 IonicContact OE2-NZ 2.72Å; E704-K813 PolarHBondContact OE2-NZ 2.69Å
705	Q	95.2	Very high	97.1	Very high	73 Å²	73	44.1 Å²	44.1	34%	0.341	22%	0.216	S	C	.	.	H	α-helix	trans	-117.7	-22.5	-167	-58.8	-169.7	52.9	0	0	114.8	L701 M702 K808	L701-Q705 WeakPolarHBondContact O-CB 3.47Å; L701-Q705 WeakPolarHBondContact O-CG 3.34Å; L701-Q705 PolarHBondContact O-N 3.2Å; M702-Q705 PolarHBondContact O-N 3.33Å; Q705-K808 PolarHBondContact NE2-O 2.94Å
706	L	96.4	Very high	96.9	Very high	11 Å²	11	45.5 Å²	45.5	6%	0.058	22%	0.224	C	C	.	.	S	Bend	trans	-136.5	55.2	-179.9	-58.7	173.5	0	0	0	109.4	M702 D708 L709 W710 L764 K765	M702-L706 CarbonylContact O-C 3.58Å; M702-L706 WeakPolarHBondContact O-CA 3.42Å; M702-L706 PolarHBondContact O-N 3.18Å; L706-D708 VanDerWaalsContact C-N 3.27Å; L706-D708 PolarHBondContact O-N 3.38Å; L706-L709 HydrophobicContact CB-CB 4.19Å; L706-L709 HydrophobicContact CD1-CD2 4.21Å; L706-L709 PolarHBondContact O-N 2.72Å; L706-W710 PolarHBondContact O-N 2.62Å; L706-L764 HydrophobicContact CD1-CB 3.79Å; L706-K765 HydrophobicContact CD1-CB 4.2Å; L706-K765 HydrophobicContact CD2-CB 3.9Å; L706-K765 HydrophobicContact CD2-CG 3.95Å
707	P	97.4	Very high	96.8	Very high	72 Å²	72	49.1 Å²	49.1	47%	0.468	25%	0.246	S	C	.	.	H	α-helix	trans	-65.7	-27	-164.6	27.1	-36.6	0	0	0	114	A711	P707-A711 WeakPolarHBondContact O-CB 3.47Å; P707-A711 PolarHBondContact O-N 2.68Å
708	D	97.2	Very high	96.5	Very high	73 Å²	73	49 Å²	49	39%	0.39	25%	0.246	S	C	.	.	H	α-helix	trans	-76	-44.8	175.8	40	18.5	0	0	0	112	L706 W710 A711 H712 K768	L706-D708 VanDerWaalsContact C-N 3.27Å; L706-D708 PolarHBondContact O-N 3.38Å; D708-W710 VanDerWaalsContact C-N 3.29Å; D708-W710 PolarHBondContact O-N 3.42Å; D708-A711 PolarHBondContact O-N 3.37Å; D708-H712 PolarHBondContact O-N 3.44Å; D708-K768 WeakPolarHBondContact OD1-CE 3.38Å; D708-K768 IonicContact OD1-NZ 3.44Å; D708-K768 PolarHBondContact OD1-NZ 3.03Å; D708-K768 IonicContact OD2-NZ 2.94Å; D708-K768 PolarHBondContact OD2-NZ 2.64Å
709	L	97.4	Very high	96.2	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62	-38.4	171	-175.1	64.4	0	0	0	111.7	M702 L706 F713 L764 K768 L771 L772	M702-L709 HydrophobicContact CE-CD2 4.37Å; M702-L709 HydrophobicContact CE-CG 4.36Å; L706-L709 HydrophobicContact CB-CB 4.19Å; L706-L709 HydrophobicContact CD1-CD2 4.21Å; L706-L709 PolarHBondContact O-N 2.72Å; L709-F713 HydrophobicContact CD1-CD1 4.04Å; L709-F713 HydrophobicContact CD1-CE1 3.52Å; L709-F713 HydrophobicContact CD1-CZ 4Å; L709-F713 HydrophobicContact CG-CD1 4.45Å; L709-F713 HydrophobicContact CG-CE1 4.16Å; L709-F713 HydrophobicContact CG-CZ 4.35Å; L709-F713 WeakPolarHBondContact O-CD1 3.25Å; L709-F713 WeakPolarHBondContact O-CG 3.4Å; L709-F713 PolarHBondContact O-N 3.1Å; L709-L764 HydrophobicContact CD2-CB 4.08Å; L709-L764 HydrophobicContact CD2-CD2 4.24Å; L709-K768 HydrophobicContact CB-CG 4.5Å; L709-L771 HydrophobicContact CD1-CB 3.59Å; L709-L771 HydrophobicContact CD1-CD1 4.32Å; L709-L771 HydrophobicContact CD2-CD1 4.35Å; L709-L772 HydrophobicContact CD1-CD2 4.35Å; L709-L772 HydrophobicContact CD1-CG 4.35Å
710	W	97.8	Very high	96.1	Very high	57 Å²	57	52 Å²	52	22%	0.216	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-44.2	173.5	179.6	81.9	0	0	0	111.9	M702 Q703 L706 D708 F713 Q714	M702-W710 HydrophobicContact CB-CB 4.14Å; M702-W710 HydrophobicContact CB-CG 4.48Å; Q703-W710 HydrophobicContact CB-CD2 3.86Å; Q703-W710 HydrophobicContact CB-CE3 4.43Å; Q703-W710 HydrophobicContact CB-CG 3.93Å; Q703-W710 HydrophobicContact CG-CD2 3.95Å; Q703-W710 HydrophobicContact CG-CE3 4.04Å; Q703-W710 HydrophobicContact CG-CZ2 4.4Å; Q703-W710 HydrophobicContact CG-CZ3 4.33Å; Q703-W710 VanDerWaalsContact NE2-CZ2 3.29Å; L706-W710 PolarHBondContact O-N 2.62Å; D708-W710 VanDerWaalsContact C-N 3.29Å; D708-W710 PolarHBondContact O-N 3.42Å; W710-F713 PolarHBondContact O-N 2.98Å; W710-Q714 HydrophobicContact CD2-CG 4.1Å; W710-Q714 HydrophobicContact CE3-CG 4.35Å; W710-Q714 HydrophobicContact CH2-CG 3.85Å; W710-Q714 HydrophobicContact CZ2-CG 3.58Å; W710-Q714 HydrophobicContact CZ3-CG 4.24Å; W710-Q714 WeakPolarHBondContact O-CG 3.49Å; W710-Q714 PolarHBondContact O-N 2.95Å
711	A	97.7	Very high	95.7	Very high	35 Å²	35	52.9 Å²	52.9	29%	0.289	27%	0.265	S	S	.	.	H	α-helix	trans	-61.7	-46.8	176.9	0	0	0	0	0	111.9	P707 D708 F713 Q714 E715	P707-A711 WeakPolarHBondContact O-CB 3.47Å; P707-A711 PolarHBondContact O-N 2.68Å; D708-A711 PolarHBondContact O-N 3.37Å; A711-F713 VanDerWaalsContact C-N 3.3Å; A711-F713 PolarHBondContact O-N 2.91Å; A711-Q714 PolarHBondContact O-N 2.88Å; A711-Q714 VanDerWaalsContact O-N 3.1Å; A711-E715 PolarHBondContact O-N 3.28Å
712	H	97.4	Very high	95.4	Very high	37 Å²	37	56.2 Å²	56.2	17%	0.171	28%	0.281	C	S	.	.	H	α-helix	trans	-57	-42.1	175.2	-173.2	64.9	0	0	0	112.3	D708 Q714 E715 L716 L771 L772 A774	D708-H712 PolarHBondContact O-N 3.44Å; H712-Q714 PolarHBondContact O-N 2.99Å; H712-E715 PolarHBondContact O-N 3.29Å; H712-L716 WeakPolarHBondContact NE2-CD1 3.35Å; H712-L716 WeakPolarHBondContact O-CG 3.22Å; H712-L716 PolarHBondContact O-N 3.42Å; H712-L771 PolarHBondContact CD2-O 3.47Å; H712-L771 PolarHBondContact NE2-O 3.39Å; H712-L771 VanDerWaalsContact NE2-O 3.08Å; H712-L772 HydrophobicContact CB-CD2 3.68Å; H712-A774 PolarHBondContact NE2-O 2.8Å
713	F	97.2	Very high	95.2	Very high	4 Å²	4	57 Å²	57	2%	0.018	28%	0.284	C	S	.	.	H	α-helix	trans	-67.7	-33.8	177.5	-79.7	22.7	0	0	0	112.4	M702 L709 W710 A711 N717 L718 Y723 L764 L771 F783	M702-F713 HydrophobicContact CE-CD2 3.77Å; M702-F713 HydrophobicContact CE-CE2 3.93Å; L709-F713 HydrophobicContact CD1-CD1 4.04Å; L709-F713 HydrophobicContact CD1-CE1 3.52Å; L709-F713 HydrophobicContact CD1-CZ 4Å; L709-F713 HydrophobicContact CG-CD1 4.45Å; L709-F713 HydrophobicContact CG-CE1 4.16Å; L709-F713 HydrophobicContact CG-CZ 4.35Å; L709-F713 WeakPolarHBondContact O-CD1 3.25Å; L709-F713 WeakPolarHBondContact O-CG 3.4Å; L709-F713 PolarHBondContact O-N 3.1Å; W710-F713 PolarHBondContact O-N 2.98Å; A711-F713 VanDerWaalsContact C-N 3.3Å; A711-F713 PolarHBondContact O-N 2.91Å; F713-N717 PolarHBondContact O-N 2.84Å; F713-L718 HydrophobicContact CB-CB 4.34Å; F713-L718 HydrophobicContact CD1-CD2 4.04Å; F713-L718 HydrophobicContact CD2-CD2 4.1Å; F713-L718 HydrophobicContact CD2-CG 4.29Å; F713-L718 HydrophobicContact CE1-CD2 3.9Å; F713-L718 HydrophobicContact CE2-CD2 3.98Å; F713-L718 HydrophobicContact CE2-CG 4.49Å; F713-L718 HydrophobicContact CG-CB 4.33Å; F713-L718 HydrophobicContact CG-CD2 4.14Å; F713-L718 HydrophobicContact CG-CG 4.46Å; F713-L718 HydrophobicContact CZ-CD2 3.88Å; F713-L718 PolarHBondContact O-N 3.07Å; F713-Y723 AromaticContact CD2-CE1 4Å; F713-Y723 HydrophobicContact CD2-CE1 4Å; F713-Y723 AromaticContact CE2-CE1 3.71Å; F713-Y723 HydrophobicContact CE2-CE1 3.71Å; F713-Y723 AromaticContact CE2-CZ 3.84Å; F713-L764 HydrophobicContact CE2-CD2 4.27Å; F713-L764 HydrophobicContact CZ-CD2 4.47Å; F713-L771 HydrophobicContact CE1-CB 4.24Å; F713-L771 HydrophobicContact CZ-CB 4.46Å; F713-L771 HydrophobicContact CZ-CD1 4.19Å; F713-L771 HydrophobicContact CZ-CD2 4.26Å; F713-F783 HydrophobicContact CE2-CE2 4.05Å; F713-F783 AromaticContact CE2-CZ 3.92Å; F713-F783 HydrophobicContact CE2-CZ 3.92Å; F713-F783 AromaticContact CZ-CE2 3.82Å; F713-F783 HydrophobicContact CZ-CE2 3.82Å; F713-F783 AromaticContact CZ-CZ 3.71Å; F713-F783 HydrophobicContact CZ-CZ 3.71Å
714	Q	96.8	Very high	95.1	Very high	89 Å²	89	53.6 Å²	53.6	42%	0.416	27%	0.268	S	S	.	.	H	α-helix	trans	-69	-39.5	172.2	-64.3	-69.6	-44	0	0	111.7	W710 A711 H712 L716 N717	W710-Q714 HydrophobicContact CD2-CG 4.1Å; W710-Q714 HydrophobicContact CE3-CG 4.35Å; W710-Q714 HydrophobicContact CH2-CG 3.85Å; W710-Q714 HydrophobicContact CZ2-CG 3.58Å; W710-Q714 HydrophobicContact CZ3-CG 4.24Å; W710-Q714 WeakPolarHBondContact O-CG 3.49Å; W710-Q714 PolarHBondContact O-N 2.95Å; A711-Q714 PolarHBondContact O-N 2.88Å; A711-Q714 VanDerWaalsContact O-N 3.1Å; H712-Q714 PolarHBondContact O-N 2.99Å; Q714-L716 VanDerWaalsContact C-N 3.33Å; Q714-L716 PolarHBondContact O-N 3.24Å; Q714-N717 PolarHBondContact O-N 3.33Å; Q714-N717 VanDerWaalsContact O-N 3.15Å
715	E	96.4	Very high	94.9	Very high	156 Å²	156	51 Å²	51	73%	0.729	26%	0.26	S	S	*	.	H	α-helix	trans	-64.5	-36.2	175.4	-71.2	178.7	-156	0	0	112.2	A711 H712 N717	A711-E715 PolarHBondContact O-N 3.28Å; H712-E715 PolarHBondContact O-N 3.29Å; E715-N717 PolarHBondContact O-ND2 2.89Å
716	L	94.2	Very high	94.8	Very high	39 Å²	39	52 Å²	52	20%	0.204	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-8.9	172.9	-67.8	-179.7	0	0	0	114.7	H712 Q714 L718 F776	H712-L716 WeakPolarHBondContact NE2-CD1 3.35Å; H712-L716 WeakPolarHBondContact O-CG 3.22Å; H712-L716 PolarHBondContact O-N 3.42Å; Q714-L716 VanDerWaalsContact C-N 3.33Å; Q714-L716 PolarHBondContact O-N 3.24Å; L716-L718 HydrophobicContact CB-CB 4.2Å; L716-L718 PolarHBondContact O-N 3.19Å; L716-F776 WeakPolarHBondContact O-CD2 3.35Å
717	N	94.4	Very high	94.8	Very high	123 Å²	123	52 Å²	52	66%	0.658	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	34.9	-169.2	-53.1	-98.3	0	0	0	113.3	F713 Q714 E715 E719	F713-N717 PolarHBondContact O-N 2.84Å; Q714-N717 PolarHBondContact O-N 3.33Å; Q714-N717 VanDerWaalsContact O-N 3.15Å; E715-N717 PolarHBondContact O-ND2 2.89Å; N717-E719 PolarHBondContact O-N 2.97Å
718	L	91.9	Very high	94.7	Very high	5 Å²	5	48.9 Å²	48.9	3%	0.026	24%	0.243	C	C	.	.			trans	-91.3	84.4	-178.2	-176.1	61.7	0	0	0	111.2	F713 L716 M722 Y723 F776 A779 L780 F783	F713-L718 HydrophobicContact CB-CB 4.34Å; F713-L718 HydrophobicContact CD1-CD2 4.04Å; F713-L718 HydrophobicContact CD2-CD2 4.1Å; F713-L718 HydrophobicContact CD2-CG 4.29Å; F713-L718 HydrophobicContact CE1-CD2 3.9Å; F713-L718 HydrophobicContact CE2-CD2 3.98Å; F713-L718 HydrophobicContact CE2-CG 4.49Å; F713-L718 HydrophobicContact CG-CB 4.33Å; F713-L718 HydrophobicContact CG-CD2 4.14Å; F713-L718 HydrophobicContact CG-CG 4.46Å; F713-L718 HydrophobicContact CZ-CD2 3.88Å; F713-L718 PolarHBondContact O-N 3.07Å; L716-L718 HydrophobicContact CB-CB 4.2Å; L716-L718 PolarHBondContact O-N 3.19Å; L718-M722 HydrophobicContact CD1-CB 4.3Å; L718-M722 HydrophobicContact CD1-SD 3.99Å; L718-Y723 HydrophobicContact CD1-CD1 4.47Å; L718-Y723 HydrophobicContact CG-CD1 4.35Å; L718-Y723 HydrophobicContact CG-CE1 4.4Å; L718-F776 HydrophobicContact CB-CD2 4.38Å; L718-F776 HydrophobicContact CD1-CD2 4.17Å; L718-F776 HydrophobicContact CD1-CE2 3.98Å; L718-A779 HydrophobicContact CD2-CB 3.59Å; L718-L780 HydrophobicContact CD1-CD2 3.78Å; L718-L780 HydrophobicContact CD1-CG 4.08Å; L718-F783 HydrophobicContact CD2-CE2 4.33Å
719	E	91.4	Very high	94.5	Very high	102 Å²	102	46.6 Å²	46.6	48%	0.477	23%	0.231	S	C	.	.			trans	-68.4	150.6	178.9	-67.7	-176.7	-147.2	0	0	113.5	N717 H721 M722	N717-E719 PolarHBondContact O-N 2.97Å; E719-H721 WeakPolarHBondContact CB-ND1 3.33Å; E719-H721 PolarHBondContact O-N 2.86Å; E719-H721 VanDerWaalsContact O-N 3.12Å; E719-H721 IonicContact OE2-CE1 3.75Å; E719-H721 PolarHBondContact OE2-CE1 3.13Å; E719-H721 IonicContact OE2-ND1 3.96Å; E719-H721 PolarHBondContact OE2-ND1 3.14Å; E719-M722 HydrophobicContact CB-CE 4.26Å; E719-M722 HydrophobicContact CB-CG 4.49Å; E719-M722 HydrophobicContact CG-CE 4.49Å; E719-M722 WeakPolarHBondContact O-CB 3.38Å; E719-M722 PolarHBondContact O-N 2.83Å
720	A	94.4	Very high	94.4	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.9	179.3	0	0	0	0	0	114.2	F695 L698 E699 M722 Y723 A724	F695-A720 HydrophobicContact CB-CB 4.01Å; F695-A720 HydrophobicContact CD1-CB 4.23Å; F695-A720 HydrophobicContact CG-CB 4.34Å; L698-A720 HydrophobicContact CD2-CB 4.42Å; E699-A720 HydrophobicContact CG-CB 3.78Å; E699-A720 WeakPolarHBondContact OE1-CB 3.37Å; E699-A720 PolarHBondContact OE1-N 3.42Å; A720-M722 PolarHBondContact O-N 2.96Å; A720-Y723 HydrophobicContact CB-CE1 4.43Å; A720-Y723 PolarHBondContact O-N 3.24Å; A720-A724 VanDerWaalsContact O-CB 3.25Å; A720-A724 WeakPolarHBondContact O-CB 3.4Å; A720-A724 PolarHBondContact O-N 3.41Å
721	H	90.4	Very high	94.3	Very high	71 Å²	71	44.4 Å²	44.4	33%	0.329	22%	0.224	S	C	.	.	H	α-helix	trans	-61.9	-29.2	176.6	81.7	-107.4	0	0	0	112.6	F695 E719 Y723 S725	F695-H721 HydrophobicContact CD2-CB 3.63Å; F695-H721 HydrophobicContact CE2-CB 3.48Å; F695-H721 VanDerWaalsContact CE2-CB 3.48Å; F695-H721 HydrophobicContact CG-CB 4.38Å; F695-H721 HydrophobicContact CZ-CB 4.1Å; E719-H721 WeakPolarHBondContact CB-ND1 3.33Å; E719-H721 PolarHBondContact O-N 2.86Å; E719-H721 VanDerWaalsContact O-N 3.12Å; E719-H721 IonicContact OE2-CE1 3.75Å; E719-H721 PolarHBondContact OE2-CE1 3.13Å; E719-H721 IonicContact OE2-ND1 3.96Å; E719-H721 PolarHBondContact OE2-ND1 3.14Å; H721-Y723 PolarHBondContact O-N 3.42Å; H721-S725 PolarHBondContact O-OG 2.87Å
722	M	90.4	Very high	94.3	Very high	69 Å²	69	42.8 Å²	42.8	34%	0.34	21%	0.21	S	C	.	.	H	α-helix	trans	-73.5	-26.8	-173.7	-56.9	-176	-175	0	0	113.4	L718 E719 A720 F776 L780	L718-M722 HydrophobicContact CD1-CB 4.3Å; L718-M722 HydrophobicContact CD1-SD 3.99Å; E719-M722 HydrophobicContact CB-CE 4.26Å; E719-M722 HydrophobicContact CB-CG 4.49Å; E719-M722 HydrophobicContact CG-CE 4.49Å; E719-M722 WeakPolarHBondContact O-CB 3.38Å; E719-M722 PolarHBondContact O-N 2.83Å; A720-M722 PolarHBondContact O-N 2.96Å; M722-F776 HydrophobicContact CE-CE2 4.43Å; M722-F776 HydrophobicContact SD-CE2 3.7Å; M722-F776 HydrophobicContact SD-CZ 3.81Å; M722-L780 HydrophobicContact CB-CD2 4.08Å
723	Y	92.4	Very high	94.1	Very high	17 Å²	17	41 Å²	41	7%	0.067	20%	0.202	C	C	.	.	H	α-helix	trans	-122.6	-33.4	-178.1	62.4	-94.9	0	0	0	114.2	M702 F713 L718 A720 H721 W727 L764 F783	M702-Y723 PolarHBondContact SD-OH 2.98Å; M702-Y723 VanDerWaalsContact SD-OH 3.41Å; F713-Y723 AromaticContact CD2-CE1 4Å; F713-Y723 HydrophobicContact CD2-CE1 4Å; F713-Y723 AromaticContact CE2-CE1 3.71Å; F713-Y723 HydrophobicContact CE2-CE1 3.71Å; F713-Y723 AromaticContact CE2-CZ 3.84Å; L718-Y723 HydrophobicContact CD1-CD1 4.47Å; L718-Y723 HydrophobicContact CG-CD1 4.35Å; L718-Y723 HydrophobicContact CG-CE1 4.4Å; A720-Y723 HydrophobicContact CB-CE1 4.43Å; A720-Y723 PolarHBondContact O-N 3.24Å; H721-Y723 PolarHBondContact O-N 3.42Å; Y723-W727 HydrophobicContact CD2-CE3 4.49Å; Y723-W727 AromaticContact CD2-CH2 3.57Å; Y723-W727 HydrophobicContact CD2-CH2 3.57Å; Y723-W727 AromaticContact CD2-CZ2 3.94Å; Y723-W727 HydrophobicContact CD2-CZ2 3.94Å; Y723-W727 AromaticContact CD2-CZ3 3.88Å; Y723-W727 HydrophobicContact CD2-CZ3 3.88Å; Y723-W727 AromaticContact CE2-CH2 3.88Å; Y723-W727 HydrophobicContact CE2-CH2 3.88Å; Y723-W727 AromaticContact CE2-CZ3 3.87Å; Y723-W727 HydrophobicContact CE2-CZ3 3.87Å; Y723-L764 HydrophobicContact CE2-CD2 4.27Å; Y723-F783 HydrophobicContact CD1-CD2 4.23Å; Y723-F783 AromaticContact CD1-CE2 3.78Å; Y723-F783 HydrophobicContact CD1-CE2 3.78Å; Y723-F783 HydrophobicContact CD1-CZ 4.32Å; Y723-F783 HydrophobicContact CD2-CD1 4.47Å; Y723-F783 HydrophobicContact CD2-CD2 4.42Å; Y723-F783 HydrophobicContact CD2-CE1 4.14Å; Y723-F783 HydrophobicContact CD2-CE2 4.07Å; Y723-F783 AromaticContact CD2-CZ 3.91Å; Y723-F783 HydrophobicContact CD2-CZ 3.91Å; Y723-F783 HydrophobicContact CE1-CE2 4.29Å; Y723-F783 HydrophobicContact CE2-CZ 4.17Å; Y723-F783 AromaticContact CG-CD2 3.84Å; Y723-F783 HydrophobicContact CG-CD2 3.84Å; Y723-F783 HydrophobicContact CG-CE1 4.48Å; Y723-F783 AromaticContact CG-CE2 3.66Å; Y723-F783 HydrophobicContact CG-CE2 3.66Å; Y723-F783 HydrophobicContact CG-CG 4.33Å; Y723-F783 HydrophobicContact CG-CZ 4.01Å
724	A	94.7	Very high	93.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-88.9	-8.6	-173	0	0	0	0	0	114.5	F695 L698 A720 Q726 W727 F728	F695-A724 HydrophobicContact CD1-CB 4.34Å; F695-A724 HydrophobicContact CE1-CB 4.19Å; L698-A724 HydrophobicContact CD2-CB 3.91Å; A720-A724 VanDerWaalsContact O-CB 3.25Å; A720-A724 WeakPolarHBondContact O-CB 3.4Å; A720-A724 PolarHBondContact O-N 3.41Å; A724-Q726 VanDerWaalsContact C-N 3.33Å; A724-Q726 PolarHBondContact O-N 3.11Å; A724-W727 HydrophobicContact CB-CD2 4.21Å; A724-W727 HydrophobicContact CB-CE3 3.85Å; A724-W727 HydrophobicContact CB-CZ3 4.38Å; A724-W727 VanDerWaalsContact O-CB 3.31Å; A724-W727 WeakPolarHBondContact O-CB 3.5Å; A724-W727 PolarHBondContact O-N 2.86Å; A724-F728 HydrophobicContact CB-CD2 4.17Å; A724-F728 HydrophobicContact CB-CE2 4.08Å; A724-F728 WeakPolarHBondContact O-CD2 3.43Å; A724-F728 PolarHBondContact O-N 2.62Å
725	S	92.8	Very high	93.4	Very high	37 Å²	37	40.3 Å²	40.3	26%	0.259	20%	0.199	S	C	.	.	H	α-helix	trans	-51.9	-47.7	-178.2	-72.5	0	0	0	0	113.1	F695 H721 W727 L729	F695-S725 VanDerWaalsContact CZ-OG 3.25Å; F695-S725 WeakPolarHBondContact CZ-OG 3.43Å; H721-S725 PolarHBondContact O-OG 2.87Å; S725-W727 VanDerWaalsContact C-N 3.34Å; S725-W727 PolarHBondContact O-N 2.7Å; S725-L729 WeakPolarHBondContact O-CB 3.44Å; S725-L729 WeakPolarHBondContact O-CG 3.36Å; S725-L729 PolarHBondContact O-N 3.29Å
726	Q	91.8	Very high	93.2	Very high	94 Å²	94	33 Å²	33	44%	0.439	17%	0.165	S	C	.	.	H	α-helix	trans	-73.1	-25.6	178.6	-68.3	-178.1	-5	0	0	112.8	A724 T730 K735	A724-Q726 VanDerWaalsContact C-N 3.33Å; A724-Q726 PolarHBondContact O-N 3.11Å; Q726-T730 WeakPolarHBondContact O-CA 3.3Å; Q726-T730 WeakPolarHBondContact O-CB 3.35Å; Q726-T730 PolarHBondContact O-N 2.77Å; Q726-T730 PolarHBondContact O-OG1 3.35Å; Q726-K735 VanDerWaalsContact OE1-CG 3.31Å
727	W	96.3	Very high	93.2	Very high	12 Å²	12	31.2 Å²	31.2	5%	0.045	16%	0.156	C	C	.	.	H	α-helix	trans	-65.8	-43.7	178	-58	-3	0	0	0	111.2	Y723 A724 S725 L731 F732 F736 A760 L764 F783 L787	Y723-W727 HydrophobicContact CD2-CE3 4.49Å; Y723-W727 AromaticContact CD2-CH2 3.57Å; Y723-W727 HydrophobicContact CD2-CH2 3.57Å; Y723-W727 AromaticContact CD2-CZ2 3.94Å; Y723-W727 HydrophobicContact CD2-CZ2 3.94Å; Y723-W727 AromaticContact CD2-CZ3 3.88Å; Y723-W727 HydrophobicContact CD2-CZ3 3.88Å; Y723-W727 AromaticContact CE2-CH2 3.88Å; Y723-W727 HydrophobicContact CE2-CH2 3.88Å; Y723-W727 AromaticContact CE2-CZ3 3.87Å; Y723-W727 HydrophobicContact CE2-CZ3 3.87Å; A724-W727 HydrophobicContact CB-CD2 4.21Å; A724-W727 HydrophobicContact CB-CE3 3.85Å; A724-W727 HydrophobicContact CB-CZ3 4.38Å; A724-W727 VanDerWaalsContact O-CB 3.31Å; A724-W727 WeakPolarHBondContact O-CB 3.5Å; A724-W727 PolarHBondContact O-N 2.86Å; S725-W727 VanDerWaalsContact C-N 3.34Å; S725-W727 PolarHBondContact O-N 2.7Å; W727-L731 VanDerWaalsContact O-CA 3.23Å; W727-L731 WeakPolarHBondContact O-CA 3.17Å; W727-L731 PolarHBondContact O-N 3.03Å; W727-F732 HydrophobicContact CB-CD1 3.79Å; W727-F732 HydrophobicContact CB-CE1 3.44Å; W727-F732 VanDerWaalsContact CB-CE1 3.44Å; W727-F732 HydrophobicContact CB-CE2 4.45Å; W727-F732 HydrophobicContact CB-CG 4.43Å; W727-F732 HydrophobicContact CB-CZ 3.81Å; W727-F732 AromaticContact CD1-CD1 3.83Å; W727-F732 AromaticContact CD1-CE1 3.93Å; W727-F732 HydrophobicContact CD2-CD1 4.32Å; W727-F732 AromaticContact CD2-CE1 3.65Å; W727-F732 HydrophobicContact CD2-CE1 3.65Å; W727-F732 HydrophobicContact CD2-CZ 4.46Å; W727-F732 HydrophobicContact CE3-CE1 4.04Å; W727-F732 AromaticContact CG-CD1 3.71Å; W727-F732 HydrophobicContact CG-CD1 3.71Å; W727-F732 AromaticContact CG-CE1 3.38Å; W727-F732 HydrophobicContact CG-CE1 3.38Å; W727-F732 HydrophobicContact CG-CZ 4.19Å; W727-F732 PolarHBondContact O-N 2.82Å; W727-F736 AromaticContact NE1-CE2 3.83Å; W727-A760 HydrophobicContact CE3-CB 3.74Å; W727-A760 HydrophobicContact CZ3-CB 3.87Å; W727-L764 HydrophobicContact CH2-CD2 4.42Å; W727-L764 HydrophobicContact CH2-CG 4.39Å; W727-L764 HydrophobicContact CZ3-CD1 4.46Å; W727-L764 HydrophobicContact CZ3-CG 4.4Å; W727-F783 HydrophobicContact CH2-CD1 4.02Å; W727-F783 AromaticContact CH2-CE1 3.74Å; W727-F783 HydrophobicContact CH2-CE1 3.74Å; W727-F783 AromaticContact CZ2-CD1 3.75Å; W727-F783 HydrophobicContact CZ2-CD1 3.75Å; W727-F783 AromaticContact CZ2-CE1 3.98Å; W727-F783 HydrophobicContact CZ2-CE1 3.98Å; W727-L787 HydrophobicContact CH2-CD2 4.43Å; W727-L787 HydrophobicContact CZ2-CD2 3.92Å
728	F	96.1	Very high	93	Very high	6 Å²	6	25.6 Å²	25.6	3%	0.026	13%	0.126	C	C	.	.	H	α-helix	trans	-78	-50.9	177	-73.3	-76.8	0	0	0	113	L683 L691 K694 F695 L698 A724 I756 F757	L683-F728 HydrophobicContact CD1-CB 4.05Å; L691-F728 HydrophobicContact CD1-CB 3.52Å; L691-F728 HydrophobicContact CD1-CG 4.22Å; K694-F728 HydrophobicContact CB-CD1 3.99Å; K694-F728 HydrophobicContact CB-CD2 4.48Å; K694-F728 HydrophobicContact CB-CE1 3.82Å; K694-F728 HydrophobicContact CB-CE2 4.32Å; K694-F728 HydrophobicContact CB-CG 4.33Å; K694-F728 HydrophobicContact CB-CZ 3.99Å; K694-F728 HydrophobicContact CG-CD1 4.24Å; K694-F728 HydrophobicContact CG-CE1 4.35Å; F695-F728 HydrophobicContact CD1-CD2 4.3Å; F695-F728 HydrophobicContact CD1-CE2 4.36Å; F695-F728 HydrophobicContact CE1-CD2 4.07Å; L698-F728 HydrophobicContact CB-CZ 4.44Å; L698-F728 HydrophobicContact CD2-CE2 4.07Å; L698-F728 HydrophobicContact CD2-CZ 4.45Å; A724-F728 HydrophobicContact CB-CD2 4.17Å; A724-F728 HydrophobicContact CB-CE2 4.08Å; A724-F728 WeakPolarHBondContact O-CD2 3.43Å; A724-F728 PolarHBondContact O-N 2.62Å; F728-I756 HydrophobicContact CD1-CB 4.19Å; F728-I756 HydrophobicContact CD1-CG2 3.45Å; F728-I756 VanDerWaalsContact CD1-CG2 3.45Å; F728-I756 HydrophobicContact CE1-CB 4.15Å; F728-I756 HydrophobicContact CE1-CG2 3.6Å; F728-I756 HydrophobicContact CG-CG2 4.05Å; F728-I756 HydrophobicContact CZ-CG2 4.31Å; F728-F757 HydrophobicContact CE1-CD1 4.24Å; F728-F757 HydrophobicContact CE1-CD2 4.37Å; F728-F757 AromaticContact CE1-CE1 3.86Å; F728-F757 HydrophobicContact CE1-CE1 3.86Å; F728-F757 HydrophobicContact CE1-CE2 4.01Å; F728-F757 HydrophobicContact CE1-CG 4.48Å; F728-F757 AromaticContact CE1-CZ 3.73Å; F728-F757 HydrophobicContact CE1-CZ 3.73Å; F728-F757 AromaticContact CZ-CD1 3.92Å; F728-F757 HydrophobicContact CZ-CD1 3.92Å; F728-F757 AromaticContact CZ-CE1 3.58Å; F728-F757 HydrophobicContact CZ-CE1 3.58Å; F728-F757 AromaticContact CZ-CZ 3.93Å; F728-F757 HydrophobicContact CZ-CZ 3.93Å
729	L	93.5	Very high	93	Very high	26 Å²	26	26.2 Å²	26.2	14%	0.136	13%	0.13	C	C	.	.	H	α-helix	trans	-68.5	-43.1	-174.8	-66.9	-179.9	0	0	0	112.6	L683 Y684 F688 L691 S725	L683-L729 HydrophobicContact CB-CD2 3.73Å; L683-L729 HydrophobicContact CD1-CD2 4.35Å; Y684-L729 HydrophobicContact CD1-CD2 4.14Å; Y684-L729 HydrophobicContact CD2-CD2 4.3Å; Y684-L729 HydrophobicContact CE1-CB 4.39Å; Y684-L729 HydrophobicContact CE1-CD1 4.28Å; Y684-L729 HydrophobicContact CE1-CD2 3.81Å; Y684-L729 HydrophobicContact CE1-CG 4.39Å; Y684-L729 HydrophobicContact CE2-CD2 4Å; Y684-L729 HydrophobicContact CG-CD2 4.39Å; Y684-L729 PolarHBondContact OH-O 2.86Å; Y684-L729 VanDerWaalsContact OH-O 3.12Å; F688-L729 HydrophobicContact CE1-CD1 4.3Å; L691-L729 HydrophobicContact CD1-CD2 3.99Å; L691-L729 HydrophobicContact CD1-CG 4.06Å; L691-L729 HydrophobicContact CD2-CD1 3.91Å; L691-L729 HydrophobicContact CD2-CD2 3.98Å; L691-L729 HydrophobicContact CD2-CG 3.94Å; L691-L729 HydrophobicContact CG-CD2 4.47Å; S725-L729 WeakPolarHBondContact O-CB 3.44Å; S725-L729 WeakPolarHBondContact O-CG 3.36Å; S725-L729 PolarHBondContact O-N 3.29Å
730	T	94.6	Very high	93.1	Very high	9 Å²	9	21.3 Å²	21.3	6%	0.055	11%	0.108	C	C	.	.	S	Bend	trans	-98.4	4.8	-178.1	78	0	0	0	0	113.1	Q726 F732 T733 A734	Q726-T730 WeakPolarHBondContact O-CA 3.3Å; Q726-T730 WeakPolarHBondContact O-CB 3.35Å; Q726-T730 PolarHBondContact O-N 2.77Å; Q726-T730 PolarHBondContact O-OG1 3.35Å; T730-F732 PolarHBondContact O-N 3.09Å; T730-T733 VanDerWaalsContact O-CB 3.25Å; T730-T733 WeakPolarHBondContact O-CB 3.05Å; T730-T733 WeakPolarHBondContact O-CG2 3.28Å; T730-T733 PolarHBondContact O-N 2.84Å; T730-T733 PolarHBondContact O-OG1 2.87Å; T730-A734 HydrophobicContact CG2-CB 3.86Å; T730-A734 WeakPolarHBondContact OG1-CB 3.21Å; T730-A734 PolarHBondContact OG1-N 3.11Å
731	L	96.5	Very high	93.1	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.01	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	41.9	-176.2	-53.8	168.8	0	0	0	112.2	L654 I674 L680 W727 T733 L748 L753 I756	L654-L731 HydrophobicContact CD1-CD1 3.86Å; L654-L731 HydrophobicContact CD2-CD1 3.99Å; I674-L731 HydrophobicContact CG2-CD1 4.13Å; L680-L731 HydrophobicContact CD1-CD2 4.23Å; L680-L731 HydrophobicContact CD1-CG 4.46Å; L680-L731 HydrophobicContact CD2-CD1 3.79Å; L680-L731 HydrophobicContact CD2-CG 4.13Å; W727-L731 VanDerWaalsContact O-CA 3.23Å; W727-L731 WeakPolarHBondContact O-CA 3.17Å; W727-L731 PolarHBondContact O-N 3.03Å; L731-T733 PolarHBondContact O-N 3.16Å; L731-L748 HydrophobicContact CD1-CD2 3.4Å; L731-L748 HydrophobicContact CD2-CD2 4.1Å; L731-L748 HydrophobicContact CG-CD2 4.28Å; L731-L753 HydrophobicContact CD2-CD2 3.62Å; L731-I756 HydrophobicContact CB-CD1 4.4Å; L731-I756 HydrophobicContact CD2-CD1 3.68Å; L731-I756 HydrophobicContact CD2-CG1 3.9Å
732	F	95.9	Very high	93.3	Very high	1 Å²	1	18.1 Å²	18.1	0%	0.004	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.4	-10.4	-171.9	-53.6	-91.1	0	0	0	117	W727 T730 A734 K735 F736 I744 I756 V759 A760 L763	W727-F732 HydrophobicContact CB-CD1 3.79Å; W727-F732 HydrophobicContact CB-CE1 3.44Å; W727-F732 VanDerWaalsContact CB-CE1 3.44Å; W727-F732 HydrophobicContact CB-CE2 4.45Å; W727-F732 HydrophobicContact CB-CG 4.43Å; W727-F732 HydrophobicContact CB-CZ 3.81Å; W727-F732 AromaticContact CD1-CD1 3.83Å; W727-F732 AromaticContact CD1-CE1 3.93Å; W727-F732 HydrophobicContact CD2-CD1 4.32Å; W727-F732 AromaticContact CD2-CE1 3.65Å; W727-F732 HydrophobicContact CD2-CE1 3.65Å; W727-F732 HydrophobicContact CD2-CZ 4.46Å; W727-F732 HydrophobicContact CE3-CE1 4.04Å; W727-F732 AromaticContact CG-CD1 3.71Å; W727-F732 HydrophobicContact CG-CD1 3.71Å; W727-F732 AromaticContact CG-CE1 3.38Å; W727-F732 HydrophobicContact CG-CE1 3.38Å; W727-F732 HydrophobicContact CG-CZ 4.19Å; W727-F732 PolarHBondContact O-N 2.82Å; T730-F732 PolarHBondContact O-N 3.09Å; F732-A734 VanDerWaalsContact C-N 3.27Å; F732-A734 PolarHBondContact O-N 2.96Å; F732-A734 VanDerWaalsContact O-N 3.12Å; F732-K735 PolarHBondContact O-N 3.04Å; F732-F736 HydrophobicContact CB-CB 4.34Å; F732-F736 HydrophobicContact CB-CD2 3.81Å; F732-F736 HydrophobicContact CB-CG 4.29Å; F732-F736 AromaticContact CD1-CD2 3.84Å; F732-F736 HydrophobicContact CD1-CD2 3.84Å; F732-F736 AromaticContact CD1-CE2 3.72Å; F732-F736 HydrophobicContact CD1-CE2 3.72Å; F732-F736 HydrophobicContact CD1-CZ 4.36Å; F732-F736 HydrophobicContact CG-CD2 4.32Å; F732-F736 PolarHBondContact O-N 3.39Å; F732-F736 VanDerWaalsContact O-N 3.13Å; F732-I744 HydrophobicContact CB-CD1 4.02Å; F732-I744 HydrophobicContact CD2-CD1 3.78Å; F732-I744 HydrophobicContact CD2-CG2 4.18Å; F732-I744 HydrophobicContact CE2-CD1 4.46Å; F732-I744 HydrophobicContact CG-CD1 4.01Å; F732-I756 HydrophobicContact CD2-CD1 4.12Å; F732-I756 HydrophobicContact CE2-CB 4.45Å; F732-I756 HydrophobicContact CE2-CD1 3.84Å; F732-I756 HydrophobicContact CE2-CG2 3.82Å; F732-I756 HydrophobicContact CZ-CG2 4.2Å; F732-V759 HydrophobicContact CD2-CG1 4.27Å; F732-V759 HydrophobicContact CE1-CG1 4Å; F732-V759 HydrophobicContact CE2-CB 3.82Å; F732-V759 HydrophobicContact CE2-CG1 3.65Å; F732-V759 HydrophobicContact CZ-CB 3.82Å; F732-V759 HydrophobicContact CZ-CG1 3.5Å; F732-A760 HydrophobicContact CZ-CB 4.47Å; F732-L763 HydrophobicContact CD1-CD1 4.08Å; F732-L763 HydrophobicContact CE1-CD1 3.47Å; F732-L763 VanDerWaalsContact CE1-CD1 3.47Å; F732-L763 HydrophobicContact CZ-CD1 4.23Å
733	T	94.8	Very high	93.5	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-34	-172.8	63.5	0	0	0	0	114.1	F614 F653 V657 T730 L731 K735 V741	F614-T733 WeakPolarHBondContact CE1-O 3.35Å; F653-T733 WeakPolarHBondContact CB-OG1 3.21Å; V657-T733 HydrophobicContact CG2-CG2 4.02Å; T730-T733 VanDerWaalsContact O-CB 3.25Å; T730-T733 WeakPolarHBondContact O-CB 3.05Å; T730-T733 WeakPolarHBondContact O-CG2 3.28Å; T730-T733 PolarHBondContact O-N 2.84Å; T730-T733 PolarHBondContact O-OG1 2.87Å; L731-T733 PolarHBondContact O-N 3.16Å; T733-K735 VanDerWaalsContact C-N 3.32Å; T733-K735 PolarHBondContact O-N 2.79Å; T733-V741 HydrophobicContact CG2-CG1 3.58Å
734	A	90.2	Very high	93.7	Very high	12 Å²	12	14.6 Å²	14.6	10%	0.099	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-11.9	-174	0	0	0	0	0	115.5	F653 T730 F732	F653-A734 HydrophobicContact CD1-CB 4.14Å; F653-A734 HydrophobicContact CD2-CB 3.9Å; F653-A734 HydrophobicContact CE1-CB 4.24Å; F653-A734 HydrophobicContact CE2-CB 4.04Å; F653-A734 HydrophobicContact CG-CB 3.95Å; F653-A734 HydrophobicContact CZ-CB 4.2Å; T730-A734 HydrophobicContact CG2-CB 3.86Å; T730-A734 WeakPolarHBondContact OG1-CB 3.21Å; T730-A734 PolarHBondContact OG1-N 3.11Å; F732-A734 VanDerWaalsContact C-N 3.27Å; F732-A734 PolarHBondContact O-N 2.96Å; F732-A734 VanDerWaalsContact O-N 3.12Å
735	K	88.3	Confident	93.8	Very high	65 Å²	65	14.7 Å²	14.7	28%	0.283	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.6	-25.5	-173.9	-71.2	-65.7	179.5	-175.9	0	115.7	E521 Q726 F732 T733 P788	E521-K735 IonicContact OE2-NZ 2.69Å; E521-K735 PolarHBondContact OE2-NZ 2.98Å; Q726-K735 VanDerWaalsContact OE1-CG 3.31Å; F732-K735 PolarHBondContact O-N 3.04Å; T733-K735 VanDerWaalsContact C-N 3.32Å; T733-K735 PolarHBondContact O-N 2.79Å; K735-P788 WeakPolarHBondContact O-CB 3.31Å
736	F	93.1	Very high	94	Very high	4 Å²	4	13 Å²	13	2%	0.018	6%	0.064	C	C	.	.	S	Bend	trans	-94.9	154.4	-174.9	-74.1	-95.4	0	0	0	112.6	W727 F732 M740 V741 L763 L787 P788 Y791	W727-F736 AromaticContact NE1-CE2 3.83Å; F732-F736 HydrophobicContact CB-CB 4.34Å; F732-F736 HydrophobicContact CB-CD2 3.81Å; F732-F736 HydrophobicContact CB-CG 4.29Å; F732-F736 AromaticContact CD1-CD2 3.84Å; F732-F736 HydrophobicContact CD1-CD2 3.84Å; F732-F736 AromaticContact CD1-CE2 3.72Å; F732-F736 HydrophobicContact CD1-CE2 3.72Å; F732-F736 HydrophobicContact CD1-CZ 4.36Å; F732-F736 HydrophobicContact CG-CD2 4.32Å; F732-F736 PolarHBondContact O-N 3.39Å; F732-F736 VanDerWaalsContact O-N 3.13Å; F736-M740 HydrophobicContact CB-CE 4.29Å; F736-M740 HydrophobicContact CB-SD 4.23Å; F736-M740 HydrophobicContact CD1-CE 3.43Å; F736-M740 VanDerWaalsContact CD1-CE 3.43Å; F736-M740 HydrophobicContact CD1-SD 3.53Å; F736-M740 VanDerWaalsContact CD1-SD 3.53Å; F736-M740 HydrophobicContact CE1-CE 3.86Å; F736-M740 HydrophobicContact CE1-SD 4.28Å; F736-M740 HydrophobicContact CG-CE 3.88Å; F736-M740 HydrophobicContact CG-SD 4.19Å; F736-V741 HydrophobicContact CB-CG2 3.94Å; F736-V741 WeakPolarHBondContact O-CG2 3.41Å; F736-L763 HydrophobicContact CE1-CD1 4.16Å; F736-L763 HydrophobicContact CE1-CD2 3.82Å; F736-L763 HydrophobicContact CZ-CD1 3.89Å; F736-L763 HydrophobicContact CZ-CD2 4.26Å; F736-L787 HydrophobicContact CE1-CD2 4.48Å; F736-L787 HydrophobicContact CE1-CG 4.19Å; F736-L787 HydrophobicContact CZ-CD2 3.98Å; F736-L787 HydrophobicContact CZ-CG 4.14Å; F736-P788 HydrophobicContact CD1-CB 4.27Å; F736-P788 HydrophobicContact CE1-CB 4.36Å; F736-P788 HydrophobicContact CE1-CG 4.35Å; F736-P788 HydrophobicContact CZ-CG 4.32Å; F736-Y791 HydrophobicContact CD1-CD2 4.31Å; F736-Y791 HydrophobicContact CE1-CD2 4.1Å
737	P	92.4	Very high	94.2	Very high	1 Å²	1	8.5 Å²	8.5	1%	0.006	4%	0.043	C	C	.	.			trans	-62.3	148.3	179.9	-27.9	39.9	0	0	0	113.7	T526 C739 M740 V741 R792	T526-P737 CarbonylContact O-C 3.26Å; T526-P737 WeakPolarHBondContact O-CA 3.33Å; T526-P737 VanDerWaalsContact O-CB 3.29Å; T526-P737 WeakPolarHBondContact O-CB 3.39Å; P737-C739 VanDerWaalsContact C-N 3.35Å; P737-C739 PolarHBondContact O-N 2.72Å; P737-M740 WeakPolarHBondContact O-CB 3.49Å; P737-M740 PolarHBondContact O-N 3.08Å; P737-V741 WeakPolarHBondContact O-CG2 3.49Å; P737-V741 PolarHBondContact O-N 3.38Å; P737-R792 HydrophobicContact CB-CG 4.32Å; P737-R792 HydrophobicContact CG-CB 4.33Å; P737-R792 HydrophobicContact CG-CG 3.73Å
738	L	92.1	Very high	94.2	Very high	5 Å²	5	7.9 Å²	7.9	3%	0.026	4%	0.041	C	C	.	.	H	α-helix	trans	-57.5	-43.8	-172.4	-68.6	-179.2	0	0	0	112.8	G525 T526 V529 F614 L660 M740 V741 F742	G525-L738 WeakPolarHBondContact O-CD1 3.14Å; T526-L738 PolarHBondContact O-N 3.5Å; V529-L738 HydrophobicContact CG2-CB 4.4Å; F614-L738 HydrophobicContact CD1-CD2 4.43Å; F614-L738 HydrophobicContact CD2-CD2 4.33Å; F614-L738 HydrophobicContact CE1-CD2 3.98Å; F614-L738 HydrophobicContact CE2-CD2 3.88Å; F614-L738 HydrophobicContact CZ-CD2 3.69Å; L660-L738 HydrophobicContact CD1-CD1 4.21Å; L738-M740 PolarHBondContact O-N 2.97Å; L738-V741 PolarHBondContact O-N 2.86Å; L738-F742 HydrophobicContact CB-CE1 3.92Å; L738-F742 HydrophobicContact CB-CE2 4.24Å; L738-F742 HydrophobicContact CB-CZ 3.77Å; L738-F742 HydrophobicContact CD1-CZ 4.19Å; L738-F742 HydrophobicContact CD2-CE1 3.85Å; L738-F742 HydrophobicContact CD2-CZ 4.19Å; L738-F742 HydrophobicContact CG-CE1 4.34Å; L738-F742 HydrophobicContact CG-CZ 4.26Å; L738-F742 VanDerWaalsContact O-CD1 3.27Å; L738-F742 WeakPolarHBondContact O-CD1 3.33Å; L738-F742 WeakPolarHBondContact O-CG 3.44Å; L738-F742 PolarHBondContact O-N 3.42Å
739	C	90.4	Very high	94.2	Very high	17 Å²	17	7.6 Å²	7.6	12%	0.115	4%	0.04	C	C	.	.	H	α-helix	trans	-55	-34.2	176.7	59.9	0	0	0	0	114	D528 V529 P737 A794	D528-C739 WeakPolarHBondContact O-CB 3.4Å; V529-C739 HydrophobicContact CG2-CB 4.02Å; P737-C739 VanDerWaalsContact C-N 3.35Å; P737-C739 PolarHBondContact O-N 2.72Å; C739-A794 HydrophobicContact CB-CB 4.3Å
740	M	93.6	Very high	94.3	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-78.9	-44.3	174.1	178.1	176.6	152.3	0	0	111.3	F736 P737 L738 F742 H743 I744 V759 L763 Y791 A797 L800 M801	F736-M740 HydrophobicContact CB-CE 4.29Å; F736-M740 HydrophobicContact CB-SD 4.23Å; F736-M740 HydrophobicContact CD1-CE 3.43Å; F736-M740 VanDerWaalsContact CD1-CE 3.43Å; F736-M740 HydrophobicContact CD1-SD 3.53Å; F736-M740 VanDerWaalsContact CD1-SD 3.53Å; F736-M740 HydrophobicContact CE1-CE 3.86Å; F736-M740 HydrophobicContact CE1-SD 4.28Å; F736-M740 HydrophobicContact CG-CE 3.88Å; F736-M740 HydrophobicContact CG-SD 4.19Å; P737-M740 WeakPolarHBondContact O-CB 3.49Å; P737-M740 PolarHBondContact O-N 3.08Å; L738-M740 PolarHBondContact O-N 2.97Å; M740-F742 VanDerWaalsContact C-N 3.33Å; M740-F742 PolarHBondContact O-N 2.97Å; M740-H743 PolarHBondContact O-N 3.2Å; M740-I744 HydrophobicContact CE-CD1 3.69Å; M740-I744 HydrophobicContact CG-CD1 3.93Å; M740-I744 WeakPolarHBondContact O-CG1 3.42Å; M740-I744 PolarHBondContact O-N 2.96Å; M740-V759 HydrophobicContact CE-CG1 4.1Å; M740-L763 HydrophobicContact CE-CD1 4.28Å; M740-L763 HydrophobicContact CE-CD2 4.15Å; M740-Y791 HydrophobicContact SD-CD1 4.47Å; M740-Y791 HydrophobicContact SD-CD2 4.09Å; M740-Y791 HydrophobicContact SD-CG 3.79Å; M740-A797 HydrophobicContact CB-CB 3.78Å; M740-A797 HydrophobicContact CG-CB 4.37Å; M740-L800 HydrophobicContact CE-CD2 3.54Å; M740-L800 HydrophobicContact SD-CD2 3.73Å; M740-M801 HydrophobicContact CE-CE 4.25Å; M740-M801 HydrophobicContact CG-CE 4.1Å
741	V	95.1	Very high	94.2	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-62.6	-38.3	-178.1	170.9	0	0	0	0	111.8	V657 T733 F736 P737 L738 I744 T745	V657-V741 HydrophobicContact CG1-CG1 4.4Å; V657-V741 HydrophobicContact CG2-CG1 3.73Å; T733-V741 HydrophobicContact CG2-CG1 3.58Å; F736-V741 HydrophobicContact CB-CG2 3.94Å; F736-V741 WeakPolarHBondContact O-CG2 3.41Å; P737-V741 WeakPolarHBondContact O-CG2 3.49Å; P737-V741 PolarHBondContact O-N 3.38Å; L738-V741 PolarHBondContact O-N 2.86Å; V741-I744 WeakPolarHBondContact O-CB 3.03Å; V741-I744 PolarHBondContact O-N 3.11Å; V741-T745 PolarHBondContact O-N 3.26Å; V741-T745 PolarHBondContact O-OG1 3.14Å
742	F	95	Very high	94	Very high	4 Å²	4	11.3 Å²	11.3	2%	0.018	6%	0.062	C	C	.	.	H	α-helix	trans	-66.1	-41.5	178.5	-60	-8.4	0	0	0	111.6	V529 E569 W576 V657 L660 H661 L738 M740 I744 T745 D746	V529-F742 HydrophobicContact CG1-CD2 4.31Å; V529-F742 HydrophobicContact CG1-CE2 4.32Å; V529-F742 HydrophobicContact CG2-CD2 4.38Å; V529-F742 HydrophobicContact CG2-CE2 4.06Å; E569-F742 WeakPolarHBondContact OE1-CE2 3.31Å; W576-F742 HydrophobicContact CZ2-CB 4.43Å; V657-F742 HydrophobicContact CG1-CD1 3.89Å; V657-F742 HydrophobicContact CG1-CE1 4.03Å; V657-F742 HydrophobicContact CG2-CE1 4.26Å; L660-F742 HydrophobicContact CD1-CE1 4.45Å; L660-F742 HydrophobicContact CD1-CZ 4.05Å; H661-F742 AromaticContact CE1-CD1 3.71Å; H661-F742 AromaticContact CE1-CD2 3.58Å; H661-F742 AromaticContact CE1-CE1 3.62Å; H661-F742 AromaticContact CE1-CE2 3.48Å; H661-F742 VanDerWaalsContact CE1-CE2 3.48Å; H661-F742 WeakPolarHBondContact CE1-CE2 3.48Å; H661-F742 AromaticContact CE1-CG 3.7Å; H661-F742 AromaticContact CE1-CZ 3.51Å; H661-F742 AromaticContact NE2-CD2 3.61Å; H661-F742 AromaticContact NE2-CE2 3.68Å; L738-F742 HydrophobicContact CB-CE1 3.92Å; L738-F742 HydrophobicContact CB-CE2 4.24Å; L738-F742 HydrophobicContact CB-CZ 3.77Å; L738-F742 HydrophobicContact CD1-CZ 4.19Å; L738-F742 HydrophobicContact CD2-CE1 3.85Å; L738-F742 HydrophobicContact CD2-CZ 4.19Å; L738-F742 HydrophobicContact CG-CE1 4.34Å; L738-F742 HydrophobicContact CG-CZ 4.26Å; L738-F742 VanDerWaalsContact O-CD1 3.27Å; L738-F742 WeakPolarHBondContact O-CD1 3.33Å; L738-F742 WeakPolarHBondContact O-CG 3.44Å; L738-F742 PolarHBondContact O-N 3.42Å; M740-F742 VanDerWaalsContact C-N 3.33Å; M740-F742 PolarHBondContact O-N 2.97Å; F742-I744 VanDerWaalsContact C-N 3.31Å; F742-I744 PolarHBondContact O-N 2.89Å; F742-T745 WeakPolarHBondContact O-CB 3.31Å; F742-T745 PolarHBondContact O-N 2.94Å; F742-T745 VanDerWaalsContact O-N 3.16Å; F742-D746 PolarHBondContact O-N 2.77Å; F742-D746 VanDerWaalsContact O-OD1 3.14Å
743	H	94.8	Very high	93.8	Very high	12 Å²	12	13.1 Å²	13.1	6%	0.056	7%	0.071	C	C	.	.	H	α-helix	trans	-67.7	-30.4	174.8	-157.5	167	0	0	0	112	V563 H564 G566 M740 D746 L747 M801	V563-H743 PolarHBondContact O-NE2 2.78Å; H564-H743 PolarHBondContact O-CE1 2.98Å; H564-H743 PolarHBondContact O-NE2 2.9Å; H564-H743 VanDerWaalsContact O-NE2 3.08Å; G566-H743 WeakPolarHBondContact CA-NE2 3.2Å; G566-H743 PolarHBondContact N-NE2 3.35Å; M740-H743 PolarHBondContact O-N 3.2Å; H743-D746 WeakPolarHBondContact O-CB 3.43Å; H743-L747 WeakPolarHBondContact O-CG 3.47Å; H743-L747 PolarHBondContact O-N 3.35Å; H743-L747 VanDerWaalsContact O-N 3.13Å; H743-M801 HydrophobicContact CB-CG 3.96Å
744	I	96.5	Very high	93.7	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-65.6	-42.5	169.8	-67.2	167.5	0	0	0	110.9	F732 M740 V741 F742 L747 L748 I756 V759 M801	F732-I744 HydrophobicContact CB-CD1 4.02Å; F732-I744 HydrophobicContact CD2-CD1 3.78Å; F732-I744 HydrophobicContact CD2-CG2 4.18Å; F732-I744 HydrophobicContact CE2-CD1 4.46Å; F732-I744 HydrophobicContact CG-CD1 4.01Å; M740-I744 HydrophobicContact CE-CD1 3.69Å; M740-I744 HydrophobicContact CG-CD1 3.93Å; M740-I744 WeakPolarHBondContact O-CG1 3.42Å; M740-I744 PolarHBondContact O-N 2.96Å; V741-I744 WeakPolarHBondContact O-CB 3.03Å; V741-I744 PolarHBondContact O-N 3.11Å; F742-I744 VanDerWaalsContact C-N 3.31Å; F742-I744 PolarHBondContact O-N 2.89Å; I744-L747 PolarHBondContact O-N 2.95Å; I744-L748 WeakPolarHBondContact O-CB 3.38Å; I744-L748 PolarHBondContact O-N 2.77Å; I744-I756 HydrophobicContact CG2-CD1 4.17Å; I744-V759 HydrophobicContact CD1-CG1 4Å; I744-V759 HydrophobicContact CG1-CG1 4.48Å; I744-V759 HydrophobicContact CG1-CG2 4.22Å; I744-M801 HydrophobicContact CD1-CE 4.18Å; I744-M801 HydrophobicContact CG1-CE 3.89Å; I744-M801 HydrophobicContact CG1-SD 3.71Å
745	T	97.1	Very high	94	Very high	2 Å²	2	14 Å²	14	1%	0.012	8%	0.077	C	C	.	.	H	α-helix	trans	-64.4	-42.8	175	-58.8	0	0	0	0	112.2	W576 V741 F742 L747 L748 L749	W576-T745 HydrophobicContact CD2-CG2 3.86Å; W576-T745 HydrophobicContact CE3-CG2 3.98Å; W576-T745 HydrophobicContact CH2-CG2 3.72Å; W576-T745 HydrophobicContact CZ2-CG2 3.57Å; W576-T745 HydrophobicContact CZ3-CG2 3.93Å; V741-T745 PolarHBondContact O-N 3.26Å; V741-T745 PolarHBondContact O-OG1 3.14Å; F742-T745 WeakPolarHBondContact O-CB 3.31Å; F742-T745 PolarHBondContact O-N 2.94Å; F742-T745 VanDerWaalsContact O-N 3.16Å; T745-L747 VanDerWaalsContact C-N 3.31Å; T745-L747 PolarHBondContact O-N 3.04Å; T745-L748 PolarHBondContact O-N 2.87Å; T745-L749 HydrophobicContact CG2-CD1 3.92Å; T745-L749 HydrophobicContact CG2-CG 4.34Å; T745-L749 WeakPolarHBondContact O-CG 3.39Å; T745-L749 PolarHBondContact O-N 2.91Å
746	D	96.3	Very high	94.4	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-51.1	-51.6	173.5	-64	-15.5	0	0	0	110.7	V563 I567 R572 W576 F742 H743 C750	V563-D746 HydrophobicContact CG1-CB 3.99Å; V563-D746 VanDerWaalsContact CG1-O 3.25Å; V563-D746 WeakPolarHBondContact CG1-O 3.31Å; I567-D746 HydrophobicContact CD1-CB 3.69Å; I567-D746 WeakPolarHBondContact CD1-OD1 3.48Å; I567-D746 HydrophobicContact CG1-CB 3.85Å; I567-D746 PolarHBondContact N-OD2 3.18Å; R572-D746 IonicContact CZ-OD1 3.67Å; R572-D746 IonicContact CZ-OD2 3.63Å; R572-D746 IonicContact NE-OD1 2.72Å; R572-D746 PolarHBondContact NE-OD1 3.23Å; R572-D746 IonicContact NE-OD2 2.7Å; R572-D746 PolarHBondContact NE-OD2 3.19Å; R572-D746 IonicContact NH2-OD1 3.38Å; R572-D746 IonicContact NH2-OD2 3.3Å; R572-D746 PolarHBondContact NH2-OD2 2.8Å; W576-D746 PolarHBondContact NE1-OD1 3.16Å; F742-D746 PolarHBondContact O-N 2.77Å; F742-D746 VanDerWaalsContact O-OD1 3.14Å; H743-D746 WeakPolarHBondContact O-CB 3.43Å; D746-C750 WeakPolarHBondContact O-CB 3.11Å; D746-C750 PolarHBondContact O-N 2.91Å
747	L	96	Very high	94.6	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-72	-37.4	-179	-68.2	166.3	0	0	0	112.8	V563 H743 I744 T745 C750 E751 I755 M801	V563-L747 HydrophobicContact CG1-CD2 4.17Å; H743-L747 WeakPolarHBondContact O-CG 3.47Å; H743-L747 PolarHBondContact O-N 3.35Å; H743-L747 VanDerWaalsContact O-N 3.13Å; I744-L747 PolarHBondContact O-N 2.95Å; T745-L747 VanDerWaalsContact C-N 3.31Å; T745-L747 PolarHBondContact O-N 3.04Å; L747-C750 PolarHBondContact O-N 3.03Å; L747-E751 PolarHBondContact O-N 2.74Å; L747-I755 HydrophobicContact CB-CD1 4.06Å; L747-I755 HydrophobicContact CB-CG1 3.78Å; L747-I755 HydrophobicContact CD1-CD1 4.24Å; L747-I755 HydrophobicContact CD1-CG1 4.28Å; L747-M801 HydrophobicContact CD1-CB 4.38Å; L747-M801 HydrophobicContact CD1-CG 4.5Å; L747-M801 HydrophobicContact CD1-SD 3.91Å
748	L	96.8	Very high	94.8	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-60.7	-47.2	177.7	172.5	66.1	0	0	0	111.5	I674 Y678 L731 I744 T745 C750 G752 L753 I755	I674-L748 HydrophobicContact CG2-CD2 4.48Å; Y678-L748 WeakPolarHBondContact CE1-O 3.47Å; L731-L748 HydrophobicContact CD1-CD2 3.4Å; L731-L748 HydrophobicContact CD2-CD2 4.1Å; L731-L748 HydrophobicContact CG-CD2 4.28Å; I744-L748 WeakPolarHBondContact O-CB 3.38Å; I744-L748 PolarHBondContact O-N 2.77Å; T745-L748 PolarHBondContact O-N 2.87Å; L748-C750 PolarHBondContact O-N 2.8Å; L748-G752 VanDerWaalsContact O-CA 3.24Å; L748-G752 WeakPolarHBondContact O-CA 3.06Å; L748-G752 PolarHBondContact O-N 2.75Å; L748-L753 HydrophobicContact CD1-CD2 3.88Å; L748-L753 HydrophobicContact CD1-CG 4.3Å; L748-I755 HydrophobicContact CB-CG2 4.13Å; L748-I755 HydrophobicContact CD1-CG2 4.36Å
749	L	96.3	Very high	95.1	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-70.5	-23.8	178.8	-66.1	176.4	0	0	0	111.6	R555 W576 L579 A580 I674 Y678 T745	R555-L749 PolarHBondContact NH1-O 2.85Å; R555-L749 PolarHBondContact NH2-O 2.88Å; W576-L749 HydrophobicContact CB-CD1 3.55Å; W576-L749 HydrophobicContact CD2-CD1 4.16Å; W576-L749 HydrophobicContact CG-CD1 3.57Å; L579-L749 HydrophobicContact CB-CB 3.74Å; L579-L749 HydrophobicContact CD1-CB 3.73Å; L579-L749 HydrophobicContact CG-CB 4.34Å; A580-L749 HydrophobicContact CB-CD2 4.35Å; I674-L749 HydrophobicContact CD1-CD2 4.09Å; I674-L749 HydrophobicContact CG1-CD2 3.82Å; Y678-L749 HydrophobicContact CD2-CD2 4.48Å; Y678-L749 HydrophobicContact CE1-CD2 4.15Å; Y678-L749 HydrophobicContact CE2-CD2 3.99Å; Y678-L749 PolarHBondContact OH-O 2.7Å; T745-L749 HydrophobicContact CG2-CD1 3.92Å; T745-L749 HydrophobicContact CG2-CG 4.34Å; T745-L749 WeakPolarHBondContact O-CG 3.39Å; T745-L749 PolarHBondContact O-N 2.91Å
750	C	94.9	Very high	95.4	Very high	15 Å²	15	10.7 Å²	10.7	10%	0.101	6%	0.06	C	C	.	.	H	α-helix	trans	-80.8	-45.6	173.6	-171.9	0	0	0	0	114.1	R555 V563 L579 D746 L747 L748	R555-C750 PolarHBondContact NH1-O 2.91Å; V563-C750 HydrophobicContact CB-CB 4.31Å; V563-C750 HydrophobicContact CG1-CB 3.75Å; V563-C750 HydrophobicContact CG2-CB 4.29Å; L579-C750 HydrophobicContact CD1-CB 4.47Å; L579-C750 HydrophobicContact CD2-CB 4.28Å; D746-C750 WeakPolarHBondContact O-CB 3.11Å; D746-C750 PolarHBondContact O-N 2.91Å; L747-C750 PolarHBondContact O-N 3.03Å; L748-C750 PolarHBondContact O-N 2.8Å
751	E	91.8	Very high	95.6	Very high	84 Å²	84	10.8 Å²	10.8	39%	0.393	6%	0.061	S	C	.	.	H	α-helix	trans	-117.4	-10.8	-168.2	-57.3	-160.7	170.6	0	0	115.3	H564 L747 S754	H564-E751 IonicContact CD2-OE1 2.75Å; H564-E751 IonicContact CE1-OE1 2.72Å; H564-E751 IonicContact NE2-OE1 3.13Å; H564-E751 PolarHBondContact NE2-OE1 2.94Å; L747-E751 PolarHBondContact O-N 2.74Å; E751-S754 PolarHBondContact O-OG 3.07Å
752	G	93.3	Very high	95.7	Very high	16 Å²	16	10.8 Å²	10.8	17%	0.165	6%	0.061	C	C	.	.			trans	86.1	177.5	-178.8	0	0	0	0	0	114.6	L748 S754 I755	L748-G752 VanDerWaalsContact O-CA 3.24Å; L748-G752 WeakPolarHBondContact O-CA 3.06Å; L748-G752 PolarHBondContact O-N 2.75Å; G752-S754 PolarHBondContact O-N 3.33Å; G752-I755 PolarHBondContact O-N 3.2Å; G752-I755 VanDerWaalsContact O-N 3.08Å
753	L	92	Very high	95.8	Very high	39 Å²	39	10.6 Å²	10.6	20%	0.204	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-16.5	-174.4	-79.1	177.9	0	0	0	115.3	Y678 L680 L731 L748 I755 I756	Y678-L753 WeakPolarHBondContact O-CD1 3.42Å; Y678-L753 WeakPolarHBondContact O-CG 3.37Å; L680-L753 HydrophobicContact CD1-CD2 4.47Å; L731-L753 HydrophobicContact CD2-CD2 3.62Å; L748-L753 HydrophobicContact CD1-CD2 3.88Å; L748-L753 HydrophobicContact CD1-CG 4.3Å; L753-I755 PolarHBondContact O-N 3.11Å; L753-I756 HydrophobicContact CD2-CG1 4.34Å; L753-I756 WeakPolarHBondContact O-CB 3.35Å; L753-I756 WeakPolarHBondContact O-CG1 3.37Å; L753-I756 PolarHBondContact O-N 2.96Å; L753-I756 VanDerWaalsContact O-N 3.17Å
754	S	92.4	Very high	96	Very high	30 Å²	30	10 Å²	10	21%	0.21	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.8	172.4	26.5	0	0	0	0	113.6	E751 G752 I756 F757 N758	E751-S754 PolarHBondContact O-OG 3.07Å; G752-S754 PolarHBondContact O-N 3.33Å; S754-I756 PolarHBondContact O-N 3.19Å; S754-I756 VanDerWaalsContact O-N 3.17Å; S754-F757 WeakPolarHBondContact O-CB 3.09Å; S754-F757 PolarHBondContact O-N 3.3Å; S754-F757 VanDerWaalsContact O-N 3.1Å; S754-N758 PolarHBondContact O-OD1 3.09Å
755	I	95.5	Very high	96	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-61.4	-25.6	179.5	-160.5	75.8	0	0	0	112.9	L747 L748 G752 L753 F757 N758 V759	L747-I755 HydrophobicContact CB-CD1 4.06Å; L747-I755 HydrophobicContact CB-CG1 3.78Å; L747-I755 HydrophobicContact CD1-CD1 4.24Å; L747-I755 HydrophobicContact CD1-CG1 4.28Å; L748-I755 HydrophobicContact CB-CG2 4.13Å; L748-I755 HydrophobicContact CD1-CG2 4.36Å; G752-I755 PolarHBondContact O-N 3.2Å; G752-I755 VanDerWaalsContact O-N 3.08Å; L753-I755 PolarHBondContact O-N 3.11Å; I755-F757 PolarHBondContact O-N 2.86Å; I755-N758 HydrophobicContact CD1-CB 4.06Å; I755-N758 HydrophobicContact CG1-CB 4.49Å; I755-N758 WeakPolarHBondContact O-CA 3.38Å; I755-N758 WeakPolarHBondContact O-CB 3.33Å; I755-N758 PolarHBondContact O-N 3.21Å; I755-V759 HydrophobicContact CG1-CG2 4.33Å; I755-V759 WeakPolarHBondContact O-CG2 3.48Å; I755-V759 PolarHBondContact O-N 3.01Å
756	I	96.9	Very high	95.9	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-63.3	-32.9	178.5	-54.5	-57.4	0	0	0	111	F728 L731 F732 I744 L753 S754 A760	F728-I756 HydrophobicContact CD1-CB 4.19Å; F728-I756 HydrophobicContact CD1-CG2 3.45Å; F728-I756 VanDerWaalsContact CD1-CG2 3.45Å; F728-I756 HydrophobicContact CE1-CB 4.15Å; F728-I756 HydrophobicContact CE1-CG2 3.6Å; F728-I756 HydrophobicContact CG-CG2 4.05Å; F728-I756 HydrophobicContact CZ-CG2 4.31Å; L731-I756 HydrophobicContact CB-CD1 4.4Å; L731-I756 HydrophobicContact CD2-CD1 3.68Å; L731-I756 HydrophobicContact CD2-CG1 3.9Å; F732-I756 HydrophobicContact CD2-CD1 4.12Å; F732-I756 HydrophobicContact CE2-CB 4.45Å; F732-I756 HydrophobicContact CE2-CD1 3.84Å; F732-I756 HydrophobicContact CE2-CG2 3.82Å; F732-I756 HydrophobicContact CZ-CG2 4.2Å; I744-I756 HydrophobicContact CG2-CD1 4.17Å; L753-I756 HydrophobicContact CD2-CG1 4.34Å; L753-I756 WeakPolarHBondContact O-CB 3.35Å; L753-I756 WeakPolarHBondContact O-CG1 3.37Å; L753-I756 PolarHBondContact O-N 2.96Å; L753-I756 VanDerWaalsContact O-N 3.17Å; S754-I756 PolarHBondContact O-N 3.19Å; S754-I756 VanDerWaalsContact O-N 3.17Å; I756-A760 WeakPolarHBondContact O-CB 3.5Å; I756-A760 PolarHBondContact O-N 3.27Å
757	F	97.6	Very high	95.9	Very high	7 Å²	7	18.2 Å²	18.2	3%	0.031	10%	0.098	C	C	.	.	H	α-helix	trans	-68.8	-41.8	170.6	-67.3	-78.8	0	0	0	112.4	K694 Q697 L698 L701 F728 S754 I755 V759 A760 L761 V809 L814	K694-F757 HydrophobicContact CB-CE1 4.46Å; K694-F757 HydrophobicContact CB-CZ 3.9Å; K694-F757 HydrophobicContact CD-CZ 4.2Å; K694-F757 HydrophobicContact CG-CZ 4.38Å; K694-F757 WeakPolarHBondContact O-CE1 3.49Å; Q697-F757 HydrophobicContact CB-CE1 3.55Å; Q697-F757 HydrophobicContact CB-CZ 3.67Å; Q697-F757 HydrophobicContact CG-CZ 4.49Å; Q697-F757 VanDerWaalsContact OE1-CZ 3.23Å; L698-F757 HydrophobicContact CB-CD1 4.23Å; L698-F757 HydrophobicContact CB-CE1 4.09Å; L698-F757 HydrophobicContact CD1-CD1 4.43Å; L701-F757 HydrophobicContact CD1-CB 4.15Å; L701-F757 HydrophobicContact CD1-CD1 3.77Å; L701-F757 HydrophobicContact CD1-CG 4.13Å; F728-F757 HydrophobicContact CE1-CD1 4.24Å; F728-F757 HydrophobicContact CE1-CD2 4.37Å; F728-F757 AromaticContact CE1-CE1 3.86Å; F728-F757 HydrophobicContact CE1-CE1 3.86Å; F728-F757 HydrophobicContact CE1-CE2 4.01Å; F728-F757 HydrophobicContact CE1-CG 4.48Å; F728-F757 AromaticContact CE1-CZ 3.73Å; F728-F757 HydrophobicContact CE1-CZ 3.73Å; F728-F757 AromaticContact CZ-CD1 3.92Å; F728-F757 HydrophobicContact CZ-CD1 3.92Å; F728-F757 AromaticContact CZ-CE1 3.58Å; F728-F757 HydrophobicContact CZ-CE1 3.58Å; F728-F757 AromaticContact CZ-CZ 3.93Å; F728-F757 HydrophobicContact CZ-CZ 3.93Å; S754-F757 WeakPolarHBondContact O-CB 3.09Å; S754-F757 PolarHBondContact O-N 3.3Å; S754-F757 VanDerWaalsContact O-N 3.1Å; I755-F757 PolarHBondContact O-N 2.86Å; F757-V759 PolarHBondContact O-N 3.01Å; F757-A760 PolarHBondContact O-N 3.13Å; F757-L761 WeakPolarHBondContact O-CB 3.4Å; F757-L761 VanDerWaalsContact O-CG 3.22Å; F757-L761 WeakPolarHBondContact O-CG 3.43Å; F757-L761 PolarHBondContact O-N 2.64Å; F757-V809 HydrophobicContact CB-CG1 4.09Å; F757-V809 HydrophobicContact CB-CG2 4.24Å; F757-L814 HydrophobicContact CD1-CD2 4.29Å; F757-L814 HydrophobicContact CD2-CD1 4.02Å; F757-L814 HydrophobicContact CD2-CD2 3.88Å; F757-L814 HydrophobicContact CE1-CD2 4.22Å; F757-L814 HydrophobicContact CE2-CD1 4.2Å; F757-L814 HydrophobicContact CE2-CD2 3.81Å; F757-L814 HydrophobicContact CG-CD2 4.12Å; F757-L814 HydrophobicContact CZ-CD2 3.99Å
758	N	96.8	Very high	95.9	Very high	13 Å²	13	20.1 Å²	20.1	7%	0.07	11%	0.106	C	C	.	.	H	α-helix	trans	-59.1	-46.6	177.1	-71.8	54.6	0	0	0	111.4	S754 I755 A762 A804 I807 V809	S754-N758 PolarHBondContact O-OD1 3.09Å; I755-N758 HydrophobicContact CD1-CB 4.06Å; I755-N758 HydrophobicContact CG1-CB 4.49Å; I755-N758 WeakPolarHBondContact O-CA 3.38Å; I755-N758 WeakPolarHBondContact O-CB 3.33Å; I755-N758 PolarHBondContact O-N 3.21Å; N758-A762 WeakPolarHBondContact O-CB 3.31Å; N758-A762 PolarHBondContact O-N 3.24Å; N758-A804 HydrophobicContact CB-CB 4.16Å; N758-A804 WeakPolarHBondContact CB-O 3.49Å; N758-A804 PolarHBondContact ND2-O 3.46Å; N758-I807 PolarHBondContact ND2-O 3.41Å; N758-V809 WeakPolarHBondContact OD1-CB 3.37Å; N758-V809 VanDerWaalsContact OD1-CG2 3.26Å; N758-V809 WeakPolarHBondContact OD1-CG2 3.46Å
759	V	97.4	Very high	95.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-69.4	-44.1	179.4	177.7	0	0	0	0	111.3	F732 M740 I744 I755 F757 L761 A762 L763 M801 A804	F732-V759 HydrophobicContact CD2-CG1 4.27Å; F732-V759 HydrophobicContact CE1-CG1 4Å; F732-V759 HydrophobicContact CE2-CB 3.82Å; F732-V759 HydrophobicContact CE2-CG1 3.65Å; F732-V759 HydrophobicContact CZ-CB 3.82Å; F732-V759 HydrophobicContact CZ-CG1 3.5Å; M740-V759 HydrophobicContact CE-CG1 4.1Å; I744-V759 HydrophobicContact CD1-CG1 4Å; I744-V759 HydrophobicContact CG1-CG1 4.48Å; I744-V759 HydrophobicContact CG1-CG2 4.22Å; I755-V759 HydrophobicContact CG1-CG2 4.33Å; I755-V759 WeakPolarHBondContact O-CG2 3.48Å; I755-V759 PolarHBondContact O-N 3.01Å; F757-V759 PolarHBondContact O-N 3.01Å; V759-L761 VanDerWaalsContact C-N 3.35Å; V759-L761 PolarHBondContact O-N 2.69Å; V759-A762 PolarHBondContact O-N 3.04Å; V759-A762 VanDerWaalsContact O-N 3.16Å; V759-L763 HydrophobicContact CG1-CD1 4.02Å; V759-L763 HydrophobicContact CG1-CG 4.39Å; V759-L763 WeakPolarHBondContact O-CG 3.49Å; V759-L763 PolarHBondContact O-N 2.78Å; V759-M801 HydrophobicContact CG1-CE 3.98Å; V759-M801 HydrophobicContact CG2-CE 3.98Å; V759-M801 HydrophobicContact CG2-SD 4.12Å; V759-A804 HydrophobicContact CG2-CB 4.04Å
760	A	97.7	Very high	95.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-58.2	-45.5	175.6	0	0	0	0	0	111.9	L698 W727 F732 I756 F757 L763 L764	L698-A760 HydrophobicContact CD1-CB 3.91Å; L698-A760 HydrophobicContact CD2-CB 4.28Å; W727-A760 HydrophobicContact CE3-CB 3.74Å; W727-A760 HydrophobicContact CZ3-CB 3.87Å; F732-A760 HydrophobicContact CZ-CB 4.47Å; I756-A760 WeakPolarHBondContact O-CB 3.5Å; I756-A760 PolarHBondContact O-N 3.27Å; F757-A760 PolarHBondContact O-N 3.13Å; A760-L763 PolarHBondContact O-N 3.21Å; A760-L764 WeakPolarHBondContact O-CB 3.35Å; A760-L764 WeakPolarHBondContact O-CD1 3.43Å; A760-L764 VanDerWaalsContact O-CG 3.25Å; A760-L764 WeakPolarHBondContact O-CG 2.84Å; A760-L764 PolarHBondContact O-N 2.94Å
761	L	97.6	Very high	95.8	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-66.6	-35.5	175.8	-69.3	169	0	0	0	112.4	L698 L701 M702 F757 V759 K765 I807 V809	L698-L761 HydrophobicContact CD1-CD2 4.15Å; L698-L761 HydrophobicContact CD1-CG 4.28Å; L701-L761 HydrophobicContact CB-CD1 3.97Å; L701-L761 HydrophobicContact CB-CD2 4.04Å; L701-L761 HydrophobicContact CD1-CD1 4.24Å; M702-L761 HydrophobicContact CG-CD2 4.17Å; F757-L761 WeakPolarHBondContact O-CB 3.4Å; F757-L761 VanDerWaalsContact O-CG 3.22Å; F757-L761 WeakPolarHBondContact O-CG 3.43Å; F757-L761 PolarHBondContact O-N 2.64Å; V759-L761 VanDerWaalsContact C-N 3.35Å; V759-L761 PolarHBondContact O-N 2.69Å; L761-K765 WeakPolarHBondContact O-CB 3.25Å; L761-K765 PolarHBondContact O-N 3.3Å; L761-I807 HydrophobicContact CB-CD1 3.99Å; L761-I807 HydrophobicContact CB-CG2 4.13Å; L761-I807 HydrophobicContact CD1-CG2 3.85Å; L761-V809 HydrophobicContact CD1-CG2 3.75Å
762	A	97.4	Very high	96.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65.3	-44.3	175.2	0	0	0	0	0	111.7	N758 V759 K765 T766 L800 A804 I807	N758-A762 WeakPolarHBondContact O-CB 3.31Å; N758-A762 PolarHBondContact O-N 3.24Å; V759-A762 PolarHBondContact O-N 3.04Å; V759-A762 VanDerWaalsContact O-N 3.16Å; A762-K765 PolarHBondContact O-N 3.01Å; A762-T766 VanDerWaalsContact O-CB 3.3Å; A762-T766 WeakPolarHBondContact O-CB 3.38Å; A762-T766 PolarHBondContact O-N 2.91Å; A762-T766 PolarHBondContact O-OG1 3.19Å; A762-L800 HydrophobicContact CB-CD1 3.67Å; A762-L800 HydrophobicContact CB-CG 4.32Å; A762-A804 HydrophobicContact CB-CB 3.99Å; A762-I807 HydrophobicContact CB-CD1 3.85Å
763	L	97.5	Very high	96.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60.8	-49.8	176.4	-73.1	167.1	0	0	0	111.7	F732 F736 M740 V759 A760 T766 S767 L787 Y791 L800	F732-L763 HydrophobicContact CD1-CD1 4.08Å; F732-L763 HydrophobicContact CE1-CD1 3.47Å; F732-L763 VanDerWaalsContact CE1-CD1 3.47Å; F732-L763 HydrophobicContact CZ-CD1 4.23Å; F736-L763 HydrophobicContact CE1-CD1 4.16Å; F736-L763 HydrophobicContact CE1-CD2 3.82Å; F736-L763 HydrophobicContact CZ-CD1 3.89Å; F736-L763 HydrophobicContact CZ-CD2 4.26Å; M740-L763 HydrophobicContact CE-CD1 4.28Å; M740-L763 HydrophobicContact CE-CD2 4.15Å; V759-L763 HydrophobicContact CG1-CD1 4.02Å; V759-L763 HydrophobicContact CG1-CG 4.39Å; V759-L763 WeakPolarHBondContact O-CG 3.49Å; V759-L763 PolarHBondContact O-N 2.78Å; A760-L763 PolarHBondContact O-N 3.21Å; L763-T766 PolarHBondContact O-N 3.39Å; L763-S767 VanDerWaalsContact O-CB 3.31Å; L763-S767 WeakPolarHBondContact O-CB 3.42Å; L763-S767 PolarHBondContact O-N 3.06Å; L763-S767 VanDerWaalsContact O-N 3.12Å; L763-S767 PolarHBondContact O-OG 3.46Å; L763-L787 HydrophobicContact CB-CD1 4.49Å; L763-L787 HydrophobicContact CB-CD2 4.33Å; L763-L787 HydrophobicContact CD2-CD1 3.92Å; L763-L787 HydrophobicContact CD2-CD2 4.28Å; L763-L787 HydrophobicContact CD2-CG 4.2Å; L763-Y791 HydrophobicContact CD2-CD2 4.01Å; L763-Y791 HydrophobicContact CD2-CE2 3.32Å; L763-L800 HydrophobicContact CD2-CD1 4.17Å; L763-L800 HydrophobicContact CD2-CD2 3.53Å; L763-L800 HydrophobicContact CG-CD1 4.37Å; L763-L800 HydrophobicContact CG-CD2 4.03Å
764	L	97.4	Very high	96.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63	-42.8	178.2	-71.6	165	0	0	0	111.9	L698 M702 L706 L709 F713 Y723 W727 A760 S767 K768 L771 F783	L698-L764 HydrophobicContact CD1-CD1 4.33Å; M702-L764 HydrophobicContact CE-CD1 4.02Å; M702-L764 HydrophobicContact CE-CD2 4.3Å; M702-L764 HydrophobicContact CG-CD1 4.01Å; M702-L764 HydrophobicContact SD-CD1 3.66Å; L706-L764 HydrophobicContact CD1-CB 3.79Å; L709-L764 HydrophobicContact CD2-CB 4.08Å; L709-L764 HydrophobicContact CD2-CD2 4.24Å; F713-L764 HydrophobicContact CE2-CD2 4.27Å; F713-L764 HydrophobicContact CZ-CD2 4.47Å; Y723-L764 HydrophobicContact CE2-CD2 4.27Å; W727-L764 HydrophobicContact CH2-CD2 4.42Å; W727-L764 HydrophobicContact CH2-CG 4.39Å; W727-L764 HydrophobicContact CZ3-CD1 4.46Å; W727-L764 HydrophobicContact CZ3-CG 4.4Å; A760-L764 WeakPolarHBondContact O-CB 3.35Å; A760-L764 WeakPolarHBondContact O-CD1 3.43Å; A760-L764 VanDerWaalsContact O-CG 3.25Å; A760-L764 WeakPolarHBondContact O-CG 2.84Å; A760-L764 PolarHBondContact O-N 2.94Å; L764-S767 PolarHBondContact O-N 2.98Å; L764-K768 WeakPolarHBondContact O-CA 3.48Å; L764-K768 PolarHBondContact O-N 3.36Å; L764-K768 VanDerWaalsContact O-N 3.08Å; L764-L771 HydrophobicContact CD2-CD1 4.17Å; L764-F783 HydrophobicContact CD2-CE1 3.81Å; L764-F783 HydrophobicContact CD2-CZ 3.65Å
765	K	96.4	Very high	96.3	Very high	116 Å²	116	35.6 Å²	35.6	50%	0.504	18%	0.178	S	C	.	.	H	α-helix	trans	-66.5	-41.5	178.3	-177.3	177.9	177.5	-171.5	0	112.7	L706 L761 A762 S767 K768	L706-K765 HydrophobicContact CD1-CB 4.2Å; L706-K765 HydrophobicContact CD2-CB 3.9Å; L706-K765 HydrophobicContact CD2-CG 3.95Å; L761-K765 WeakPolarHBondContact O-CB 3.25Å; L761-K765 PolarHBondContact O-N 3.3Å; A762-K765 PolarHBondContact O-N 3.01Å; K765-S767 VanDerWaalsContact C-N 3.26Å; K765-S767 PolarHBondContact O-N 3.25Å; K765-K768 WeakPolarHBondContact O-CB 3.5Å
766	T	95.6	Very high	96.1	Very high	58 Å²	58	39.5 Å²	39.5	36%	0.356	20%	0.195	S	C	.	.	H	α-helix	trans	-68.7	-28.5	179.4	-55.6	0	0	0	0	111.9	A762 L763 Q803	A762-T766 VanDerWaalsContact O-CB 3.3Å; A762-T766 WeakPolarHBondContact O-CB 3.38Å; A762-T766 PolarHBondContact O-N 2.91Å; A762-T766 PolarHBondContact O-OG1 3.19Å; L763-T766 PolarHBondContact O-N 3.39Å; T766-Q803 PolarHBondContact OG1-OE1 2.9Å
767	S	95.9	Very high	95.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	10.2	-174.5	-44.6	0	0	0	0	113.6	L763 L764 K765 E769 D770 L771 L787	L763-S767 VanDerWaalsContact O-CB 3.31Å; L763-S767 WeakPolarHBondContact O-CB 3.42Å; L763-S767 PolarHBondContact O-N 3.06Å; L763-S767 VanDerWaalsContact O-N 3.12Å; L763-S767 PolarHBondContact O-OG 3.46Å; L764-S767 PolarHBondContact O-N 2.98Å; K765-S767 VanDerWaalsContact C-N 3.26Å; K765-S767 PolarHBondContact O-N 3.25Å; S767-E769 PolarHBondContact O-N 3.25Å; S767-D770 PolarHBondContact O-N 2.98Å; S767-L771 WeakPolarHBondContact O-CG 3.19Å; S767-L771 PolarHBondContact O-N 3.44Å; S767-L787 WeakPolarHBondContact OG-CD1 3.29Å
768	K	95.9	Very high	95.5	Very high	40 Å²	40	47.5 Å²	47.5	17%	0.174	24%	0.239	C	C	.	.	H	α-helix	trans	-56.9	-47.9	-171	167.9	-179.7	159.1	165.7	0	112.4	D708 L709 L764 K765 D770 L771 L772	D708-K768 WeakPolarHBondContact OD1-CE 3.38Å; D708-K768 IonicContact OD1-NZ 3.44Å; D708-K768 PolarHBondContact OD1-NZ 3.03Å; D708-K768 IonicContact OD2-NZ 2.94Å; D708-K768 PolarHBondContact OD2-NZ 2.64Å; L709-K768 HydrophobicContact CB-CG 4.5Å; L764-K768 WeakPolarHBondContact O-CA 3.48Å; L764-K768 PolarHBondContact O-N 3.36Å; L764-K768 VanDerWaalsContact O-N 3.08Å; K765-K768 WeakPolarHBondContact O-CB 3.5Å; K768-D770 VanDerWaalsContact C-N 3.29Å; K768-D770 PolarHBondContact O-N 3.25Å; K768-L771 PolarHBondContact O-N 3.42Å; K768-L772 HydrophobicContact CD-CD1 4.45Å; K768-L772 HydrophobicContact CG-CD1 3.85Å; K768-L772 HydrophobicContact CG-CG 4.3Å; K768-L772 WeakPolarHBondContact O-CB 3.44Å; K768-L772 WeakPolarHBondContact O-CG 3.49Å; K768-L772 PolarHBondContact O-N 3.14Å
769	E	95.8	Very high	95.4	Very high	118 Å²	118	46.9 Å²	46.9	55%	0.551	24%	0.236	S	C	*	.	H	α-helix	trans	-69	-29.4	-174.2	-53.3	-54.4	128.9	0	0	112	S767 Q773	S767-E769 PolarHBondContact O-N 3.25Å; E769-Q773 WeakPolarHBondContact O-CG 3.27Å; E769-Q773 PolarHBondContact O-NE2 3.35Å
770	D	95.1	Very high	95	Very high	55 Å²	55	49.3 Å²	49.3	29%	0.294	25%	0.249	S	C	.	.	H	α-helix	trans	-69.7	-48.3	171.1	-46.6	-91.6	0	0	0	110.8	S767 K768 L772 Q773 A774 F782 R790	S767-D770 PolarHBondContact O-N 2.98Å; K768-D770 VanDerWaalsContact C-N 3.29Å; K768-D770 PolarHBondContact O-N 3.25Å; D770-L772 VanDerWaalsContact C-N 3.33Å; D770-L772 PolarHBondContact O-N 2.93Å; D770-Q773 PolarHBondContact O-N 2.95Å; D770-Q773 VanDerWaalsContact O-N 3.1Å; D770-A774 PolarHBondContact O-N 3.29Å; D770-F782 HydrophobicContact CB-CD2 4.09Å; D770-F782 HydrophobicContact CB-CE2 3.53Å; D770-F782 HydrophobicContact CB-CZ 3.93Å; D770-R790 IonicContact OD1-CZ 3.09Å; D770-R790 IonicContact OD1-NH1 3.15Å; D770-R790 IonicContact OD1-NH2 3.57Å; D770-R790 PolarHBondContact OD1-NH2 2.88Å; D770-R790 IonicContact OD2-CZ 3.67Å; D770-R790 IonicContact OD2-NH1 3.84Å; D770-R790 PolarHBondContact OD2-NH1 2.89Å; D770-R790 IonicContact OD2-NH2 2.75Å; D770-R790 PolarHBondContact OD2-NH2 3.21Å
771	L	96.3	Very high	94.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67.8	-29.8	-176	-71.1	167.5	0	0	0	113.1	L709 H712 F713 L764 S767 K768 Q773 A774 A779 F782 F783	L709-L771 HydrophobicContact CD1-CB 3.59Å; L709-L771 HydrophobicContact CD1-CD1 4.32Å; L709-L771 HydrophobicContact CD2-CD1 4.35Å; H712-L771 PolarHBondContact CD2-O 3.47Å; H712-L771 PolarHBondContact NE2-O 3.39Å; H712-L771 VanDerWaalsContact NE2-O 3.08Å; F713-L771 HydrophobicContact CE1-CB 4.24Å; F713-L771 HydrophobicContact CZ-CB 4.46Å; F713-L771 HydrophobicContact CZ-CD1 4.19Å; F713-L771 HydrophobicContact CZ-CD2 4.26Å; L764-L771 HydrophobicContact CD2-CD1 4.17Å; S767-L771 WeakPolarHBondContact O-CG 3.19Å; S767-L771 PolarHBondContact O-N 3.44Å; K768-L771 PolarHBondContact O-N 3.42Å; L771-Q773 VanDerWaalsContact C-N 3.29Å; L771-A774 PolarHBondContact O-N 2.91Å; L771-A779 HydrophobicContact CD2-CB 4.22Å; L771-F782 HydrophobicContact CD2-CB 4.44Å; L771-F782 HydrophobicContact CD2-CD1 3.67Å; L771-F782 HydrophobicContact CD2-CE1 4.27Å; L771-F782 HydrophobicContact CD2-CG 4.2Å; L771-F782 HydrophobicContact CG-CD1 4.14Å; L771-F782 HydrophobicContact CG-CE1 4.24Å; L771-F783 HydrophobicContact CD1-CE1 4.03Å; L771-F783 HydrophobicContact CD1-CZ 3.84Å; L771-F783 HydrophobicContact CD2-CD2 4.45Å; L771-F783 HydrophobicContact CD2-CE1 4.24Å; L771-F783 HydrophobicContact CD2-CE2 3.93Å; L771-F783 HydrophobicContact CD2-CZ 3.81Å
772	L	96.6	Very high	94.5	Very high	52 Å²	52	53.8 Å²	53.8	27%	0.272	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-19.7	172.7	-75.3	176.3	0	0	0	113.7	L709 H712 K768 D770	L709-L772 HydrophobicContact CD1-CD2 4.35Å; L709-L772 HydrophobicContact CD1-CG 4.35Å; H712-L772 HydrophobicContact CB-CD2 3.68Å; K768-L772 HydrophobicContact CD-CD1 4.45Å; K768-L772 HydrophobicContact CG-CD1 3.85Å; K768-L772 HydrophobicContact CG-CG 4.3Å; K768-L772 WeakPolarHBondContact O-CB 3.44Å; K768-L772 WeakPolarHBondContact O-CG 3.49Å; K768-L772 PolarHBondContact O-N 3.14Å; D770-L772 VanDerWaalsContact C-N 3.33Å; D770-L772 PolarHBondContact O-N 2.93Å
773	Q	94.8	Very high	94.3	Very high	167 Å²	167	54.5 Å²	54.5	78%	0.78	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-15.4	175.7	-70.3	173.8	78.1	0	0	112.6	E769 D770 L771	E769-Q773 WeakPolarHBondContact O-CG 3.27Å; E769-Q773 PolarHBondContact O-NE2 3.35Å; D770-Q773 PolarHBondContact O-N 2.95Å; D770-Q773 VanDerWaalsContact O-N 3.1Å; L771-Q773 VanDerWaalsContact C-N 3.29Å
774	A	94.8	Very high	93.8	Very high	18 Å²	18	61.7 Å²	61.7	15%	0.149	30%	0.299	C	S	.	.			trans	-82.5	146.4	179.3	0	0	0	0	0	112.3	H712 D770 L771 A779	H712-A774 PolarHBondContact NE2-O 2.8Å; D770-A774 PolarHBondContact O-N 3.29Å; L771-A774 PolarHBondContact O-N 2.91Å; A774-A779 HydrophobicContact CB-CB 4.18Å
775	D	92.8	Very high	93.3	Very high	99 Å²	99	62.1 Å²	62.1	53%	0.529	30%	0.301	S	S	.	.			trans	-84.6	-172.1	162.3	65.8	12.7	0	0	0	110.9	E777 G778 A779	D775-E777 PolarHBondContact O-N 2.79Å; D775-E777 PolarHBondContact OD1-N 2.94Å; D775-G778 PolarHBondContact O-N 2.75Å; D775-G778 PolarHBondContact OD1-N 3.4Å; D775-A779 VanDerWaalsContact O-CB 3.26Å; D775-A779 WeakPolarHBondContact O-CB 3.47Å; D775-A779 PolarHBondContact O-N 3.22Å
776	F	91.6	Very high	93	Very high	83 Å²	83	59.7 Å²	59.7	36%	0.364	29%	0.292	S	S	.	.	H	α-helix	trans	-59.1	-44.1	-177.8	-179.7	-90.8	0	0	0	113.2	L716 L718 M722 L780	L716-F776 WeakPolarHBondContact O-CD2 3.35Å; L718-F776 HydrophobicContact CB-CD2 4.38Å; L718-F776 HydrophobicContact CD1-CD2 4.17Å; L718-F776 HydrophobicContact CD1-CE2 3.98Å; M722-F776 HydrophobicContact CE-CE2 4.43Å; M722-F776 HydrophobicContact SD-CE2 3.7Å; M722-F776 HydrophobicContact SD-CZ 3.81Å; F776-L780 HydrophobicContact CD1-CD1 4.07Å; F776-L780 HydrophobicContact CE1-CD1 3.53Å; F776-L780 HydrophobicContact CE2-CD1 4.47Å; F776-L780 HydrophobicContact CZ-CD1 3.76Å; F776-L780 WeakPolarHBondContact O-CG 3.35Å; F776-L780 PolarHBondContact O-N 3.49Å
777	E	89.4	Confident	92.9	Very high	149 Å²	149	57 Å²	57	70%	0.696	28%	0.275	S	S	*	.	H	α-helix	trans	-73.7	-43.2	179.6	-171.8	177.6	158.3	0	0	110.9	D775 A779 L780 K781	D775-E777 PolarHBondContact O-N 2.79Å; D775-E777 PolarHBondContact OD1-N 2.94Å; E777-A779 VanDerWaalsContact C-N 3.33Å; E777-A779 PolarHBondContact O-N 2.54Å; E777-L780 PolarHBondContact O-N 2.87Å; E777-K781 WeakPolarHBondContact O-CB 3.17Å; E777-K781 PolarHBondContact O-N 2.82Å
778	G	92.2	Very high	92.7	Very high	27 Å²	27	57.1 Å²	57.1	28%	0.278	28%	0.276	S	S	.	.	H	α-helix	trans	-57.6	-42.2	175.4	0	0	0	0	0	112.7	D775 K781 F782	D775-G778 PolarHBondContact O-N 2.75Å; D775-G778 PolarHBondContact OD1-N 3.4Å; G778-K781 PolarHBondContact O-N 2.89Å; G778-F782 WeakPolarHBondContact O-CB 3.37Å; G778-F782 PolarHBondContact O-N 3.43Å
779	A	94.2	Very high	92.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-67.1	-43.3	178.8	0	0	0	0	0	111.9	L718 L771 A774 D775 E777 F782 F783	L718-A779 HydrophobicContact CD2-CB 3.59Å; L771-A779 HydrophobicContact CD2-CB 4.22Å; A774-A779 HydrophobicContact CB-CB 4.18Å; D775-A779 VanDerWaalsContact O-CB 3.26Å; D775-A779 WeakPolarHBondContact O-CB 3.47Å; D775-A779 PolarHBondContact O-N 3.22Å; E777-A779 VanDerWaalsContact C-N 3.33Å; E777-A779 PolarHBondContact O-N 2.54Å; A779-F782 WeakPolarHBondContact O-CB 3.29Å; A779-F782 PolarHBondContact O-N 3.4Å; A779-F783 WeakPolarHBondContact O-CD2 3.18Å; A779-F783 PolarHBondContact O-N 3.18Å
780	L	90.1	Very high	92.2	Very high	52 Å²	52	55.9 Å²	55.9	27%	0.272	27%	0.266	S	S	.	.	H	α-helix	trans	-65.7	-41.2	175.3	-69.6	175.1	0	0	0	112.1	L718 M722 F776 E777 F782 F783 R784	L718-L780 HydrophobicContact CD1-CD2 3.78Å; L718-L780 HydrophobicContact CD1-CG 4.08Å; M722-L780 HydrophobicContact CB-CD2 4.08Å; F776-L780 HydrophobicContact CD1-CD1 4.07Å; F776-L780 HydrophobicContact CE1-CD1 3.53Å; F776-L780 HydrophobicContact CE2-CD1 4.47Å; F776-L780 HydrophobicContact CZ-CD1 3.76Å; F776-L780 WeakPolarHBondContact O-CG 3.35Å; F776-L780 PolarHBondContact O-N 3.49Å; E777-L780 PolarHBondContact O-N 2.87Å; L780-F782 VanDerWaalsContact C-N 3.35Å; L780-F783 PolarHBondContact O-N 2.8Å; L780-R784 VanDerWaalsContact O-CB 3.27Å; L780-R784 WeakPolarHBondContact O-CB 3.11Å; L780-R784 PolarHBondContact O-N 2.94Å
781	K	89.9	Confident	92.1	Very high	86 Å²	86	53.7 Å²	53.7	37%	0.374	25%	0.254	S	S	.	.	H	α-helix	trans	-62	-42.6	173.2	-175.3	177.2	179.9	179.9	0	111.4	D519 E777 G778 R784 V785	D519-K781 WeakPolarHBondContact OD1-CE 3.48Å; D519-K781 IonicContact OD1-NZ 2.64Å; D519-K781 PolarHBondContact OD1-NZ 2.9Å; D519-K781 IonicContact OD2-NZ 2.74Å; D519-K781 PolarHBondContact OD2-NZ 3.12Å; E777-K781 WeakPolarHBondContact O-CB 3.17Å; E777-K781 PolarHBondContact O-N 2.82Å; G778-K781 PolarHBondContact O-N 2.89Å; K781-R784 PolarHBondContact O-N 2.89Å; K781-V785 WeakPolarHBondContact O-CB 3.31Å; K781-V785 PolarHBondContact O-N 2.96Å
782	F	94.3	Very high	91.6	Very high	10 Å²	10	58.7 Å²	58.7	4%	0.044	27%	0.273	C	S	.	.	I	π-helix	trans	-59.6	-52	176.3	-178.3	-84.8	0	0	0	111.3	D770 L771 G778 A779 L780 R784 Q786 L787	D770-F782 HydrophobicContact CB-CD2 4.09Å; D770-F782 HydrophobicContact CB-CE2 3.53Å; D770-F782 HydrophobicContact CB-CZ 3.93Å; L771-F782 HydrophobicContact CD2-CB 4.44Å; L771-F782 HydrophobicContact CD2-CD1 3.67Å; L771-F782 HydrophobicContact CD2-CE1 4.27Å; L771-F782 HydrophobicContact CD2-CG 4.2Å; L771-F782 HydrophobicContact CG-CD1 4.14Å; L771-F782 HydrophobicContact CG-CE1 4.24Å; G778-F782 WeakPolarHBondContact O-CB 3.37Å; G778-F782 PolarHBondContact O-N 3.43Å; A779-F782 WeakPolarHBondContact O-CB 3.29Å; A779-F782 PolarHBondContact O-N 3.4Å; L780-F782 VanDerWaalsContact C-N 3.35Å; F782-R784 VanDerWaalsContact C-N 3.29Å; F782-R784 PolarHBondContact O-N 3.17Å; F782-Q786 HydrophobicContact CD2-CB 3.91Å; F782-Q786 HydrophobicContact CE2-CB 4.14Å; F782-Q786 HydrophobicContact CG-CB 4.44Å; F782-Q786 PolarHBondContact O-N 3.47Å; F782-L787 HydrophobicContact CD1-CB 4.15Å; F782-L787 HydrophobicContact CE1-CB 3.84Å; F782-L787 HydrophobicContact CE1-CD1 4.03Å; F782-L787 HydrophobicContact CE1-CG 4.45Å; F782-L787 WeakPolarHBondContact O-CB 3.44Å; F782-L787 PolarHBondContact O-N 2.99Å
783	F	93	Very high	91	Very high	14 Å²	14	58.7 Å²	58.7	6%	0.061	28%	0.28	C	S	.	.	I	π-helix	trans	-59.5	-37.1	178.1	-76.5	-54.8	0	0	0	113.4	F713 L718 Y723 W727 L764 L771 A779 L780 L787	F713-F783 HydrophobicContact CE2-CE2 4.05Å; F713-F783 AromaticContact CE2-CZ 3.92Å; F713-F783 HydrophobicContact CE2-CZ 3.92Å; F713-F783 AromaticContact CZ-CE2 3.82Å; F713-F783 HydrophobicContact CZ-CE2 3.82Å; F713-F783 AromaticContact CZ-CZ 3.71Å; F713-F783 HydrophobicContact CZ-CZ 3.71Å; L718-F783 HydrophobicContact CD2-CE2 4.33Å; Y723-F783 HydrophobicContact CD1-CD2 4.23Å; Y723-F783 AromaticContact CD1-CE2 3.78Å; Y723-F783 HydrophobicContact CD1-CE2 3.78Å; Y723-F783 HydrophobicContact CD1-CZ 4.32Å; Y723-F783 HydrophobicContact CD2-CD1 4.47Å; Y723-F783 HydrophobicContact CD2-CD2 4.42Å; Y723-F783 HydrophobicContact CD2-CE1 4.14Å; Y723-F783 HydrophobicContact CD2-CE2 4.07Å; Y723-F783 AromaticContact CD2-CZ 3.91Å; Y723-F783 HydrophobicContact CD2-CZ 3.91Å; Y723-F783 HydrophobicContact CE1-CE2 4.29Å; Y723-F783 HydrophobicContact CE2-CZ 4.17Å; Y723-F783 AromaticContact CG-CD2 3.84Å; Y723-F783 HydrophobicContact CG-CD2 3.84Å; Y723-F783 HydrophobicContact CG-CE1 4.48Å; Y723-F783 AromaticContact CG-CE2 3.66Å; Y723-F783 HydrophobicContact CG-CE2 3.66Å; Y723-F783 HydrophobicContact CG-CG 4.33Å; Y723-F783 HydrophobicContact CG-CZ 4.01Å; W727-F783 HydrophobicContact CH2-CD1 4.02Å; W727-F783 AromaticContact CH2-CE1 3.74Å; W727-F783 HydrophobicContact CH2-CE1 3.74Å; W727-F783 AromaticContact CZ2-CD1 3.75Å; W727-F783 HydrophobicContact CZ2-CD1 3.75Å; W727-F783 AromaticContact CZ2-CE1 3.98Å; W727-F783 HydrophobicContact CZ2-CE1 3.98Å; L764-F783 HydrophobicContact CD2-CE1 3.81Å; L764-F783 HydrophobicContact CD2-CZ 3.65Å; L771-F783 HydrophobicContact CD1-CE1 4.03Å; L771-F783 HydrophobicContact CD1-CZ 3.84Å; L771-F783 HydrophobicContact CD2-CD2 4.45Å; L771-F783 HydrophobicContact CD2-CE1 4.24Å; L771-F783 HydrophobicContact CD2-CE2 3.93Å; L771-F783 HydrophobicContact CD2-CZ 3.81Å; A779-F783 WeakPolarHBondContact O-CD2 3.18Å; A779-F783 PolarHBondContact O-N 3.18Å; L780-F783 PolarHBondContact O-N 2.8Å; F783-L787 HydrophobicContact CD1-CD2 3.73Å; F783-L787 HydrophobicContact CE1-CD2 4.24Å
784	R	87.3	Confident	90.5	Very high	152 Å²	152	53 Å²	53	57%	0.574	26%	0.262	S	S	*	.	I	π-helix	trans	-81.2	-36.9	-176.1	-176.1	172.4	174.3	-172.6	-8.2	113.9	E521 L780 K781 F782	E521-R784 HydrophobicContact CG-CG 4.07Å; E521-R784 IonicContact OE1-CZ 3.52Å; E521-R784 IonicContact OE1-NE 2.69Å; E521-R784 PolarHBondContact OE1-NE 3.04Å; E521-R784 IonicContact OE1-NH2 3.86Å; E521-R784 PolarHBondContact OE1-NH2 3.38Å; E521-R784 VanDerWaalsContact OE2-CG 3.32Å; E521-R784 WeakPolarHBondContact OE2-CG 3.2Å; E521-R784 IonicContact OE2-NE 3.81Å; E521-R784 PolarHBondContact OE2-NE 3.36Å; L780-R784 VanDerWaalsContact O-CB 3.27Å; L780-R784 WeakPolarHBondContact O-CB 3.11Å; L780-R784 PolarHBondContact O-N 2.94Å; K781-R784 PolarHBondContact O-N 2.89Å; F782-R784 VanDerWaalsContact C-N 3.29Å; F782-R784 PolarHBondContact O-N 3.17Å
785	V	87.6	Confident	90.1	Very high	9 Å²	9	55.5 Å²	55.5	6%	0.055	27%	0.271	C	S	.	.	I	π-helix	trans	-115.8	-53.4	-169.4	-178.3	0	0	0	0	112.7	E521 K781 K789	E521-V785 HydrophobicContact CG-CG2 3.99Å; K781-V785 WeakPolarHBondContact O-CB 3.31Å; K781-V785 PolarHBondContact O-N 2.96Å; V785-K789 HydrophobicContact CG1-CD 4.35Å; V785-K789 WeakPolarHBondContact O-CD 3.38Å; V785-K789 VanDerWaalsContact O-CG 3.24Å; V785-K789 WeakPolarHBondContact O-CG 3.44Å
786	Q	90.6	Very high	90	Very high	65 Å²	65	53.9 Å²	53.9	30%	0.304	26%	0.262	S	S	.	.	I	π-helix	trans	-84.2	-38	-170	-69.4	-175.4	-14.5	0	0	113.1	D517 F782 K789 R790	D517-Q786 PolarHBondContact OD2-NE2 3.46Å; F782-Q786 HydrophobicContact CD2-CB 3.91Å; F782-Q786 HydrophobicContact CE2-CB 4.14Å; F782-Q786 HydrophobicContact CG-CB 4.44Å; F782-Q786 PolarHBondContact O-N 3.47Å; Q786-K789 WeakPolarHBondContact O-CB 3.24Å; Q786-K789 PolarHBondContact O-N 3.13Å; Q786-R790 PolarHBondContact O-N 3.49Å
787	L	93.3	Very high	90	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.7	-47.6	-179	-179.7	67.5	0	0	0	112.5	W727 F736 L763 S767 F782 F783 K789 R790 Y791	W727-L787 HydrophobicContact CH2-CD2 4.43Å; W727-L787 HydrophobicContact CZ2-CD2 3.92Å; F736-L787 HydrophobicContact CE1-CD2 4.48Å; F736-L787 HydrophobicContact CE1-CG 4.19Å; F736-L787 HydrophobicContact CZ-CD2 3.98Å; F736-L787 HydrophobicContact CZ-CG 4.14Å; L763-L787 HydrophobicContact CB-CD1 4.49Å; L763-L787 HydrophobicContact CB-CD2 4.33Å; L763-L787 HydrophobicContact CD2-CD1 3.92Å; L763-L787 HydrophobicContact CD2-CD2 4.28Å; L763-L787 HydrophobicContact CD2-CG 4.2Å; S767-L787 WeakPolarHBondContact OG-CD1 3.29Å; F782-L787 HydrophobicContact CD1-CB 4.15Å; F782-L787 HydrophobicContact CE1-CB 3.84Å; F782-L787 HydrophobicContact CE1-CD1 4.03Å; F782-L787 HydrophobicContact CE1-CG 4.45Å; F782-L787 WeakPolarHBondContact O-CB 3.44Å; F782-L787 PolarHBondContact O-N 2.99Å; F783-L787 HydrophobicContact CD1-CD2 3.73Å; F783-L787 HydrophobicContact CE1-CD2 4.24Å; L787-K789 VanDerWaalsContact C-N 3.31Å; L787-K789 PolarHBondContact O-N 3.04Å; L787-R790 PolarHBondContact O-N 3.13Å; L787-Y791 HydrophobicContact CD1-CE2 3.78Å; L787-Y791 HydrophobicContact CG-CE2 4.36Å; L787-Y791 WeakPolarHBondContact O-CD2 3.45Å; L787-Y791 VanDerWaalsContact O-CE2 3.28Å; L787-Y791 WeakPolarHBondContact O-CE2 3.44Å
788	P	92.1	Very high	89.9	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.019	23%	0.229	C	C	.	.	H	α-helix	trans	-69.4	-27.6	178.1	-19.7	35	0	0	0	113.1	I522 K735 F736 R790 Y791	I522-P788 HydrophobicContact CD1-CB 3.85Å; K735-P788 WeakPolarHBondContact O-CB 3.31Å; F736-P788 HydrophobicContact CD1-CB 4.27Å; F736-P788 HydrophobicContact CE1-CB 4.36Å; F736-P788 HydrophobicContact CE1-CG 4.35Å; F736-P788 HydrophobicContact CZ-CG 4.32Å; P788-R790 VanDerWaalsContact C-N 3.27Å; P788-R790 PolarHBondContact O-N 3.34Å; P788-Y791 PolarHBondContact O-N 2.78Å
789	K	89.9	Confident	89.9	Confident	49 Å²	49	52.1 Å²	52.1	21%	0.213	24%	0.239	C	C	.	.	H	α-helix	trans	-61.7	-37.1	-179.4	-80.4	171.6	178.4	174.3	0	111.1	D517 S518 I522 V785 Q786 L787 Y791 R792	D517-K789 IonicContact OD1-NZ 2.62Å; D517-K789 PolarHBondContact OD1-NZ 3.22Å; S518-K789 PolarHBondContact O-NZ 3.39Å; I522-K789 HydrophobicContact CD1-CB 4.17Å; I522-K789 HydrophobicContact CD1-CG 3.71Å; I522-K789 HydrophobicContact CG1-CG 3.88Å; V785-K789 HydrophobicContact CG1-CD 4.35Å; V785-K789 WeakPolarHBondContact O-CD 3.38Å; V785-K789 VanDerWaalsContact O-CG 3.24Å; V785-K789 WeakPolarHBondContact O-CG 3.44Å; Q786-K789 WeakPolarHBondContact O-CB 3.24Å; Q786-K789 PolarHBondContact O-N 3.13Å; L787-K789 VanDerWaalsContact C-N 3.31Å; L787-K789 PolarHBondContact O-N 3.04Å; K789-Y791 PolarHBondContact O-N 3.28Å; K789-R792 PolarHBondContact O-N 2.67Å
790	R	91.2	Very high	89.9	Confident	84 Å²	84	52.2 Å²	52.2	32%	0.317	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-27.1	-179.1	-68.6	178.9	176.1	-167.3	-3.4	113.8	D770 Q786 L787 P788 N796	D770-R790 IonicContact OD1-CZ 3.09Å; D770-R790 IonicContact OD1-NH1 3.15Å; D770-R790 IonicContact OD1-NH2 3.57Å; D770-R790 PolarHBondContact OD1-NH2 2.88Å; D770-R790 IonicContact OD2-CZ 3.67Å; D770-R790 IonicContact OD2-NH1 3.84Å; D770-R790 PolarHBondContact OD2-NH1 2.89Å; D770-R790 IonicContact OD2-NH2 2.75Å; D770-R790 PolarHBondContact OD2-NH2 3.21Å; Q786-R790 PolarHBondContact O-N 3.49Å; L787-R790 PolarHBondContact O-N 3.13Å; P788-R790 VanDerWaalsContact C-N 3.27Å; P788-R790 PolarHBondContact O-N 3.34Å; R790-N796 WeakPolarHBondContact O-CB 3.49Å; R790-N796 PolarHBondContact O-ND2 2.97Å
791	Y	91.6	Very high	90.1	Very high	8 Å²	8	49.8 Å²	49.8	3%	0.031	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	14.9	-172.9	-52.7	-71.3	0	0	0	114.5	F736 M740 L763 L787 P788 K789 A793 N796 L800	F736-Y791 HydrophobicContact CD1-CD2 4.31Å; F736-Y791 HydrophobicContact CE1-CD2 4.1Å; M740-Y791 HydrophobicContact SD-CD1 4.47Å; M740-Y791 HydrophobicContact SD-CD2 4.09Å; M740-Y791 HydrophobicContact SD-CG 3.79Å; L763-Y791 HydrophobicContact CD2-CD2 4.01Å; L763-Y791 HydrophobicContact CD2-CE2 3.32Å; L787-Y791 HydrophobicContact CD1-CE2 3.78Å; L787-Y791 HydrophobicContact CG-CE2 4.36Å; L787-Y791 WeakPolarHBondContact O-CD2 3.45Å; L787-Y791 VanDerWaalsContact O-CE2 3.28Å; L787-Y791 WeakPolarHBondContact O-CE2 3.44Å; P788-Y791 PolarHBondContact O-N 2.78Å; K789-Y791 PolarHBondContact O-N 3.28Å; Y791-A793 VanDerWaalsContact C-N 3.3Å; Y791-N796 HydrophobicContact CD1-CB 4.17Å; Y791-L800 HydrophobicContact CD1-CB 4.13Å; Y791-L800 HydrophobicContact CD1-CD2 3.92Å; Y791-L800 HydrophobicContact CD2-CD2 4.47Å; Y791-L800 HydrophobicContact CE1-CB 3.84Å; Y791-L800 HydrophobicContact CE1-CD1 3.98Å; Y791-L800 HydrophobicContact CE1-CD2 3.75Å; Y791-L800 HydrophobicContact CE1-CG 4.06Å; Y791-L800 HydrophobicContact CE2-CD2 4.32Å; Y791-L800 HydrophobicContact CG-CD2 4.3Å
792	R	86.4	Confident	90.3	Very high	106 Å²	106	50 Å²	50	40%	0.4	23%	0.229	S	C	.	.	S	Bend	trans	-65	-33.8	172	-87.7	-169.1	176	139.3	-11.7	113	I522 P737 K789	I522-R792 HydrophobicContact CD1-CG 4.45Å; P737-R792 HydrophobicContact CB-CG 4.32Å; P737-R792 HydrophobicContact CG-CB 4.33Å; P737-R792 HydrophobicContact CG-CG 3.73Å; K789-R792 PolarHBondContact O-N 2.67Å
793	A	84.5	Confident	90.2	Very high	51 Å²	51	53.4 Å²	53.4	42%	0.421	25%	0.245	S	C	.	.	S	Bend	trans	-77.8	123.6	174.2	0	0	0	0	0	109.6	Y791 E795 N796 A797	Y791-A793 VanDerWaalsContact C-N 3.3Å; A793-E795 PolarHBondContact O-N 3.02Å; A793-E795 VanDerWaalsContact O-N 3.1Å; A793-N796 PolarHBondContact O-N 2.97Å; A793-A797 PolarHBondContact O-N 3.05Å
794	A	83.5	Confident	90.3	Very high	48 Å²	48	52.7 Å²	52.7	40%	0.397	24%	0.242	S	C	.	.	H	α-helix	trans	-55.7	-30.2	-179.1	0	0	0	0	0	113	C739 A797 R798	C739-A794 HydrophobicContact CB-CB 4.3Å; A794-A797 PolarHBondContact O-N 3.12Å; A794-R798 WeakPolarHBondContact O-CB 3.33Å; A794-R798 PolarHBondContact O-N 3.03Å
795	E	86.7	Confident	90.5	Very high	71 Å²	71	47 Å²	47	33%	0.332	23%	0.225	S	C	.	.	H	α-helix	trans	-59.9	-44.5	173.4	-175.2	59.1	-153.2	0	0	112.9	A793 R798 R799	A793-E795 PolarHBondContact O-N 3.02Å; A793-E795 VanDerWaalsContact O-N 3.1Å; E795-R798 VanDerWaalsContact CD-NH1 3.34Å; E795-R798 IonicContact OE1-NH1 3.44Å; E795-R798 PolarHBondContact OE1-NH1 2.89Å; E795-R798 IonicContact OE2-CZ 3.19Å; E795-R798 IonicContact OE2-NH1 2.71Å; E795-R798 PolarHBondContact OE2-NH1 2.9Å; E795-R798 IonicContact OE2-NH2 2.75Å; E795-R798 PolarHBondContact OE2-NH2 3.02Å; E795-R799 VanDerWaalsContact O-CG 3.26Å; E795-R799 WeakPolarHBondContact O-CG 3.32Å; E795-R799 PolarHBondContact O-N 3.16Å; E795-R799 VanDerWaalsContact O-N 3.11Å; E795-R799 IonicContact OE1-CZ 3.16Å; E795-R799 IonicContact OE1-NE 2.65Å; E795-R799 PolarHBondContact OE1-NE 2.71Å; E795-R799 IonicContact OE1-NH2 3.64Å; E795-R799 PolarHBondContact OE1-NH2 2.72Å
796	N	90.4	Very high	90.8	Very high	65 Å²	65	52.8 Å²	52.8	35%	0.348	26%	0.256	S	S	.	.	H	α-helix	trans	-71.4	-36.6	178	-69.8	-11.9	0	0	0	111.2	R790 Y791 A793 L800	R790-N796 WeakPolarHBondContact O-CB 3.49Å; R790-N796 PolarHBondContact O-ND2 2.97Å; Y791-N796 HydrophobicContact CD1-CB 4.17Å; A793-N796 PolarHBondContact O-N 2.97Å; N796-L800 WeakPolarHBondContact O-CB 3.5Å; N796-L800 PolarHBondContact O-N 2.91Å
797	A	90.9	Very high	90.9	Very high	3 Å²	3	50.5 Å²	50.5	3%	0.025	25%	0.245	C	C	.	.	H	α-helix	trans	-61.7	-47.8	173.8	0	0	0	0	0	111.5	M740 A793 A794 R799 L800 M801	M740-A797 HydrophobicContact CB-CB 3.78Å; M740-A797 HydrophobicContact CG-CB 4.37Å; A793-A797 PolarHBondContact O-N 3.05Å; A794-A797 PolarHBondContact O-N 3.12Å; A797-R799 PolarHBondContact O-N 3.31Å; A797-L800 WeakPolarHBondContact O-CB 3.3Å; A797-L800 PolarHBondContact O-N 3.12Å; A797-L800 VanDerWaalsContact O-N 3.17Å; A797-M801 WeakPolarHBondContact O-CG 3.41Å; A797-M801 PolarHBondContact O-N 2.88Å
798	R	88.8	Confident	90.6	Very high	90 Å²	90	58.6 Å²	58.6	34%	0.34	28%	0.28	S	S	.	.	H	α-helix	trans	-61.3	-46.5	178.8	-153.1	-168.5	-37.1	97.8	4.5	111.8	A794 E795 L800 M801 E802	A794-R798 WeakPolarHBondContact O-CB 3.33Å; A794-R798 PolarHBondContact O-N 3.03Å; E795-R798 VanDerWaalsContact CD-NH1 3.34Å; E795-R798 IonicContact OE1-NH1 3.44Å; E795-R798 PolarHBondContact OE1-NH1 2.89Å; E795-R798 IonicContact OE2-CZ 3.19Å; E795-R798 IonicContact OE2-NH1 2.71Å; E795-R798 PolarHBondContact OE2-NH1 2.9Å; E795-R798 IonicContact OE2-NH2 2.75Å; E795-R798 PolarHBondContact OE2-NH2 3.02Å; R798-L800 VanDerWaalsContact C-N 3.29Å; R798-L800 PolarHBondContact O-N 3.18Å; R798-M801 PolarHBondContact O-N 2.81Å; R798-M801 VanDerWaalsContact O-N 3.1Å; R798-E802 WeakPolarHBondContact O-CG 3.19Å; R798-E802 PolarHBondContact O-N 3.36Å
799	R	92	Very high	90.6	Very high	128 Å²	128	59.3 Å²	59.3	48%	0.483	29%	0.285	S	S	.	.	H	α-helix	trans	-58.9	-37.3	174.9	-70.4	171.1	-171.2	-171.1	3.5	112.5	E795 A797 Q803	E795-R799 VanDerWaalsContact O-CG 3.26Å; E795-R799 WeakPolarHBondContact O-CG 3.32Å; E795-R799 PolarHBondContact O-N 3.16Å; E795-R799 VanDerWaalsContact O-N 3.11Å; E795-R799 IonicContact OE1-CZ 3.16Å; E795-R799 IonicContact OE1-NE 2.65Å; E795-R799 PolarHBondContact OE1-NE 2.71Å; E795-R799 IonicContact OE1-NH2 3.64Å; E795-R799 PolarHBondContact OE1-NH2 2.72Å; A797-R799 PolarHBondContact O-N 3.31Å; R799-Q803 VanDerWaalsContact O-CG 3.32Å; R799-Q803 WeakPolarHBondContact O-CG 3.29Å; R799-Q803 PolarHBondContact O-N 3.23Å; R799-Q803 VanDerWaalsContact O-N 3.08Å
800	L	94.8	Very high	90.5	Very high	3 Å²	3	59.8 Å²	59.8	2%	0.016	29%	0.293	C	S	.	.	H	α-helix	trans	-66.6	-42.4	174.3	-177.1	74.4	0	0	0	111.6	M740 A762 L763 Y791 N796 A797 R798 Q803 A804	M740-L800 HydrophobicContact CE-CD2 3.54Å; M740-L800 HydrophobicContact SD-CD2 3.73Å; A762-L800 HydrophobicContact CB-CD1 3.67Å; A762-L800 HydrophobicContact CB-CG 4.32Å; L763-L800 HydrophobicContact CD2-CD1 4.17Å; L763-L800 HydrophobicContact CD2-CD2 3.53Å; L763-L800 HydrophobicContact CG-CD1 4.37Å; L763-L800 HydrophobicContact CG-CD2 4.03Å; Y791-L800 HydrophobicContact CD1-CB 4.13Å; Y791-L800 HydrophobicContact CD1-CD2 3.92Å; Y791-L800 HydrophobicContact CD2-CD2 4.47Å; Y791-L800 HydrophobicContact CE1-CB 3.84Å; Y791-L800 HydrophobicContact CE1-CD1 3.98Å; Y791-L800 HydrophobicContact CE1-CD2 3.75Å; Y791-L800 HydrophobicContact CE1-CG 4.06Å; Y791-L800 HydrophobicContact CE2-CD2 4.32Å; Y791-L800 HydrophobicContact CG-CD2 4.3Å; N796-L800 WeakPolarHBondContact O-CB 3.5Å; N796-L800 PolarHBondContact O-N 2.91Å; A797-L800 WeakPolarHBondContact O-CB 3.3Å; A797-L800 PolarHBondContact O-N 3.12Å; A797-L800 VanDerWaalsContact O-N 3.17Å; R798-L800 VanDerWaalsContact C-N 3.29Å; R798-L800 PolarHBondContact O-N 3.18Å; L800-Q803 PolarHBondContact O-N 3.01Å; L800-A804 WeakPolarHBondContact O-CB 3.21Å; L800-A804 PolarHBondContact O-N 3.43Å
801	M	94.4	Very high	90.5	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-67.5	-41.4	178.3	-65.5	-58.4	110.2	0	0	111.9	M740 H743 I744 L747 V759 A797 R798 Q803 A804 C805	M740-M801 HydrophobicContact CE-CE 4.25Å; M740-M801 HydrophobicContact CG-CE 4.1Å; H743-M801 HydrophobicContact CB-CG 3.96Å; I744-M801 HydrophobicContact CD1-CE 4.18Å; I744-M801 HydrophobicContact CG1-CE 3.89Å; I744-M801 HydrophobicContact CG1-SD 3.71Å; L747-M801 HydrophobicContact CD1-CB 4.38Å; L747-M801 HydrophobicContact CD1-CG 4.5Å; L747-M801 HydrophobicContact CD1-SD 3.91Å; V759-M801 HydrophobicContact CG1-CE 3.98Å; V759-M801 HydrophobicContact CG2-CE 3.98Å; V759-M801 HydrophobicContact CG2-SD 4.12Å; A797-M801 WeakPolarHBondContact O-CG 3.41Å; A797-M801 PolarHBondContact O-N 2.88Å; R798-M801 PolarHBondContact O-N 2.81Å; R798-M801 VanDerWaalsContact O-N 3.1Å; M801-Q803 VanDerWaalsContact C-N 3.29Å; M801-Q803 PolarHBondContact O-N 3.49Å; M801-A804 WeakPolarHBondContact O-CB 3.41Å; M801-A804 PolarHBondContact O-N 3Å; M801-A804 VanDerWaalsContact O-N 3.12Å; M801-C805 PolarHBondContact O-N 2.92Å; M801-C805 PolarHBondContact O-SG 2.87Å; M801-C805 VanDerWaalsContact O-SG 3.37Å
802	E	92.2	Very high	90.5	Very high	92 Å²	92	68.3 Å²	68.3	43%	0.43	34%	0.339	S	S	.	.	H	α-helix	trans	-56.3	-43.1	170.4	-72.3	168.4	-153.7	0	0	111.5	R798 N806	R798-E802 WeakPolarHBondContact O-CG 3.19Å; R798-E802 PolarHBondContact O-N 3.36Å; E802-N806 PolarHBondContact O-N 2.89Å; E802-N806 PolarHBondContact O-ND2 3.4Å
803	Q	93.8	Very high	90.9	Very high	80 Å²	80	66.8 Å²	66.8	37%	0.374	34%	0.336	S	S	.	.	H	α-helix	trans	-66.4	-40.6	174.5	-73.4	-177	39.4	0	0	112.5	T766 R799 L800 M801 N806 I807	T766-Q803 PolarHBondContact OG1-OE1 2.9Å; R799-Q803 VanDerWaalsContact O-CG 3.32Å; R799-Q803 WeakPolarHBondContact O-CG 3.29Å; R799-Q803 PolarHBondContact O-N 3.23Å; R799-Q803 VanDerWaalsContact O-N 3.08Å; L800-Q803 PolarHBondContact O-N 3.01Å; M801-Q803 VanDerWaalsContact C-N 3.29Å; M801-Q803 PolarHBondContact O-N 3.49Å; Q803-N806 PolarHBondContact O-N 2.93Å; Q803-N806 VanDerWaalsContact O-N 3.17Å; Q803-I807 WeakPolarHBondContact O-CG1 3.48Å; Q803-I807 PolarHBondContact O-N 2.86Å
804	A	95.1	Very high	91.4	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-61.9	-45.2	177.1	0	0	0	0	0	111.8	N758 V759 A762 L800 M801 N806 I807	N758-A804 HydrophobicContact CB-CB 4.16Å; N758-A804 WeakPolarHBondContact CB-O 3.49Å; N758-A804 PolarHBondContact ND2-O 3.46Å; V759-A804 HydrophobicContact CG2-CB 4.04Å; A762-A804 HydrophobicContact CB-CB 3.99Å; L800-A804 WeakPolarHBondContact O-CB 3.21Å; L800-A804 PolarHBondContact O-N 3.43Å; M801-A804 WeakPolarHBondContact O-CB 3.41Å; M801-A804 PolarHBondContact O-N 3Å; M801-A804 VanDerWaalsContact O-N 3.12Å; A804-N806 PolarHBondContact O-N 3.42Å; A804-I807 PolarHBondContact O-N 2.86Å; A804-I807 VanDerWaalsContact O-N 3.15Å
805	C	91.9	Very high	91.9	Very high	33 Å²	33	69.4 Å²	69.4	22%	0.223	33%	0.329	C	S	.	.	H	α-helix	trans	-62.1	-29.9	174.2	-66.7	0	0	0	0	112.8	M801	M801-C805 PolarHBondContact O-N 2.92Å; M801-C805 PolarHBondContact O-SG 2.87Å; M801-C805 VanDerWaalsContact O-SG 3.37Å
806	N	92.3	Very high	92.4	Very high	130 Å²	130	70.9 Å²	70.9	70%	0.695	33%	0.334	S	S	*	.	H	α-helix	trans	-80.3	-19.4	175.6	-83	-73.1	0	0	0	114.3	E802 Q803 A804 K808	E802-N806 PolarHBondContact O-N 2.89Å; E802-N806 PolarHBondContact O-ND2 3.4Å; Q803-N806 PolarHBondContact O-N 2.93Å; Q803-N806 VanDerWaalsContact O-N 3.17Å; A804-N806 PolarHBondContact O-N 3.42Å; N806-K808 PolarHBondContact O-N 2.89Å
807	I	93.3	Very high	92.7	Very high	16 Å²	16	68.1 Å²	68.1	8%	0.082	32%	0.319	C	S	.	.	S	Bend	trans	-74.1	126.1	176.4	-72.6	169.2	0	0	0	109.8	N758 L761 A762 Q803 A804 V809	N758-I807 PolarHBondContact ND2-O 3.41Å; L761-I807 HydrophobicContact CB-CD1 3.99Å; L761-I807 HydrophobicContact CB-CG2 4.13Å; L761-I807 HydrophobicContact CD1-CG2 3.85Å; A762-I807 HydrophobicContact CB-CD1 3.85Å; Q803-I807 WeakPolarHBondContact O-CG1 3.48Å; Q803-I807 PolarHBondContact O-N 2.86Å; A804-I807 PolarHBondContact O-N 2.86Å; A804-I807 VanDerWaalsContact O-N 3.15Å; I807-V809 HydrophobicContact CG2-CG2 4.03Å; I807-V809 PolarHBondContact O-N 2.87Å
808	K	87.8	Confident	92.9	Very high	171 Å²	171	70.7 Å²	70.7	74%	0.743	33%	0.331	S	S	*	.			trans	-89.1	104.7	-177.6	-69.2	174.6	-177.2	170.9	0	109.8	Q705 N806 P810	Q705-K808 PolarHBondContact NE2-O 2.94Å; N806-K808 PolarHBondContact O-N 2.89Å; K808-P810 WeakPolarHBondContact O-CD 3.39Å
809	V	90.6	Very high	93.2	Very high	18 Å²	18	73 Å²	73	11%	0.109	34%	0.344	C	S	.	.			trans	-109.8	86.7	168.2	-172.3	0	0	0	0	109.2	L701 F757 N758 L761 I807 T811 L814	L701-V809 HydrophobicContact CD1-CG1 3.79Å; L701-V809 HydrophobicContact CD2-CG1 4.25Å; F757-V809 HydrophobicContact CB-CG1 4.09Å; F757-V809 HydrophobicContact CB-CG2 4.24Å; N758-V809 WeakPolarHBondContact OD1-CB 3.37Å; N758-V809 VanDerWaalsContact OD1-CG2 3.26Å; N758-V809 WeakPolarHBondContact OD1-CG2 3.46Å; L761-V809 HydrophobicContact CD1-CG2 3.75Å; I807-V809 HydrophobicContact CG2-CG2 4.03Å; I807-V809 PolarHBondContact O-N 2.87Å; V809-T811 PolarHBondContact O-N 3.41Å; V809-L814 HydrophobicContact CG1-CD1 3.87Å; V809-L814 HydrophobicContact CG1-CD2 3.99Å; V809-L814 HydrophobicContact CG1-CG 3.87Å
810	P	89.6	Confident	93.4	Very high	59 Å²	59	70.2 Å²	70.2	38%	0.383	34%	0.336	S	S	.	.			trans	-67.5	128.5	-178.8	-17.2	31.5	0	0	0	110.2	K808 K812 K813 L814	K808-P810 WeakPolarHBondContact O-CD 3.39Å; P810-K812 PolarHBondContact O-N 3.36Å; P810-K813 HydrophobicContact CB-CG 4.35Å; P810-K813 HydrophobicContact CG-CG 4.27Å; P810-K813 WeakPolarHBondContact O-CA 3.46Å; P810-K813 WeakPolarHBondContact O-CB 3.02Å; P810-K813 PolarHBondContact O-N 3.08Å; P810-L814 PolarHBondContact O-N 2.87Å
811	T	89.7	Confident	93.4	Very high	85 Å²	85	71.5 Å²	71.5	52%	0.521	34%	0.341	S	S	.	.	H	α-helix	trans	-55.4	-27.5	176.3	55.4	0	0	0	0	113.1	V809 K813 L814 K815	V809-T811 PolarHBondContact O-N 3.41Å; T811-K813 VanDerWaalsContact C-N 3.34Å; T811-K813 PolarHBondContact O-N 3.07Å; T811-L814 PolarHBondContact O-N 3.34Å; T811-K815 WeakPolarHBondContact O-CB 3.25Å; T811-K815 WeakPolarHBondContact O-CG 3.17Å; T811-K815 PolarHBondContact O-N 3.02Å
812	K	92.9	Very high	93.4	Very high	185 Å²	185	75.8 Å²	75.8	80%	0.804	36%	0.361	S	S	*	.	H	α-helix	trans	-64.3	-30.2	170.9	-67.1	-175	179	-179.5	0	114.1	P810 K816	P810-K812 PolarHBondContact O-N 3.36Å; K812-K816 PolarHBondContact O-N 2.92Å
813	K	93.4	Very high	93.4	Very high	75 Å²	75	75.8 Å²	75.8	33%	0.326	37%	0.367	S	S	.	.	H	α-helix	trans	-76.7	-45.4	173.5	-71.6	-154.6	-177.4	-163.6	0	111.3	E704 P810 T811 K815 K816 F817	E704-K813 IonicContact OE1-NZ 3.67Å; E704-K813 PolarHBondContact OE1-NZ 2.86Å; E704-K813 VanDerWaalsContact OE2-CD 3.3Å; E704-K813 WeakPolarHBondContact OE2-CD 3.27Å; E704-K813 IonicContact OE2-NZ 2.72Å; E704-K813 PolarHBondContact OE2-NZ 2.69Å; P810-K813 HydrophobicContact CB-CG 4.35Å; P810-K813 HydrophobicContact CG-CG 4.27Å; P810-K813 WeakPolarHBondContact O-CA 3.46Å; P810-K813 WeakPolarHBondContact O-CB 3.02Å; P810-K813 PolarHBondContact O-N 3.08Å; T811-K813 VanDerWaalsContact C-N 3.34Å; T811-K813 PolarHBondContact O-N 3.07Å; K813-K815 VanDerWaalsContact C-N 3.31Å; K813-K815 PolarHBondContact O-N 3.25Å; K813-K816 WeakPolarHBondContact O-CA 3.21Å; K813-K816 WeakPolarHBondContact O-CB 3.36Å; K813-K816 PolarHBondContact O-N 3.41Å; K813-F817 HydrophobicContact CB-CE2 4.05Å; K813-F817 HydrophobicContact CB-CZ 4.49Å; K813-F817 HydrophobicContact CD-CZ 4.41Å; K813-F817 WeakPolarHBondContact O-CD2 3.25Å; K813-F817 WeakPolarHBondContact O-CG 3.2Å; K813-F817 PolarHBondContact O-N 3.17Å
814	L	94.6	Very high	93.3	Very high	15 Å²	15	75.6 Å²	75.6	8%	0.079	37%	0.368	C	S	.	.	H	α-helix	trans	-53.1	-50.1	174.2	-68.3	176	0	0	0	110.8	Q697 L701 F757 V809 P810 T811 K816 F817 E818	Q697-L814 HydrophobicContact CB-CD2 4.05Å; Q697-L814 HydrophobicContact CG-CD2 4.24Å; Q697-L814 PolarHBondContact NE2-O 2.98Å; L701-L814 HydrophobicContact CD1-CD2 3.89Å; F757-L814 HydrophobicContact CD1-CD2 4.29Å; F757-L814 HydrophobicContact CD2-CD1 4.02Å; F757-L814 HydrophobicContact CD2-CD2 3.88Å; F757-L814 HydrophobicContact CE1-CD2 4.22Å; F757-L814 HydrophobicContact CE2-CD1 4.2Å; F757-L814 HydrophobicContact CE2-CD2 3.81Å; F757-L814 HydrophobicContact CG-CD2 4.12Å; F757-L814 HydrophobicContact CZ-CD2 3.99Å; V809-L814 HydrophobicContact CG1-CD1 3.87Å; V809-L814 HydrophobicContact CG1-CD2 3.99Å; V809-L814 HydrophobicContact CG1-CG 3.87Å; P810-L814 PolarHBondContact O-N 2.87Å; T811-L814 PolarHBondContact O-N 3.34Å; L814-K816 PolarHBondContact O-N 2.94Å; L814-F817 PolarHBondContact O-N 3.44Å; L814-E818 VanDerWaalsContact O-CB 3.26Å; L814-E818 WeakPolarHBondContact O-CB 3.5Å; L814-E818 PolarHBondContact O-N 3.12Å
815	K	94.9	Very high	93	Very high	138 Å²	138	79.1 Å²	79.1	60%	0.6	38%	0.382	S	S	*	.	H	α-helix	trans	-68.1	-10	176.3	-67.6	-170.2	173.3	-167.9	0	115.6	T811 K813 E818 K819	T811-K815 WeakPolarHBondContact O-CB 3.25Å; T811-K815 WeakPolarHBondContact O-CG 3.17Å; T811-K815 PolarHBondContact O-N 3.02Å; K813-K815 VanDerWaalsContact C-N 3.31Å; K813-K815 PolarHBondContact O-N 3.25Å; K815-E818 WeakPolarHBondContact CA-OE2 3.4Å; K815-K819 WeakPolarHBondContact O-CG 3.5Å
816	K	96.6	Very high	92.8	Very high	102 Å²	102	83 Å²	83	44%	0.443	40%	0.397	S	S	.	.	H	α-helix	trans	-86.3	-52.4	169.1	174	-177.7	172.4	-70.2	0	109.8	K812 K813 L814 E818 K819 E820	K812-K816 PolarHBondContact O-N 2.92Å; K813-K816 WeakPolarHBondContact O-CA 3.21Å; K813-K816 WeakPolarHBondContact O-CB 3.36Å; K813-K816 PolarHBondContact O-N 3.41Å; L814-K816 PolarHBondContact O-N 2.94Å; K816-E818 VanDerWaalsContact C-N 3.26Å; K816-E818 PolarHBondContact O-N 2.79Å; K816-K819 PolarHBondContact O-N 3.27Å; K816-K819 VanDerWaalsContact O-N 3.13Å; K816-E820 WeakPolarHBondContact CE-OE1 3.38Å; K816-E820 IonicContact NZ-OE1 3.41Å; K816-E820 PolarHBondContact NZ-OE1 3.39Å; K816-E820 IonicContact NZ-OE2 3.66Å; K816-E820 PolarHBondContact NZ-OE2 3.01Å; K816-E820 WeakPolarHBondContact O-CG 3.42Å; K816-E820 PolarHBondContact O-N 3.27Å
817	F	96.7	Very high	92.6	Very high	7 Å²	7	79.3 Å²	79.3	3%	0.031	38%	0.381	C	S	.	.	H	α-helix	trans	-61.9	-33.9	178.4	-58.9	-37.1	0	0	0	112.3	Y696 Q697 K700 L701 K813 L814 E820 Y821	Y696-F817 HydrophobicContact CD1-CB 4.4Å; Y696-F817 HydrophobicContact CE1-CB 4.38Å; Y696-F817 WeakPolarHBondContact CE1-O 3.25Å; Q697-F817 HydrophobicContact CG-CB 3.93Å; K700-F817 HydrophobicContact CB-CD1 3.8Å; K700-F817 HydrophobicContact CB-CD2 3.77Å; K700-F817 HydrophobicContact CB-CE1 3.83Å; K700-F817 HydrophobicContact CB-CE2 3.8Å; K700-F817 HydrophobicContact CB-CG 3.79Å; K700-F817 HydrophobicContact CB-CZ 3.83Å; K700-F817 HydrophobicContact CD-CD1 4.39Å; K700-F817 HydrophobicContact CD-CE1 4.4Å; K700-F817 HydrophobicContact CG-CD1 3.97Å; K700-F817 HydrophobicContact CG-CE1 4.28Å; K700-F817 HydrophobicContact CG-CG 4.18Å; L701-F817 HydrophobicContact CD2-CE2 4.04Å; L701-F817 HydrophobicContact CG-CE2 4.12Å; K813-F817 HydrophobicContact CB-CE2 4.05Å; K813-F817 HydrophobicContact CB-CZ 4.49Å; K813-F817 HydrophobicContact CD-CZ 4.41Å; K813-F817 WeakPolarHBondContact O-CD2 3.25Å; K813-F817 WeakPolarHBondContact O-CG 3.2Å; K813-F817 PolarHBondContact O-N 3.17Å; L814-F817 PolarHBondContact O-N 3.44Å; F817-E820 WeakPolarHBondContact CD1-OE2 3.47Å; F817-E820 PolarHBondContact O-N 2.85Å; F817-Y821 WeakPolarHBondContact O-CB 3.31Å; F817-Y821 PolarHBondContact O-N 3.09Å
818	E	95.3	Very high	92.1	Very high	58 Å²	58	82.8 Å²	82.8	27%	0.271	40%	0.397	S	S	.	.	H	α-helix	trans	-56.7	-47.1	171.4	-176	176.2	-172	0	0	112.4	L814 K815 K816 Y821 Q822	L814-E818 VanDerWaalsContact O-CB 3.26Å; L814-E818 WeakPolarHBondContact O-CB 3.5Å; L814-E818 PolarHBondContact O-N 3.12Å; K815-E818 WeakPolarHBondContact CA-OE2 3.4Å; K816-E818 VanDerWaalsContact C-N 3.26Å; K816-E818 PolarHBondContact O-N 2.79Å; E818-Y821 PolarHBondContact O-N 2.66Å; E818-Q822 VanDerWaalsContact O-CG 3.28Å; E818-Q822 WeakPolarHBondContact O-CG 3.47Å; E818-Q822 PolarHBondContact O-N 2.57Å
819	K	95.9	Very high	91.6	Very high	138 Å²	138	77.2 Å²	77.2	60%	0.6	38%	0.375	S	S	*	.	H	α-helix	trans	-71.8	-33.8	177.4	-69.3	-175.4	175	-162.3	0	112.7	K815 K816 T823	K815-K819 WeakPolarHBondContact O-CG 3.5Å; K816-K819 PolarHBondContact O-N 3.27Å; K816-K819 VanDerWaalsContact O-N 3.13Å; K819-T823 WeakPolarHBondContact O-CB 3.41Å; K819-T823 PolarHBondContact O-N 3.07Å; K819-T823 PolarHBondContact O-OG1 3.29Å
820	E	96.2	Very high	91	Very high	69 Å²	69	83.6 Å²	83.6	32%	0.322	40%	0.403	S	S	.	.	H	α-helix	trans	-66.4	-39.9	174.4	-72.4	170	174.1	0	0	110.9	Y696 K816 F817 L824	Y696-E820 HydrophobicContact CE1-CB 4.19Å; K816-E820 WeakPolarHBondContact CE-OE1 3.38Å; K816-E820 IonicContact NZ-OE1 3.41Å; K816-E820 PolarHBondContact NZ-OE1 3.39Å; K816-E820 IonicContact NZ-OE2 3.66Å; K816-E820 PolarHBondContact NZ-OE2 3.01Å; K816-E820 WeakPolarHBondContact O-CG 3.42Å; K816-E820 PolarHBondContact O-N 3.27Å; F817-E820 WeakPolarHBondContact CD1-OE2 3.47Å; F817-E820 PolarHBondContact O-N 2.85Å; E820-L824 VanDerWaalsContact O-CB 3.28Å; E820-L824 WeakPolarHBondContact O-CB 3.49Å; E820-L824 PolarHBondContact O-N 3.01Å
821	Y	95.3	Very high	90.3	Very high	31 Å²	31	88.3 Å²	88.3	12%	0.122	42%	0.42	C	S	.	.	H	α-helix	trans	-63.4	-50.3	171.4	-179.6	-99.3	0	0	0	112.3	E689 H692 C693 Y696 F817 E818 T823 L824 R825	E689-Y821 WeakPolarHBondContact OE1-CE1 3.41Å; E689-Y821 PolarHBondContact OE1-OH 3.46Å; H692-Y821 WeakPolarHBondContact CB-OH 3.42Å; C693-Y821 HydrophobicContact CB-CD1 3.54Å; C693-Y821 HydrophobicContact CB-CE1 3.7Å; C693-Y821 HydrophobicContact CB-CG 4.19Å; Y696-Y821 HydrophobicContact CD1-CD2 4.31Å; Y696-Y821 HydrophobicContact CD1-CG 4.48Å; Y696-Y821 AromaticContact CD2-CD2 3.98Å; Y696-Y821 HydrophobicContact CD2-CD2 3.98Å; Y696-Y821 AromaticContact CG-CD2 3.72Å; Y696-Y821 HydrophobicContact CG-CD2 3.72Å; Y696-Y821 HydrophobicContact CG-CG 4.31Å; F817-Y821 WeakPolarHBondContact O-CB 3.31Å; F817-Y821 PolarHBondContact O-N 3.09Å; E818-Y821 PolarHBondContact O-N 2.66Å; Y821-T823 PolarHBondContact O-N 3.15Å; Y821-L824 WeakPolarHBondContact O-CB 3.38Å; Y821-L824 PolarHBondContact O-N 3.14Å; Y821-L824 VanDerWaalsContact O-N 3.16Å; Y821-R825 PolarHBondContact O-N 3.21Å
822	Q	92.9	Very high	89.2	Confident	90 Å²	90	86.8 Å²	86.8	42%	0.421	41%	0.407	S	S	.	.	H	α-helix	trans	-56.8	-47.1	177	-73.8	163.8	-8.5	0	0	111.6	E818 L824 R825 E826	E818-Q822 VanDerWaalsContact O-CG 3.28Å; E818-Q822 WeakPolarHBondContact O-CG 3.47Å; E818-Q822 PolarHBondContact O-N 2.57Å; Q822-L824 VanDerWaalsContact C-N 3.33Å; Q822-L824 PolarHBondContact O-N 3.4Å; Q822-R825 PolarHBondContact O-N 3.18Å; Q822-E826 WeakPolarHBondContact O-CB 2.95Å; Q822-E826 WeakPolarHBondContact O-CG 3.28Å; Q822-E826 PolarHBondContact O-N 3.2Å
823	T	93.8	Very high	88.3	Confident	92 Å²	92	82 Å²	82	56%	0.564	39%	0.39	S	S	*	.	H	α-helix	trans	-62.7	-39.8	177.7	-52.3	0	0	0	0	111.7	K819 Y821 S827	K819-T823 WeakPolarHBondContact O-CB 3.41Å; K819-T823 PolarHBondContact O-N 3.07Å; K819-T823 PolarHBondContact O-OG1 3.29Å; Y821-T823 PolarHBondContact O-N 3.15Å; T823-S827 WeakPolarHBondContact O-CB 3.42Å; T823-S827 PolarHBondContact O-N 2.85Å
824	L	91.5	Very high	87.3	Confident	76 Å²	76	82.3 Å²	82.3	40%	0.398	40%	0.4	S	S	.	.	H	α-helix	trans	-64.6	-45.5	176.2	177.6	61.9	0	0	0	111.3	Y696 E820 Y821 Q822 S827 Q828	Y696-L824 HydrophobicContact CE2-CD2 4.06Å; E820-L824 VanDerWaalsContact O-CB 3.28Å; E820-L824 WeakPolarHBondContact O-CB 3.49Å; E820-L824 PolarHBondContact O-N 3.01Å; Y821-L824 WeakPolarHBondContact O-CB 3.38Å; Y821-L824 PolarHBondContact O-N 3.14Å; Y821-L824 VanDerWaalsContact O-N 3.16Å; Q822-L824 VanDerWaalsContact C-N 3.33Å; Q822-L824 PolarHBondContact O-N 3.4Å; L824-S827 PolarHBondContact O-N 2.66Å; L824-Q828 WeakPolarHBondContact O-CG 3.28Å; L824-Q828 PolarHBondContact O-N 3.26Å
825	R	88.4	Confident	86.3	Confident	74 Å²	74	86.5 Å²	86.5	28%	0.279	42%	0.422	S	S	.	.	H	α-helix	trans	-68.5	-41.5	-180	-173.7	68.2	-168.5	122.2	6.3	112.2	Y821 Q822 S827 Q828 L829	Y821-R825 PolarHBondContact O-N 3.21Å; Q822-R825 PolarHBondContact O-N 3.18Å; R825-S827 VanDerWaalsContact C-N 3.32Å; R825-S827 PolarHBondContact O-N 3.22Å; R825-Q828 VanDerWaalsContact NH1-OE1 3.1Å; R825-Q828 PolarHBondContact O-N 3.19Å; R825-L829 HydrophobicContact CG-CD1 4.16Å; R825-L829 WeakPolarHBondContact O-CB 3.24Å; R825-L829 WeakPolarHBondContact O-CG 3.32Å; R825-L829 PolarHBondContact O-N 2.75Å
826	E	87.1	Confident	85.3	Confident	115 Å²	115	84.2 Å²	84.2	54%	0.537	42%	0.416	S	S	.	.	H	α-helix	trans	-58.4	-43.6	170.9	-76.4	-179.4	-167.7	0	0	111.4	Q822 Q828 L829 Q830	Q822-E826 WeakPolarHBondContact O-CB 2.95Å; Q822-E826 WeakPolarHBondContact O-CG 3.28Å; Q822-E826 PolarHBondContact O-N 3.2Å; E826-Q828 VanDerWaalsContact C-N 3.33Å; E826-Q828 PolarHBondContact O-N 3.18Å; E826-L829 PolarHBondContact O-N 3.34Å; E826-Q830 VanDerWaalsContact O-CG 3.27Å; E826-Q830 WeakPolarHBondContact O-CG 3.48Å; E826-Q830 PolarHBondContact O-N 3.36Å
827	S	87.5	Confident	84.3	Confident	51 Å²	51	85.4 Å²	85.4	36%	0.357	42%	0.418	S	S	.	.	H	α-helix	trans	-66.6	-32.1	177.8	-173.4	0	0	0	0	113.2	T823 L824 R825 Q831	T823-S827 WeakPolarHBondContact O-CB 3.42Å; T823-S827 PolarHBondContact O-N 2.85Å; L824-S827 PolarHBondContact O-N 2.66Å; R825-S827 VanDerWaalsContact C-N 3.32Å; R825-S827 PolarHBondContact O-N 3.22Å; S827-Q831 WeakPolarHBondContact O-CG 3.21Å; S827-Q831 PolarHBondContact O-N 2.79Å
828	Q	82.9	Confident	83.4	Confident	89 Å²	89	92.6 Å²	92.6	42%	0.416	45%	0.446	S	S	.	.	H	α-helix	trans	-69.2	-45.4	172.1	-71.1	170.1	-3.2	0	0	111.3	L824 R825 E826 Q830 Q831 E832	L824-Q828 WeakPolarHBondContact O-CG 3.28Å; L824-Q828 PolarHBondContact O-N 3.26Å; R825-Q828 VanDerWaalsContact NH1-OE1 3.1Å; R825-Q828 PolarHBondContact O-N 3.19Å; E826-Q828 VanDerWaalsContact C-N 3.33Å; E826-Q828 PolarHBondContact O-N 3.18Å; Q828-Q830 PolarHBondContact O-N 3.15Å; Q828-Q831 PolarHBondContact O-N 3.29Å; Q828-E832 PolarHBondContact O-N 3.43Å
829	L	77.6	Confident	82.7	Confident	54 Å²	54	95.3 Å²	95.3	28%	0.283	46%	0.458	S	S	.	.	H	α-helix	trans	-63.5	-18.5	176.5	-76.6	165.5	0	0	0	113.7	R825 E826	R825-L829 HydrophobicContact CG-CD1 4.16Å; R825-L829 WeakPolarHBondContact O-CB 3.24Å; R825-L829 WeakPolarHBondContact O-CG 3.32Å; R825-L829 PolarHBondContact O-N 2.75Å; E826-L829 PolarHBondContact O-N 3.34Å
830	Q	77.3	Confident	81.8	Confident	152 Å²	152	95.3 Å²	95.3	71%	0.71	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-12.7	172.8	-70.7	171.3	34.2	0	0	113.6	E826 Q828	E826-Q830 VanDerWaalsContact O-CG 3.27Å; E826-Q830 WeakPolarHBondContact O-CG 3.48Å; E826-Q830 PolarHBondContact O-N 3.36Å; Q828-Q830 PolarHBondContact O-N 3.15Å
831	Q	74.9	Confident	80.9	Confident	158 Å²	158	96.2 Å²	96.2	74%	0.738	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-21	174.4	-72.3	176.8	24.6	0	0	112.9	S827 Q828	S827-Q831 WeakPolarHBondContact O-CG 3.21Å; S827-Q831 PolarHBondContact O-N 2.79Å; Q828-Q831 PolarHBondContact O-N 3.29Å
832	E	67.8	Low	80.1	Confident	54 Å²	54	99.2 Å²	99.2	25%	0.252	48%	0.477	S	S	.	.	S	Bend	trans	-67.5	134.8	170.5	-171.7	166.4	-142.4	0	0	110.6	Q828 P834 R840	Q828-E832 PolarHBondContact O-N 3.43Å; E832-P834 WeakPolarHBondContact O-CD 3.32Å; E832-R840 IonicContact OE1-CZ 2.78Å; E832-R840 IonicContact OE1-NH1 3.37Å; E832-R840 PolarHBondContact OE1-NH1 3.42Å; E832-R840 IonicContact OE1-NH2 3.98Å; E832-R840 PolarHBondContact OE1-NH2 3.27Å; E832-R840 IonicContact OE2-NH1 2.73Å
833	D	73.6	Confident	79.7	Confident	83 Å²	83	102.4 Å²	102.4	44%	0.444	49%	0.485	S	S	.	.			trans	-61.6	127	-176.7	-166.8	-49	0	0	0	110	I835 D836 R837	D833-I835 PolarHBondContact O-N 2.9Å; D833-I835 VanDerWaalsContact O-N 3.12Å; D833-I835 VanDerWaalsContact OD1-CB 3.28Å; D833-I835 WeakPolarHBondContact OD1-CB 3.2Å; D833-I835 PolarHBondContact OD1-N 2.79Å; D833-D836 HydrophobicContact CB-CB 4.33Å; D833-D836 PolarHBondContact O-N 2.89Å; D833-D836 VanDerWaalsContact O-N 3.09Å; D833-R837 PolarHBondContact O-N 2.94Å
834	P	72.8	Confident	79	Confident	82 Å²	82	104.6 Å²	104.6	53%	0.532	48%	0.483	S	S	.	.	H	α-helix	trans	-51.5	-34.3	175.5	-28.4	35.7	0	0	0	113.4	E832 Y838	E832-P834 WeakPolarHBondContact O-CD 3.32Å; P834-Y838 HydrophobicContact CB-CD2 4.43Å; P834-Y838 HydrophobicContact CB-CE2 4.27Å; P834-Y838 WeakPolarHBondContact O-CB 3.4Å; P834-Y838 WeakPolarHBondContact O-CD2 3.46Å; P834-Y838 PolarHBondContact O-N 3.24Å
835	I	72.4	Confident	78.6	Confident	104 Å²	104	105.7 Å²	105.7	53%	0.533	49%	0.489	S	S	.	.	H	α-helix	trans	-65.3	-49.7	177.9	-63.7	175.8	0	0	0	110.5	D833 R837 Y838 Q839	D833-I835 PolarHBondContact O-N 2.9Å; D833-I835 VanDerWaalsContact O-N 3.12Å; D833-I835 VanDerWaalsContact OD1-CB 3.28Å; D833-I835 WeakPolarHBondContact OD1-CB 3.2Å; D833-I835 PolarHBondContact OD1-N 2.79Å; I835-R837 VanDerWaalsContact C-N 3.32Å; I835-R837 PolarHBondContact O-N 2.92Å; I835-Y838 PolarHBondContact O-N 2.75Å; I835-Q839 HydrophobicContact CG2-CG 4.39Å; I835-Q839 VanDerWaalsContact CG2-NE2 3.28Å; I835-Q839 WeakPolarHBondContact O-CB 3.3Å; I835-Q839 WeakPolarHBondContact O-CG 3.4Å; I835-Q839 PolarHBondContact O-N 3.2Å
836	D	74.8	Confident	78.3	Confident	89 Å²	89	108.5 Å²	108.5	48%	0.476	51%	0.505	S	S	.	.	H	α-helix	trans	-64.3	-39.1	179.6	-75.5	-9.5	0	0	0	111.4	D833 Q839 R840	D833-D836 HydrophobicContact CB-CB 4.33Å; D833-D836 PolarHBondContact O-N 2.89Å; D833-D836 VanDerWaalsContact O-N 3.09Å; D836-Q839 PolarHBondContact O-N 3.16Å; D836-R840 WeakPolarHBondContact O-CB 3.29Å; D836-R840 PolarHBondContact O-N 3.35Å
837	R	74.9	Confident	78.1	Confident	128 Å²	128	108.5 Å²	108.5	48%	0.483	51%	0.505	S	S	.	.	H	α-helix	trans	-60.4	-49	172.8	-178.4	178.1	171.7	-175	-2.6	111.7	D833 I835 R840 E841	D833-R837 PolarHBondContact O-N 2.94Å; I835-R837 VanDerWaalsContact C-N 3.32Å; I835-R837 PolarHBondContact O-N 2.92Å; R837-R840 PolarHBondContact O-N 3.41Å; R837-E841 PolarHBondContact O-N 3.43Å
838	Y	78.5	Confident	77.6	Confident	158 Å²	158	108.3 Å²	108.3	62%	0.62	51%	0.507	S	S	*	.	H	α-helix	trans	-70.1	-28.5	178.5	-71.7	-52.9	0	0	0	113.2	P834 I835 N842	P834-Y838 HydrophobicContact CB-CD2 4.43Å; P834-Y838 HydrophobicContact CB-CE2 4.27Å; P834-Y838 WeakPolarHBondContact O-CB 3.4Å; P834-Y838 WeakPolarHBondContact O-CD2 3.46Å; P834-Y838 PolarHBondContact O-N 3.24Å; I835-Y838 PolarHBondContact O-N 2.75Å; Y838-N842 VanDerWaalsContact O-CB 3.3Å; Y838-N842 WeakPolarHBondContact O-CB 3.49Å; Y838-N842 PolarHBondContact O-N 3.01Å; Y838-N842 PolarHBondContact O-ND2 2.95Å
839	Q	80.1	Confident	77.5	Confident	115 Å²	115	106.7 Å²	106.7	54%	0.537	51%	0.505	S	S	.	.	H	α-helix	trans	-69.5	-43	172.4	-76.6	-174.3	38.9	0	0	111.6	I835 D836 R843	I835-Q839 HydrophobicContact CG2-CG 4.39Å; I835-Q839 VanDerWaalsContact CG2-NE2 3.28Å; I835-Q839 WeakPolarHBondContact O-CB 3.3Å; I835-Q839 WeakPolarHBondContact O-CG 3.4Å; I835-Q839 PolarHBondContact O-N 3.2Å; D836-Q839 PolarHBondContact O-N 3.16Å; Q839-R843 WeakPolarHBondContact O-CB 3.43Å; Q839-R843 PolarHBondContact O-N 3.34Å
840	R	76.6	Confident	77.8	Confident	138 Å²	138	110.5 Å²	110.5	52%	0.521	52%	0.523	S	S	.	.	H	α-helix	trans	-63.3	-43.5	176.3	-165.8	-175.9	-57.6	133.2	3.7	111.5	E832 D836 R837 R843 R844	E832-R840 IonicContact OE1-CZ 2.78Å; E832-R840 IonicContact OE1-NH1 3.37Å; E832-R840 PolarHBondContact OE1-NH1 3.42Å; E832-R840 IonicContact OE1-NH2 3.98Å; E832-R840 PolarHBondContact OE1-NH2 3.27Å; E832-R840 IonicContact OE2-NH1 2.73Å; D836-R840 WeakPolarHBondContact O-CB 3.29Å; D836-R840 PolarHBondContact O-N 3.35Å; R837-R840 PolarHBondContact O-N 3.41Å; R840-R843 PolarHBondContact O-N 3.05Å; R840-R844 PolarHBondContact O-N 2.67Å
841	E	79.1	Confident	78.1	Confident	88 Å²	88	111.1 Å²	111.1	41%	0.411	52%	0.519	S	S	.	.	H	α-helix	trans	-70.4	-41.8	178.8	-161.4	63.9	-163.8	0	0	112.1	R837 R843 R844 L845	R837-E841 PolarHBondContact O-N 3.43Å; E841-R843 VanDerWaalsContact C-N 3.32Å; E841-R843 PolarHBondContact O-N 3.25Å; E841-R844 PolarHBondContact O-N 3.19Å; E841-L845 HydrophobicContact CG-CD1 4.16Å; E841-L845 WeakPolarHBondContact O-CB 3.39Å; E841-L845 VanDerWaalsContact O-CG 3.28Å; E841-L845 WeakPolarHBondContact O-CG 3.42Å; E841-L845 PolarHBondContact O-N 3.47Å
842	N	78	Confident	78.4	Confident	93 Å²	93	109 Å²	109	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-59.6	-42.4	172.7	-89.1	-67.2	0	0	0	111.9	Y838 L845 Q846	Y838-N842 VanDerWaalsContact O-CB 3.3Å; Y838-N842 WeakPolarHBondContact O-CB 3.49Å; Y838-N842 PolarHBondContact O-N 3.01Å; Y838-N842 PolarHBondContact O-ND2 2.95Å; N842-L845 PolarHBondContact O-N 3.07Å; N842-Q846 WeakPolarHBondContact O-CB 3.2Å; N842-Q846 VanDerWaalsContact O-CG 3.25Å; N842-Q846 WeakPolarHBondContact O-CG 3.3Å; N842-Q846 PolarHBondContact O-N 3.27Å
843	R	83.6	Confident	79.2	Confident	158 Å²	158	111.5 Å²	111.5	60%	0.596	52%	0.523	S	S	*	.	H	α-helix	trans	-59.7	-48.5	176.1	-177.7	-173.3	-62.3	-119.6	-0	111	Q839 R840 E841 L845 Q846 E847	Q839-R843 WeakPolarHBondContact O-CB 3.43Å; Q839-R843 PolarHBondContact O-N 3.34Å; R840-R843 PolarHBondContact O-N 3.05Å; E841-R843 VanDerWaalsContact C-N 3.32Å; E841-R843 PolarHBondContact O-N 3.25Å; R843-L845 VanDerWaalsContact C-N 3.31Å; R843-L845 PolarHBondContact O-N 3.49Å; R843-Q846 PolarHBondContact O-N 3.36Å; R843-Q846 VanDerWaalsContact O-N 3.17Å; R843-E847 WeakPolarHBondContact CD-OE1 3.38Å; R843-E847 HydrophobicContact CG-CG 4.43Å; R843-E847 VanDerWaalsContact CG-OE1 3.22Å; R843-E847 WeakPolarHBondContact CG-OE1 3.34Å; R843-E847 WeakPolarHBondContact O-CB 3.48Å; R843-E847 WeakPolarHBondContact O-CG 3.48Å; R843-E847 PolarHBondContact O-N 3.06Å
844	R	80.3	Confident	79.6	Confident	137 Å²	137	113.3 Å²	113.3	52%	0.517	53%	0.529	S	S	.	.	H	α-helix	trans	-60.1	-39.6	177.7	-170	-176.1	-173.3	-174.2	3.6	112.4	R840 E841 A848	R840-R844 PolarHBondContact O-N 2.67Å; E841-R844 PolarHBondContact O-N 3.19Å; R844-A848 WeakPolarHBondContact O-CB 3.49Å; R844-A848 PolarHBondContact O-N 3.48Å
845	L	82.8	Confident	80	Confident	100 Å²	100	113 Å²	113	52%	0.524	52%	0.521	S	S	.	.	H	α-helix	trans	-70.6	-34.5	176.7	-69.9	166.6	0	0	0	112.3	E841 N842 R843 S849	E841-L845 HydrophobicContact CG-CD1 4.16Å; E841-L845 WeakPolarHBondContact O-CB 3.39Å; E841-L845 VanDerWaalsContact O-CG 3.28Å; E841-L845 WeakPolarHBondContact O-CG 3.42Å; E841-L845 PolarHBondContact O-N 3.47Å; N842-L845 PolarHBondContact O-N 3.07Å; R843-L845 VanDerWaalsContact C-N 3.31Å; R843-L845 PolarHBondContact O-N 3.49Å; L845-S849 WeakPolarHBondContact O-CB 3.48Å; L845-S849 PolarHBondContact O-N 3.35Å
846	Q	82.6	Confident	80.4	Confident	132 Å²	132	113 Å²	113	62%	0.617	52%	0.522	S	S	*	.	H	α-helix	trans	-68.5	-44.3	173.2	-75	170.1	-24.1	0	0	111.7	N842 R843 A848 S849 M850	N842-Q846 WeakPolarHBondContact O-CB 3.2Å; N842-Q846 VanDerWaalsContact O-CG 3.25Å; N842-Q846 WeakPolarHBondContact O-CG 3.3Å; N842-Q846 PolarHBondContact O-N 3.27Å; R843-Q846 PolarHBondContact O-N 3.36Å; R843-Q846 VanDerWaalsContact O-N 3.17Å; Q846-A848 VanDerWaalsContact C-N 3.31Å; Q846-A848 PolarHBondContact O-N 3.41Å; Q846-S849 PolarHBondContact O-N 3.49Å; Q846-M850 WeakPolarHBondContact O-CB 3.39Å; Q846-M850 PolarHBondContact O-N 3.47Å
847	E	81.1	Confident	80.9	Confident	116 Å²	116	114 Å²	114	54%	0.542	53%	0.527	S	S	.	.	H	α-helix	trans	-60.6	-39.9	173.7	-71.6	164.2	179.5	0	0	111.2	R843 R851	R843-E847 WeakPolarHBondContact CD-OE1 3.38Å; R843-E847 HydrophobicContact CG-CG 4.43Å; R843-E847 VanDerWaalsContact CG-OE1 3.22Å; R843-E847 WeakPolarHBondContact CG-OE1 3.34Å; R843-E847 WeakPolarHBondContact O-CB 3.48Å; R843-E847 WeakPolarHBondContact O-CG 3.48Å; R843-E847 PolarHBondContact O-N 3.06Å; E847-R851 PolarHBondContact O-N 3.43Å; E847-R851 VanDerWaalsContact O-N 3.15Å
848	A	78.1	Confident	81.2	Confident	47 Å²	47	112.5 Å²	112.5	39%	0.388	53%	0.529	S	S	.	.	H	α-helix	trans	-69.2	-40.5	174.4	0	0	0	0	0	113.3	R844 Q846 R851 L852	R844-A848 WeakPolarHBondContact O-CB 3.49Å; R844-A848 PolarHBondContact O-N 3.48Å; Q846-A848 VanDerWaalsContact C-N 3.31Å; Q846-A848 PolarHBondContact O-N 3.41Å; A848-R851 PolarHBondContact O-N 3.15Å; A848-L852 WeakPolarHBondContact O-CG 3.24Å; A848-L852 PolarHBondContact O-N 3.33Å
849	S	80.6	Confident	81.3	Confident	54 Å²	54	110.1 Å²	110.1	38%	0.378	53%	0.526	S	S	.	.	H	α-helix	trans	-62.2	-49.3	176.4	-158.9	0	0	0	0	110.8	L845 Q846 R851 L852 E853	L845-S849 WeakPolarHBondContact O-CB 3.48Å; L845-S849 PolarHBondContact O-N 3.35Å; Q846-S849 PolarHBondContact O-N 3.49Å; S849-R851 VanDerWaalsContact C-N 3.28Å; S849-R851 PolarHBondContact O-N 3.14Å; S849-L852 PolarHBondContact O-N 3.3Å; S849-L852 VanDerWaalsContact O-N 3.1Å; S849-E853 WeakPolarHBondContact CB-OE1 3.35Å; S849-E853 WeakPolarHBondContact O-CB 3.3Å; S849-E853 VanDerWaalsContact O-CG 3.28Å; S849-E853 WeakPolarHBondContact O-CG 3.49Å; S849-E853 PolarHBondContact O-N 3.11Å; S849-E853 PolarHBondContact OG-OE1 3.35Å
850	M	83.1	Confident	81.7	Confident	134 Å²	134	106.9 Å²	106.9	66%	0.66	52%	0.519	S	S	*	.	H	α-helix	trans	-59.4	-37.2	178	179.7	172.1	-78.2	0	0	112.4	Q846 Q854	Q846-M850 WeakPolarHBondContact O-CB 3.39Å; Q846-M850 PolarHBondContact O-N 3.47Å; M850-Q854 PolarHBondContact O-N 3.1Å; M850-Q854 VanDerWaalsContact O-N 3.1Å
851	R	83.9	Confident	82.2	Confident	166 Å²	166	106.7 Å²	106.7	63%	0.626	52%	0.524	S	S	*	.	H	α-helix	trans	-67.2	-45.4	173.6	178.8	177.4	167.2	-177.9	-6	112.3	E847 A848 S849 E853 Q854 E855	E847-R851 PolarHBondContact O-N 3.43Å; E847-R851 VanDerWaalsContact O-N 3.15Å; A848-R851 PolarHBondContact O-N 3.15Å; S849-R851 VanDerWaalsContact C-N 3.28Å; S849-R851 PolarHBondContact O-N 3.14Å; R851-E853 VanDerWaalsContact C-N 3.32Å; R851-Q854 PolarHBondContact O-N 3.05Å; R851-E855 HydrophobicContact CG-CG 4.4Å; R851-E855 IonicContact CZ-OE1 2.74Å; R851-E855 IonicContact NE-OE1 3.06Å; R851-E855 PolarHBondContact NE-OE1 3.04Å; R851-E855 IonicContact NE-OE2 2.69Å; R851-E855 IonicContact NH2-OE1 3.46Å; R851-E855 PolarHBondContact NH2-OE1 3.31Å; R851-E855 WeakPolarHBondContact O-CG 3.45Å; R851-E855 PolarHBondContact O-N 2.93Å
852	L	82.2	Confident	82.4	Confident	112 Å²	112	108.8 Å²	108.8	59%	0.586	53%	0.534	S	S	*	.	H	α-helix	trans	-67	-33.8	179.3	-73.1	169.6	0	0	0	112.3	A848 S849 N856	A848-L852 WeakPolarHBondContact O-CG 3.24Å; A848-L852 PolarHBondContact O-N 3.33Å; S849-L852 PolarHBondContact O-N 3.3Å; S849-L852 VanDerWaalsContact O-N 3.1Å; L852-N856 VanDerWaalsContact O-CB 3.25Å; L852-N856 WeakPolarHBondContact O-CB 3.49Å; L852-N856 PolarHBondContact O-N 3.15Å
853	E	83.2	Confident	82.9	Confident	107 Å²	107	110.5 Å²	110.5	50%	0.5	54%	0.542	S	S	.	.	H	α-helix	trans	-61.5	-48.6	171	-73.7	155.5	-141.8	0	0	110.2	S849 R851 N856 D857	S849-E853 WeakPolarHBondContact CB-OE1 3.35Å; S849-E853 WeakPolarHBondContact O-CB 3.3Å; S849-E853 VanDerWaalsContact O-CG 3.28Å; S849-E853 WeakPolarHBondContact O-CG 3.49Å; S849-E853 PolarHBondContact O-N 3.11Å; S849-E853 PolarHBondContact OG-OE1 3.35Å; R851-E853 VanDerWaalsContact C-N 3.32Å; E853-N856 PolarHBondContact O-N 3.08Å; E853-D857 PolarHBondContact O-N 3.31Å
854	Q	84	Confident	83.3	Confident	122 Å²	122	106.8 Å²	106.8	57%	0.57	54%	0.537	S	S	*	.	H	α-helix	trans	-65.4	-43.4	177.2	-174.7	171.1	-5	0	0	113.3	M850 R851 N856 D857 D858	M850-Q854 PolarHBondContact O-N 3.1Å; M850-Q854 VanDerWaalsContact O-N 3.1Å; R851-Q854 PolarHBondContact O-N 3.05Å; Q854-N856 PolarHBondContact O-N 2.95Å; Q854-D857 PolarHBondContact O-N 3.43Å; Q854-D858 PolarHBondContact O-N 3.18Å
855	E	79.8	Confident	83.6	Confident	76 Å²	76	103.8 Å²	103.8	36%	0.355	53%	0.534	S	S	.	.	H	α-helix	trans	-61.4	-32.9	176.2	-74.2	175.4	169.2	0	0	111.9	R851 L859	R851-E855 HydrophobicContact CG-CG 4.4Å; R851-E855 IonicContact CZ-OE1 2.74Å; R851-E855 IonicContact NE-OE1 3.06Å; R851-E855 PolarHBondContact NE-OE1 3.04Å; R851-E855 IonicContact NE-OE2 2.69Å; R851-E855 IonicContact NH2-OE1 3.46Å; R851-E855 PolarHBondContact NH2-OE1 3.31Å; R851-E855 WeakPolarHBondContact O-CG 3.45Å; R851-E855 PolarHBondContact O-N 2.93Å; E855-L859 WeakPolarHBondContact O-CB 3.43Å; E855-L859 WeakPolarHBondContact O-CD1 3.33Å; E855-L859 VanDerWaalsContact O-CG 3.24Å; E855-L859 WeakPolarHBondContact O-CG 3.37Å; E855-L859 PolarHBondContact O-N 3.24Å; E855-L859 VanDerWaalsContact O-N 3.1Å
856	N	81.6	Confident	83.7	Confident	104 Å²	104	102 Å²	102	56%	0.556	53%	0.529	S	S	*	.	H	α-helix	trans	-74.4	-36.7	174.9	179.9	79.4	0	0	0	112.8	L852 E853 Q854 A860	L852-N856 VanDerWaalsContact O-CB 3.25Å; L852-N856 WeakPolarHBondContact O-CB 3.49Å; L852-N856 PolarHBondContact O-N 3.15Å; E853-N856 PolarHBondContact O-N 3.08Å; Q854-N856 PolarHBondContact O-N 2.95Å; N856-A860 WeakPolarHBondContact O-CB 3.4Å; N856-A860 PolarHBondContact O-N 3.08Å
857	D	85.6	Confident	84	Confident	109 Å²	109	103.3 Å²	103.3	58%	0.583	53%	0.533	S	S	*	.	H	α-helix	trans	-67.3	-41.7	173.6	-76	-12.4	0	0	0	111.8	E853 Q854 A860 H861	E853-D857 PolarHBondContact O-N 3.31Å; Q854-D857 PolarHBondContact O-N 3.43Å; D857-A860 PolarHBondContact O-N 3.48Å; D857-H861 PolarHBondContact O-N 3.28Å
858	D	80.5	Confident	84.5	Confident	96 Å²	96	102.2 Å²	102.2	51%	0.513	53%	0.53	S	S	.	.	H	α-helix	trans	-62.1	-45.6	175	-74.8	-31.2	0	0	0	111	Q854 A860 H861 E862	Q854-D858 PolarHBondContact O-N 3.18Å; D858-A860 VanDerWaalsContact C-N 3.34Å; D858-A860 PolarHBondContact O-N 2.95Å; D858-H861 WeakPolarHBondContact O-CB 3.22Å; D858-H861 PolarHBondContact O-N 3.39Å; D858-E862 PolarHBondContact O-N 2.84Å
859	L	81.8	Confident	85	Confident	108 Å²	108	102.2 Å²	102.2	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-61.4	-38.7	173.8	-78.7	168.1	0	0	0	112.8	E855 H861 E862 L863	E855-L859 WeakPolarHBondContact O-CB 3.43Å; E855-L859 WeakPolarHBondContact O-CD1 3.33Å; E855-L859 VanDerWaalsContact O-CG 3.24Å; E855-L859 WeakPolarHBondContact O-CG 3.37Å; E855-L859 PolarHBondContact O-N 3.24Å; E855-L859 VanDerWaalsContact O-N 3.1Å; L859-H861 VanDerWaalsContact C-N 3.34Å; L859-E862 PolarHBondContact O-N 3.42Å; L859-L863 WeakPolarHBondContact O-CB 3.44Å; L859-L863 PolarHBondContact O-N 2.9Å
860	A	87.4	Confident	85.4	Confident	48 Å²	48	105.2 Å²	105.2	40%	0.397	54%	0.541	S	S	.	.	H	α-helix	trans	-65.8	-38.2	175.3	0	0	0	0	0	111.6	N856 D857 D858 L863 V864	N856-A860 WeakPolarHBondContact O-CB 3.4Å; N856-A860 PolarHBondContact O-N 3.08Å; D857-A860 PolarHBondContact O-N 3.48Å; D858-A860 VanDerWaalsContact C-N 3.34Å; D858-A860 PolarHBondContact O-N 2.95Å; A860-L863 PolarHBondContact O-N 2.97Å; A860-V864 WeakPolarHBondContact O-CG2 3.48Å; A860-V864 PolarHBondContact O-N 3.31Å
861	H	87.1	Confident	85.9	Confident	133 Å²	133	104.8 Å²	104.8	62%	0.616	53%	0.532	S	S	*	.	H	α-helix	trans	-67.5	-41.6	176.2	-168.5	68.9	0	0	0	112.4	D857 D858 L859 V864 T865	D857-H861 PolarHBondContact O-N 3.28Å; D858-H861 WeakPolarHBondContact O-CB 3.22Å; D858-H861 PolarHBondContact O-N 3.39Å; L859-H861 VanDerWaalsContact C-N 3.34Å; H861-V864 PolarHBondContact O-N 2.93Å; H861-T865 WeakPolarHBondContact O-CB 3.32Å; H861-T865 PolarHBondContact O-N 2.88Å; H861-T865 PolarHBondContact O-OG1 3.37Å
862	E	82.6	Confident	86.2	Confident	132 Å²	132	101 Å²	101	62%	0.617	52%	0.524	S	S	*	.	H	α-helix	trans	-62.7	-45.4	173.7	-173.4	176	-159.7	0	0	111.4	D858 L859 V864 T865 S866	D858-E862 PolarHBondContact O-N 2.84Å; L859-E862 PolarHBondContact O-N 3.42Å; E862-V864 VanDerWaalsContact C-N 3.35Å; E862-V864 PolarHBondContact O-N 3.15Å; E862-T865 PolarHBondContact O-N 3.34Å; E862-S866 VanDerWaalsContact O-CB 3.32Å; E862-S866 WeakPolarHBondContact O-CB 3.38Å; E862-S866 PolarHBondContact O-N 3Å
863	L	89.1	Confident	86.6	Confident	130 Å²	130	100.2 Å²	100.2	68%	0.681	52%	0.521	S	S	*	.	H	α-helix	trans	-58.9	-43.8	177.6	-170.9	78	0	0	0	112.1	L859 A860 K867	L859-L863 WeakPolarHBondContact O-CB 3.44Å; L859-L863 PolarHBondContact O-N 2.9Å; A860-L863 PolarHBondContact O-N 2.97Å; L863-K867 VanDerWaalsContact O-CB 3.31Å; L863-K867 WeakPolarHBondContact O-CB 3.45Å; L863-K867 PolarHBondContact O-N 2.72Å
864	V	92.2	Very high	87.1	Confident	80 Å²	80	98.9 Å²	98.9	49%	0.485	52%	0.517	S	S	.	.	H	α-helix	trans	-65.7	-44	176.3	168.9	0	0	0	0	111	A860 H861 E862 K867 I868	A860-V864 WeakPolarHBondContact O-CG2 3.48Å; A860-V864 PolarHBondContact O-N 3.31Å; H861-V864 PolarHBondContact O-N 2.93Å; E862-V864 VanDerWaalsContact C-N 3.35Å; E862-V864 PolarHBondContact O-N 3.15Å; V864-K867 PolarHBondContact O-N 3.39Å; V864-I868 HydrophobicContact CG1-CD1 3.88Å; V864-I868 WeakPolarHBondContact O-CG1 3.25Å; V864-I868 PolarHBondContact O-N 2.99Å
865	T	87.3	Confident	87.5	Confident	74 Å²	74	95.8 Å²	95.8	45%	0.454	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-45.1	179.1	-58.7	0	0	0	0	111.5	H861 E862 I868 A869	H861-T865 WeakPolarHBondContact O-CB 3.32Å; H861-T865 PolarHBondContact O-N 2.88Å; H861-T865 PolarHBondContact O-OG1 3.37Å; E862-T865 PolarHBondContact O-N 3.34Å; T865-I868 PolarHBondContact O-N 3.14Å; T865-A869 PolarHBondContact O-N 2.96Å
866	S	84.5	Confident	88.1	Confident	61 Å²	61	96.1 Å²	96.1	43%	0.427	51%	0.506	S	S	.	.	H	α-helix	trans	-62.5	-42.9	175.4	-176.4	0	0	0	0	111.9	E862 I868 A869 L870	E862-S866 VanDerWaalsContact O-CB 3.32Å; E862-S866 WeakPolarHBondContact O-CB 3.38Å; E862-S866 PolarHBondContact O-N 3Å; S866-I868 VanDerWaalsContact C-N 3.33Å; S866-I868 PolarHBondContact O-N 2.76Å; S866-A869 PolarHBondContact O-N 3.46Å; S866-L870 WeakPolarHBondContact O-CB 3.28Å; S866-L870 WeakPolarHBondContact O-CG 3.42Å; S866-L870 PolarHBondContact O-N 3.26Å
867	K	89.6	Confident	88.6	Confident	160 Å²	160	93.6 Å²	93.6	70%	0.696	50%	0.499	S	S	*	.	H	α-helix	trans	-60.4	-38.9	174.3	-177.2	-177	175.2	-171.7	0	112.6	L863 V864 R871	L863-K867 VanDerWaalsContact O-CB 3.31Å; L863-K867 WeakPolarHBondContact O-CB 3.45Å; L863-K867 PolarHBondContact O-N 2.72Å; V864-K867 PolarHBondContact O-N 3.39Å; K867-R871 PolarHBondContact O-N 3.17Å; K867-R871 VanDerWaalsContact O-N 3.12Å
868	I	90.3	Very high	89	Confident	94 Å²	94	93.5 Å²	93.5	48%	0.482	50%	0.495	S	S	.	.	H	α-helix	trans	-67.7	-44.7	176.3	-68.9	163.6	0	0	0	110.7	V864 T865 S866 R871 N872	V864-I868 HydrophobicContact CG1-CD1 3.88Å; V864-I868 WeakPolarHBondContact O-CG1 3.25Å; V864-I868 PolarHBondContact O-N 2.99Å; T865-I868 PolarHBondContact O-N 3.14Å; S866-I868 VanDerWaalsContact C-N 3.33Å; S866-I868 PolarHBondContact O-N 2.76Å; I868-R871 PolarHBondContact O-N 3.15Å; I868-N872 VanDerWaalsContact O-CG 3.32Å; I868-N872 PolarHBondContact O-N 3.38Å; I868-N872 PolarHBondContact O-ND2 3.44Å
869	A	88.9	Confident	89.6	Confident	47 Å²	47	94.7 Å²	94.7	39%	0.388	50%	0.501	S	S	.	.	H	α-helix	trans	-59.1	-49.2	176.4	0	0	0	0	0	111.9	T865 S866 R871 N872 D873	T865-A869 PolarHBondContact O-N 2.96Å; S866-A869 PolarHBondContact O-N 3.46Å; A869-R871 VanDerWaalsContact C-N 3.26Å; A869-R871 PolarHBondContact O-N 2.87Å; A869-N872 PolarHBondContact O-N 3.03Å; A869-N872 VanDerWaalsContact O-N 3.15Å; A869-D873 PolarHBondContact O-N 2.88Å
870	L	89.9	Confident	90.2	Very high	116 Å²	116	95 Å²	95	61%	0.607	50%	0.498	S	S	*	.	H	α-helix	trans	-60.9	-31.5	177.2	-71.3	170.7	0	0	0	113.3	S866 L874	S866-L870 WeakPolarHBondContact O-CB 3.28Å; S866-L870 WeakPolarHBondContact O-CG 3.42Å; S866-L870 PolarHBondContact O-N 3.26Å; L870-L874 WeakPolarHBondContact O-CB 3.3Å; L870-L874 PolarHBondContact O-N 3.31Å; L870-L874 VanDerWaalsContact O-N 3.11Å
871	R	92.5	Very high	90.4	Very high	126 Å²	126	95.3 Å²	95.3	48%	0.475	50%	0.501	S	S	.	.	H	α-helix	trans	-69.1	-47.9	173.2	-172.4	70.2	-139.4	-173.1	8.9	111.2	K867 I868 A869 D873 L874 D875	K867-R871 PolarHBondContact O-N 3.17Å; K867-R871 VanDerWaalsContact O-N 3.12Å; I868-R871 PolarHBondContact O-N 3.15Å; A869-R871 VanDerWaalsContact C-N 3.26Å; A869-R871 PolarHBondContact O-N 2.87Å; R871-D873 VanDerWaalsContact C-N 3.26Å; R871-D873 PolarHBondContact O-N 2.85Å; R871-L874 WeakPolarHBondContact O-CB 3.41Å; R871-L874 PolarHBondContact O-N 2.9Å; R871-L874 VanDerWaalsContact O-N 3.14Å; R871-D875 IonicContact CZ-OD1 2.78Å; R871-D875 IonicContact NE-OD1 2.61Å; R871-D875 PolarHBondContact NE-OD1 2.97Å; R871-D875 IonicContact NE-OD2 2.81Å; R871-D875 IonicContact NH2-OD1 3.63Å; R871-D875 PolarHBondContact NH2-OD1 2.96Å; R871-D875 PolarHBondContact O-N 3.42Å
872	N	90.4	Very high	90.8	Very high	86 Å²	86	94.5 Å²	94.5	46%	0.46	50%	0.501	S	S	.	.	H	α-helix	trans	-60.6	-34	177.9	-64.6	-30.5	0	0	0	112.8	I868 A869 Q876	I868-N872 VanDerWaalsContact O-CG 3.32Å; I868-N872 PolarHBondContact O-N 3.38Å; I868-N872 PolarHBondContact O-ND2 3.44Å; A869-N872 PolarHBondContact O-N 3.03Å; A869-N872 VanDerWaalsContact O-N 3.15Å; N872-Q876 WeakPolarHBondContact O-CB 3.45Å; N872-Q876 VanDerWaalsContact O-CG 3.3Å; N872-Q876 WeakPolarHBondContact O-CG 3.34Å; N872-Q876 PolarHBondContact O-N 2.82Å; N872-Q876 VanDerWaalsContact O-N 3.15Å; N872-Q876 PolarHBondContact O-NE2 3.12Å
873	D	91	Very high	91.3	Very high	96 Å²	96	92.1 Å²	92.1	51%	0.513	50%	0.495	S	S	.	.	H	α-helix	trans	-75.5	-33.6	176.1	-77.1	-21.1	0	0	0	112.8	A869 R871 Q876 A877	A869-D873 PolarHBondContact O-N 2.88Å; R871-D873 VanDerWaalsContact C-N 3.26Å; R871-D873 PolarHBondContact O-N 2.85Å; D873-Q876 PolarHBondContact OD1-NE2 3.12Å; D873-A877 WeakPolarHBondContact O-CB 3.26Å; D873-A877 PolarHBondContact O-N 2.98Å
874	L	92.8	Very high	91.4	Very high	78 Å²	78	91.1 Å²	91.1	41%	0.408	49%	0.49	S	S	.	.	H	α-helix	trans	-66	-49.7	171.8	177.7	62.7	0	0	0	111.3	L870 R871 Q876 A877 E878	L870-L874 WeakPolarHBondContact O-CB 3.3Å; L870-L874 PolarHBondContact O-N 3.31Å; L870-L874 VanDerWaalsContact O-N 3.11Å; R871-L874 WeakPolarHBondContact O-CB 3.41Å; R871-L874 PolarHBondContact O-N 2.9Å; R871-L874 VanDerWaalsContact O-N 3.14Å; L874-Q876 VanDerWaalsContact C-N 3.28Å; L874-Q876 PolarHBondContact O-N 2.88Å; L874-A877 WeakPolarHBondContact O-CA 3.5Å; L874-A877 WeakPolarHBondContact O-CB 3.45Å; L874-A877 PolarHBondContact O-N 3.39Å; L874-E878 PolarHBondContact O-N 2.94Å
875	D	93.3	Very high	91.5	Very high	58 Å²	58	91.7 Å²	91.7	31%	0.31	49%	0.491	S	S	.	.	H	α-helix	trans	-59.6	-42.2	179.7	-60.2	-23.3	0	0	0	110.5	R871 A877 E878 D879	R871-D875 IonicContact CZ-OD1 2.78Å; R871-D875 IonicContact NE-OD1 2.61Å; R871-D875 PolarHBondContact NE-OD1 2.97Å; R871-D875 IonicContact NE-OD2 2.81Å; R871-D875 IonicContact NH2-OD1 3.63Å; R871-D875 PolarHBondContact NH2-OD1 2.96Å; R871-D875 PolarHBondContact O-N 3.42Å; D875-A877 VanDerWaalsContact C-N 3.3Å; D875-A877 PolarHBondContact O-N 3.44Å; D875-E878 PolarHBondContact O-N 3.18Å; D875-D879 PolarHBondContact O-N 2.92Å
876	Q	92.6	Very high	91.8	Very high	83 Å²	83	96.1 Å²	96.1	39%	0.388	50%	0.503	S	S	.	.	H	α-helix	trans	-61.7	-31.2	170.9	-87.9	-175.6	75.8	0	0	114.5	N872 D873 L874 K880	N872-Q876 WeakPolarHBondContact O-CB 3.45Å; N872-Q876 VanDerWaalsContact O-CG 3.3Å; N872-Q876 WeakPolarHBondContact O-CG 3.34Å; N872-Q876 PolarHBondContact O-N 2.82Å; N872-Q876 VanDerWaalsContact O-N 3.15Å; N872-Q876 PolarHBondContact O-NE2 3.12Å; D873-Q876 PolarHBondContact OD1-NE2 3.12Å; L874-Q876 VanDerWaalsContact C-N 3.28Å; L874-Q876 PolarHBondContact O-N 2.88Å; Q876-K880 WeakPolarHBondContact O-CB 3.5Å; Q876-K880 WeakPolarHBondContact O-CD 3.49Å; Q876-K880 VanDerWaalsContact O-CE 3.29Å; Q876-K880 WeakPolarHBondContact O-CE 3.45Å; Q876-K880 WeakPolarHBondContact O-CG 3.48Å; Q876-K880 PolarHBondContact O-N 3.38Å
877	A	90.9	Very high	92.2	Very high	50 Å²	50	98.8 Å²	98.8	41%	0.413	51%	0.509	S	S	.	.	H	α-helix	trans	-76.6	-36.5	178.5	0	0	0	0	0	111.2	D873 L874 D875 K880 A881	D873-A877 WeakPolarHBondContact O-CB 3.26Å; D873-A877 PolarHBondContact O-N 2.98Å; L874-A877 WeakPolarHBondContact O-CA 3.5Å; L874-A877 WeakPolarHBondContact O-CB 3.45Å; L874-A877 PolarHBondContact O-N 3.39Å; D875-A877 VanDerWaalsContact C-N 3.3Å; D875-A877 PolarHBondContact O-N 3.44Å; A877-K880 PolarHBondContact O-N 3.17Å; A877-A881 WeakPolarHBondContact O-CB 3.45Å; A877-A881 PolarHBondContact O-N 3.37Å
878	E	94	Very high	92.4	Very high	107 Å²	107	95 Å²	95	50%	0.5	50%	0.496	S	S	.	.	H	α-helix	trans	-63.8	-48.3	172.5	-68	179.8	-179.6	0	0	110.8	L874 D875 K880 A881 D882	L874-E878 PolarHBondContact O-N 2.94Å; D875-E878 PolarHBondContact O-N 3.18Å; E878-K880 VanDerWaalsContact C-N 3.33Å; E878-K880 PolarHBondContact O-N 3.49Å; E878-A881 WeakPolarHBondContact O-CB 3.5Å; E878-A881 PolarHBondContact O-N 3.36Å; E878-A881 VanDerWaalsContact O-N 3.1Å; E878-D882 PolarHBondContact O-N 3.14Å
879	D	94.3	Very high	92.5	Very high	121 Å²	121	96.2 Å²	96.2	65%	0.647	50%	0.503	S	S	*	.	H	α-helix	trans	-52.6	-46.9	172.6	-97.7	-15.7	0	0	0	112.5	D875 D882 V883	D875-D879 PolarHBondContact O-N 2.92Å; D879-D882 PolarHBondContact O-N 3.45Å; D879-V883 WeakPolarHBondContact O-CG2 3.32Å; D879-V883 PolarHBondContact O-N 3Å; D879-V883 VanDerWaalsContact O-N 3.09Å
880	K	92.9	Very high	92.7	Very high	115 Å²	115	96.7 Å²	96.7	50%	0.5	50%	0.503	S	S	.	.	H	α-helix	trans	-66	-38.3	179.2	-71.4	160.5	-160	159.6	0	111.5	Q876 A877 E878 L884	Q876-K880 WeakPolarHBondContact O-CB 3.5Å; Q876-K880 WeakPolarHBondContact O-CD 3.49Å; Q876-K880 VanDerWaalsContact O-CE 3.29Å; Q876-K880 WeakPolarHBondContact O-CE 3.45Å; Q876-K880 WeakPolarHBondContact O-CG 3.48Å; Q876-K880 PolarHBondContact O-N 3.38Å; A877-K880 PolarHBondContact O-N 3.17Å; E878-K880 VanDerWaalsContact C-N 3.33Å; E878-K880 PolarHBondContact O-N 3.49Å; K880-L884 WeakPolarHBondContact O-CB 3.47Å; K880-L884 VanDerWaalsContact O-CG 3.28Å; K880-L884 WeakPolarHBondContact O-CG 3.41Å; K880-L884 PolarHBondContact O-N 3.37Å; K880-L884 VanDerWaalsContact O-N 3.07Å
881	A	92.6	Very high	92.8	Very high	54 Å²	54	94.8 Å²	94.8	45%	0.446	50%	0.497	S	S	.	.	H	α-helix	trans	-64.9	-42.3	176.9	0	0	0	0	0	111.8	A877 E878 L884 N885	A877-A881 WeakPolarHBondContact O-CB 3.45Å; A877-A881 PolarHBondContact O-N 3.37Å; E878-A881 WeakPolarHBondContact O-CB 3.5Å; E878-A881 PolarHBondContact O-N 3.36Å; E878-A881 VanDerWaalsContact O-N 3.1Å; A881-L884 PolarHBondContact O-N 2.88Å; A881-N885 VanDerWaalsContact O-CB 3.26Å; A881-N885 WeakPolarHBondContact O-CB 3.34Å; A881-N885 PolarHBondContact O-N 3.49Å
882	D	94.6	Very high	92.8	Very high	116 Å²	116	94.2 Å²	94.2	62%	0.62	50%	0.498	S	S	*	.	H	α-helix	trans	-69.3	-38.2	179.4	-107.4	10.7	0	0	0	112.9	E878 D879 N885 K886	E878-D882 PolarHBondContact O-N 3.14Å; D879-D882 PolarHBondContact O-N 3.45Å; D882-N885 PolarHBondContact O-N 3.17Å; D882-K886 WeakPolarHBondContact O-CB 3.39Å; D882-K886 PolarHBondContact O-N 3.1Å
883	V	93.5	Very high	92.9	Very high	82 Å²	82	95.9 Å²	95.9	50%	0.497	50%	0.503	S	S	.	.	H	α-helix	trans	-59.6	-50.6	170.5	171	0	0	0	0	110.8	D879 N885 K886 E887	D879-V883 WeakPolarHBondContact O-CG2 3.32Å; D879-V883 PolarHBondContact O-N 3Å; D879-V883 VanDerWaalsContact O-N 3.09Å; V883-N885 VanDerWaalsContact C-N 3.33Å; V883-N885 PolarHBondContact O-N 3.28Å; V883-K886 WeakPolarHBondContact O-CB 3.49Å; V883-K886 PolarHBondContact O-N 2.96Å; V883-E887 WeakPolarHBondContact O-CG 3.4Å; V883-E887 PolarHBondContact O-N 3.39Å
884	L	91.9	Very high	93	Very high	110 Å²	110	97.8 Å²	97.8	58%	0.576	50%	0.503	S	S	*	.	H	α-helix	trans	-63	-37.6	179.2	-72.7	169.8	0	0	0	112.4	K880 A881 E887 L888	K880-L884 WeakPolarHBondContact O-CB 3.47Å; K880-L884 VanDerWaalsContact O-CG 3.28Å; K880-L884 WeakPolarHBondContact O-CG 3.41Å; K880-L884 PolarHBondContact O-N 3.37Å; K880-L884 VanDerWaalsContact O-N 3.07Å; A881-L884 PolarHBondContact O-N 2.88Å; L884-E887 PolarHBondContact O-N 3.37Å; L884-L888 VanDerWaalsContact O-CB 3.24Å; L884-L888 WeakPolarHBondContact O-CB 3.42Å; L884-L888 PolarHBondContact O-N 2.95Å
885	N	93.5	Very high	92.9	Very high	92 Å²	92	98.6 Å²	98.6	49%	0.492	51%	0.507	S	S	.	.	H	α-helix	trans	-65.7	-39.9	176.9	-169.3	20.7	0	0	0	111.5	A881 D882 V883 L888 L889	A881-N885 VanDerWaalsContact O-CB 3.26Å; A881-N885 WeakPolarHBondContact O-CB 3.34Å; A881-N885 PolarHBondContact O-N 3.49Å; D882-N885 PolarHBondContact O-N 3.17Å; V883-N885 VanDerWaalsContact C-N 3.33Å; V883-N885 PolarHBondContact O-N 3.28Å; N885-L888 PolarHBondContact O-N 3.48Å; N885-L889 WeakPolarHBondContact O-CB 3.36Å; N885-L889 PolarHBondContact O-N 2.89Å
886	K	94.2	Very high	93	Very high	166 Å²	166	99.4 Å²	99.4	72%	0.722	51%	0.514	S	S	*	.	H	α-helix	trans	-66.5	-41.2	174.8	-173.3	178.1	-177.8	177.7	0	112.6	D882 V883 L889 S890	D882-K886 WeakPolarHBondContact O-CB 3.39Å; D882-K886 PolarHBondContact O-N 3.1Å; V883-K886 WeakPolarHBondContact O-CB 3.49Å; V883-K886 PolarHBondContact O-N 2.96Å; K886-L889 PolarHBondContact O-N 2.99Å; K886-S890 PolarHBondContact O-N 2.98Å
887	E	93.4	Very high	93	Very high	117 Å²	117	99.9 Å²	99.9	55%	0.547	52%	0.516	S	S	.	.	H	α-helix	trans	-65.6	-41.3	173.2	-71.7	-171.9	162.4	0	0	112.1	V883 L884 L889 S890 T891	V883-E887 WeakPolarHBondContact O-CG 3.4Å; V883-E887 PolarHBondContact O-N 3.39Å; L884-E887 PolarHBondContact O-N 3.37Å; E887-L889 VanDerWaalsContact C-N 3.32Å; E887-L889 PolarHBondContact O-N 3.08Å; E887-S890 PolarHBondContact O-N 3.37Å; E887-T891 WeakPolarHBondContact O-CB 3.34Å; E887-T891 PolarHBondContact O-N 2.98Å; E887-T891 PolarHBondContact O-OG1 3.36Å
888	L	92.1	Very high	92.8	Very high	82 Å²	82	101.2 Å²	101.2	43%	0.429	52%	0.519	S	S	.	.	H	α-helix	trans	-61	-40.4	174.1	179.5	64	0	0	0	111.5	L884 N885 T891 K892	L884-L888 VanDerWaalsContact O-CB 3.24Å; L884-L888 WeakPolarHBondContact O-CB 3.42Å; L884-L888 PolarHBondContact O-N 2.95Å; N885-L888 PolarHBondContact O-N 3.48Å; L888-T891 PolarHBondContact O-N 3.3Å; L888-K892 HydrophobicContact CD1-CD 4.41Å; L888-K892 HydrophobicContact CD1-CG 4.5Å; L888-K892 HydrophobicContact CG-CD 4.19Å; L888-K892 WeakPolarHBondContact O-CB 3.26Å; L888-K892 VanDerWaalsContact O-CG 3.28Å; L888-K892 WeakPolarHBondContact O-CG 3.43Å; L888-K892 PolarHBondContact O-N 3.3Å
889	L	94.2	Very high	92.7	Very high	118 Å²	118	101.7 Å²	101.7	62%	0.618	52%	0.521	S	S	*	.	H	α-helix	trans	-65.2	-47.5	176.4	-158.9	79.7	0	0	0	111.5	N885 K886 E887 T891 K892 Q893	N885-L889 WeakPolarHBondContact O-CB 3.36Å; N885-L889 PolarHBondContact O-N 2.89Å; K886-L889 PolarHBondContact O-N 2.99Å; E887-L889 VanDerWaalsContact C-N 3.32Å; E887-L889 PolarHBondContact O-N 3.08Å; L889-T891 VanDerWaalsContact C-N 3.3Å; L889-T891 PolarHBondContact O-N 3.43Å; L889-K892 PolarHBondContact O-N 2.85Å; L889-Q893 PolarHBondContact O-N 3.41Å
890	S	92.3	Very high	92.6	Very high	57 Å²	57	101.8 Å²	101.8	40%	0.399	52%	0.518	S	S	.	.	H	α-helix	trans	-60	-40.2	175.2	179.7	0	0	0	0	112.2	K886 E887 Q893 R894	K886-S890 PolarHBondContact O-N 2.98Å; E887-S890 PolarHBondContact O-N 3.37Å; S890-Q893 PolarHBondContact O-N 3.23Å; S890-R894 WeakPolarHBondContact O-CB 3.39Å; S890-R894 PolarHBondContact O-N 3.08Å; S890-R894 PolarHBondContact OG-NH2 2.94Å
891	T	91.3	Very high	92.5	Very high	77 Å²	77	102.1 Å²	102.1	47%	0.472	52%	0.521	S	S	.	.	H	α-helix	trans	-69.9	-40.1	179.8	-56.7	0	0	0	0	111.5	E887 L888 L889 R894 L895	E887-T891 WeakPolarHBondContact O-CB 3.34Å; E887-T891 PolarHBondContact O-N 2.98Å; E887-T891 PolarHBondContact O-OG1 3.36Å; L888-T891 PolarHBondContact O-N 3.3Å; L889-T891 VanDerWaalsContact C-N 3.3Å; L889-T891 PolarHBondContact O-N 3.43Å; T891-R894 PolarHBondContact O-N 2.93Å; T891-L895 WeakPolarHBondContact O-CB 3.41Å; T891-L895 PolarHBondContact O-N 3.33Å
892	K	93.1	Very high	92.4	Very high	114 Å²	114	105.3 Å²	105.3	50%	0.496	53%	0.525	S	S	.	.	H	α-helix	trans	-61.6	-45	172.5	-78.2	168.8	177.5	170.7	0	112.2	L888 L889 L895 V896	L888-K892 HydrophobicContact CD1-CD 4.41Å; L888-K892 HydrophobicContact CD1-CG 4.5Å; L888-K892 HydrophobicContact CG-CD 4.19Å; L888-K892 WeakPolarHBondContact O-CB 3.26Å; L888-K892 VanDerWaalsContact O-CG 3.28Å; L888-K892 WeakPolarHBondContact O-CG 3.43Å; L888-K892 PolarHBondContact O-N 3.3Å; L889-K892 PolarHBondContact O-N 2.85Å; K892-L895 WeakPolarHBondContact O-CB 3.5Å; K892-L895 PolarHBondContact O-N 3.5Å; K892-V896 WeakPolarHBondContact O-CG2 3.49Å; K892-V896 PolarHBondContact O-N 3Å; K892-V896 VanDerWaalsContact O-N 3.11Å
893	Q	93.2	Very high	92.2	Very high	121 Å²	121	105.8 Å²	105.8	57%	0.565	52%	0.518	S	S	*	.	H	α-helix	trans	-61.4	-47.9	177.5	179.6	176.1	-19.2	0	0	111.2	L889 S890 L895 V896 E897	L889-Q893 PolarHBondContact O-N 3.41Å; S890-Q893 PolarHBondContact O-N 3.23Å; Q893-L895 VanDerWaalsContact C-N 3.26Å; Q893-L895 PolarHBondContact O-N 3.03Å; Q893-V896 PolarHBondContact O-N 3.48Å; Q893-V896 VanDerWaalsContact O-N 3.11Å; Q893-E897 HydrophobicContact CG-CG 4.49Å; Q893-E897 WeakPolarHBondContact CG-OE1 3.37Å; Q893-E897 PolarHBondContact NE2-OE1 3.14Å; Q893-E897 WeakPolarHBondContact O-CG 3.46Å; Q893-E897 PolarHBondContact O-N 2.93Å
894	R	91.9	Very high	92.2	Very high	135 Å²	135	109 Å²	109	51%	0.509	52%	0.521	S	S	.	.	H	α-helix	trans	-61.9	-33.3	178.8	-159.8	-174	-46.7	149.8	14.4	112.8	S890 T891 T898	S890-R894 WeakPolarHBondContact O-CB 3.39Å; S890-R894 PolarHBondContact O-N 3.08Å; S890-R894 PolarHBondContact OG-NH2 2.94Å; T891-R894 PolarHBondContact O-N 2.93Å; R894-T898 WeakPolarHBondContact O-CB 3.39Å; R894-T898 PolarHBondContact O-N 3.04Å; R894-T898 PolarHBondContact O-OG1 3.3Å
895	L	90.8	Very high	91.9	Very high	96 Å²	96	108.8 Å²	108.8	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-64.4	-48.1	172.8	178.2	63	0	0	0	111.2	T891 K892 Q893 E897 T898 E899	T891-L895 WeakPolarHBondContact O-CB 3.41Å; T891-L895 PolarHBondContact O-N 3.33Å; K892-L895 WeakPolarHBondContact O-CB 3.5Å; K892-L895 PolarHBondContact O-N 3.5Å; Q893-L895 VanDerWaalsContact C-N 3.26Å; Q893-L895 PolarHBondContact O-N 3.03Å; L895-E897 PolarHBondContact O-N 2.95Å; L895-T898 WeakPolarHBondContact O-CB 3.42Å; L895-T898 PolarHBondContact O-N 2.97Å; L895-E899 HydrophobicContact CD1-CG 4.32Å; L895-E899 WeakPolarHBondContact O-CG 3.46Å; L895-E899 PolarHBondContact O-N 3.34Å
896	V	94.9	Very high	91.6	Very high	75 Å²	75	109.9 Å²	109.9	46%	0.455	52%	0.519	S	S	.	.	H	α-helix	trans	-60.3	-45	177	173.4	0	0	0	0	111.3	K892 Q893 T898 E899 E900	K892-V896 WeakPolarHBondContact O-CG2 3.49Å; K892-V896 PolarHBondContact O-N 3Å; K892-V896 VanDerWaalsContact O-N 3.11Å; Q893-V896 PolarHBondContact O-N 3.48Å; Q893-V896 VanDerWaalsContact O-N 3.11Å; V896-T898 VanDerWaalsContact C-N 3.32Å; V896-T898 PolarHBondContact O-N 2.79Å; V896-E899 PolarHBondContact O-N 3.24Å; V896-E900 PolarHBondContact O-N 3.43Å
897	E	92.8	Very high	91.5	Very high	93 Å²	93	106 Å²	106	44%	0.435	50%	0.504	S	S	.	.	H	α-helix	trans	-57.4	-45	175	-69.8	164.7	176	0	0	111.3	Q893 L895 E899 E900 E901	Q893-E897 HydrophobicContact CG-CG 4.49Å; Q893-E897 WeakPolarHBondContact CG-OE1 3.37Å; Q893-E897 PolarHBondContact NE2-OE1 3.14Å; Q893-E897 WeakPolarHBondContact O-CG 3.46Å; Q893-E897 PolarHBondContact O-N 2.93Å; L895-E897 PolarHBondContact O-N 2.95Å; E897-E899 PolarHBondContact O-N 3.17Å; E897-E900 PolarHBondContact O-N 3.06Å; E897-E901 WeakPolarHBondContact O-CG 3.34Å; E897-E901 PolarHBondContact O-N 3.45Å
898	T	88.4	Confident	91.3	Very high	78 Å²	78	104.7 Å²	104.7	48%	0.479	50%	0.498	S	S	.	.	H	α-helix	trans	-65.8	-36.8	176.8	-53.2	0	0	0	0	112.5	R894 L895 V896 K902	R894-T898 WeakPolarHBondContact O-CB 3.39Å; R894-T898 PolarHBondContact O-N 3.04Å; R894-T898 PolarHBondContact O-OG1 3.3Å; L895-T898 WeakPolarHBondContact O-CB 3.42Å; L895-T898 PolarHBondContact O-N 2.97Å; V896-T898 VanDerWaalsContact C-N 3.32Å; V896-T898 PolarHBondContact O-N 2.79Å; T898-K902 WeakPolarHBondContact O-CB 3.25Å; T898-K902 PolarHBondContact O-N 3.01Å
899	E	91.1	Very high	91	Very high	116 Å²	116	103.9 Å²	103.9	54%	0.542	50%	0.496	S	S	.	.	H	α-helix	trans	-69.8	-37.3	176.5	-74.1	-175	159.3	0	0	111.9	L895 V896 E897 R903	L895-E899 HydrophobicContact CD1-CG 4.32Å; L895-E899 WeakPolarHBondContact O-CG 3.46Å; L895-E899 PolarHBondContact O-N 3.34Å; V896-E899 PolarHBondContact O-N 3.24Å; E897-E899 PolarHBondContact O-N 3.17Å; E899-R903 VanDerWaalsContact O-CB 3.26Å; E899-R903 WeakPolarHBondContact O-CB 3.44Å; E899-R903 PolarHBondContact O-N 3.33Å
900	E	93.1	Very high	90.7	Very high	123 Å²	123	100.9 Å²	100.9	58%	0.575	49%	0.489	S	S	*	.	H	α-helix	trans	-67.5	-40.6	173.2	-73.6	-167.3	-176	0	0	112.9	V896 E897 R903 R904	V896-E900 PolarHBondContact O-N 3.43Å; E897-E900 PolarHBondContact O-N 3.06Å; E900-R903 PolarHBondContact O-N 2.92Å; E900-R904 WeakPolarHBondContact O-CB 3.26Å; E900-R904 PolarHBondContact O-N 2.73Å
901	E	90.8	Very high	90.6	Very high	122 Å²	122	104.3 Å²	104.3	57%	0.57	50%	0.498	S	S	*	.	H	α-helix	trans	-62.1	-47.5	172.6	-75.2	-171.9	158	0	0	111.5	E897 R903 R904 H905	E897-E901 WeakPolarHBondContact O-CG 3.34Å; E897-E901 PolarHBondContact O-N 3.45Å; E901-R903 VanDerWaalsContact C-N 3.35Å; E901-R903 PolarHBondContact O-N 3.42Å; E901-R904 WeakPolarHBondContact O-CB 3.46Å; E901-R904 PolarHBondContact O-N 2.9Å; E901-H905 PolarHBondContact O-CD2 3.2Å; E901-H905 PolarHBondContact O-N 3.37Å
902	K	88.9	Confident	90.4	Very high	122 Å²	122	105.4 Å²	105.4	53%	0.53	50%	0.501	S	S	.	.	H	α-helix	trans	-56.5	-48.3	174.2	177.9	-169.2	163	-166.3	0	111.2	T898 R904 H905 E906	T898-K902 WeakPolarHBondContact O-CB 3.25Å; T898-K902 PolarHBondContact O-N 3.01Å; K902-R904 VanDerWaalsContact C-N 3.3Å; K902-R904 PolarHBondContact O-N 3.41Å; K902-H905 PolarHBondContact O-N 2.98Å; K902-E906 WeakPolarHBondContact CE-OE1 3.32Å; K902-E906 IonicContact NZ-OE1 3.13Å; K902-E906 WeakPolarHBondContact O-CG 3.48Å; K902-E906 PolarHBondContact O-N 3.17Å
903	R	91.9	Very high	90.1	Very high	126 Å²	126	106.8 Å²	106.8	48%	0.475	51%	0.507	S	S	.	.	H	α-helix	trans	-58.7	-41.7	179.1	-166.7	-161.7	72.5	67	26.7	111.4	E899 E900 E901 E906 E907	E899-R903 VanDerWaalsContact O-CB 3.26Å; E899-R903 WeakPolarHBondContact O-CB 3.44Å; E899-R903 PolarHBondContact O-N 3.33Å; E900-R903 PolarHBondContact O-N 2.92Å; E901-R903 VanDerWaalsContact C-N 3.35Å; E901-R903 PolarHBondContact O-N 3.42Å; R903-E906 PolarHBondContact O-N 3.26Å; R903-E907 IonicContact CZ-OE1 3.65Å; R903-E907 IonicContact CZ-OE2 3.15Å; R903-E907 VanDerWaalsContact CZ-OE2 3.29Å; R903-E907 IonicContact NH1-OE1 2.72Å; R903-E907 PolarHBondContact NH1-OE1 3.21Å; R903-E907 IonicContact NH1-OE2 3.75Å; R903-E907 PolarHBondContact NH1-OE2 3.2Å; R903-E907 VanDerWaalsContact NH1-OE2 3.15Å; R903-E907 IonicContact NH2-OE1 3.8Å; R903-E907 IonicContact NH2-OE2 3.29Å; R903-E907 PolarHBondContact NH2-OE2 2.89Å; R903-E907 WeakPolarHBondContact O-CG 3.24Å; R903-E907 PolarHBondContact O-N 2.96Å
904	R	91.9	Very high	89.9	Confident	148 Å²	148	103.8 Å²	103.8	56%	0.558	49%	0.493	S	S	*	.	H	α-helix	trans	-62.1	-47.2	174.1	-175.9	-168.4	-60.1	-115.3	0.2	111.9	E900 E901 K902 E906 E907 E908	E900-R904 WeakPolarHBondContact O-CB 3.26Å; E900-R904 PolarHBondContact O-N 2.73Å; E901-R904 WeakPolarHBondContact O-CB 3.46Å; E901-R904 PolarHBondContact O-N 2.9Å; K902-R904 VanDerWaalsContact C-N 3.3Å; K902-R904 PolarHBondContact O-N 3.41Å; R904-E906 VanDerWaalsContact C-N 3.31Å; R904-E906 PolarHBondContact O-N 3.47Å; R904-E907 WeakPolarHBondContact O-CB 3.4Å; R904-E907 PolarHBondContact O-N 2.9Å; R904-E907 VanDerWaalsContact O-N 3.17Å; R904-E908 WeakPolarHBondContact O-CG 3.2Å; R904-E908 PolarHBondContact O-N 2.97Å
905	H	86.8	Confident	89.8	Confident	107 Å²	107	100.8 Å²	100.8	50%	0.495	49%	0.489	S	S	.	.	H	α-helix	trans	-66.7	-30.7	178.3	-70.3	-36.7	0	0	0	113.2	E901 K902 E908 T909	E901-H905 PolarHBondContact O-CD2 3.2Å; E901-H905 PolarHBondContact O-N 3.37Å; K902-H905 PolarHBondContact O-N 2.98Å; H905-E908 IonicContact CE1-OE2 2.68Å; H905-E908 IonicContact CG-OE2 2.65Å; H905-E908 IonicContact ND1-OE2 3.84Å; H905-E908 PolarHBondContact ND1-OE2 3.36Å; H905-T909 WeakPolarHBondContact O-CB 3.35Å; H905-T909 PolarHBondContact O-N 3.35Å; H905-T909 PolarHBondContact O-OG1 2.99Å
906	E	87.7	Confident	89.5	Confident	114 Å²	114	102.8 Å²	102.8	53%	0.533	49%	0.494	S	S	.	.	H	α-helix	trans	-66.7	-40.8	170.6	-73.9	177.7	171.2	0	0	111.6	K902 R903 R904 T909 A910	K902-E906 WeakPolarHBondContact CE-OE1 3.32Å; K902-E906 IonicContact NZ-OE1 3.13Å; K902-E906 WeakPolarHBondContact O-CG 3.48Å; K902-E906 PolarHBondContact O-N 3.17Å; R903-E906 PolarHBondContact O-N 3.26Å; R904-E906 VanDerWaalsContact C-N 3.31Å; R904-E906 PolarHBondContact O-N 3.47Å; E906-T909 PolarHBondContact O-N 2.93Å; E906-A910 WeakPolarHBondContact O-CB 3.4Å; E906-A910 PolarHBondContact O-N 3.45Å
907	E	90.9	Very high	89.2	Confident	85 Å²	85	104.3 Å²	104.3	40%	0.397	49%	0.492	S	S	.	.	H	α-helix	trans	-64.4	-46	172.9	-72.4	177	143.3	0	0	112.7	R903 R904 T909 A910 Q911	R903-E907 IonicContact CZ-OE1 3.65Å; R903-E907 IonicContact CZ-OE2 3.15Å; R903-E907 VanDerWaalsContact CZ-OE2 3.29Å; R903-E907 IonicContact NH1-OE1 2.72Å; R903-E907 PolarHBondContact NH1-OE1 3.21Å; R903-E907 IonicContact NH1-OE2 3.75Å; R903-E907 PolarHBondContact NH1-OE2 3.2Å; R903-E907 VanDerWaalsContact NH1-OE2 3.15Å; R903-E907 IonicContact NH2-OE1 3.8Å; R903-E907 IonicContact NH2-OE2 3.29Å; R903-E907 PolarHBondContact NH2-OE2 2.89Å; R903-E907 WeakPolarHBondContact O-CG 3.24Å; R903-E907 PolarHBondContact O-N 2.96Å; R904-E907 WeakPolarHBondContact O-CB 3.4Å; R904-E907 PolarHBondContact O-N 2.9Å; R904-E907 VanDerWaalsContact O-N 3.17Å; E907-T909 VanDerWaalsContact C-N 3.33Å; E907-T909 PolarHBondContact O-N 3.11Å; E907-A910 PolarHBondContact O-N 3.47Å; E907-Q911 WeakPolarHBondContact O-CG 3.5Å; E907-Q911 PolarHBondContact O-N 3.5Å
908	E	89	Confident	88.9	Confident	89 Å²	89	105.8 Å²	105.8	42%	0.416	49%	0.494	S	S	.	.	H	α-helix	trans	-60	-43.9	175.3	-71.7	166.3	173.9	0	0	111	R904 H905 A910 Q911 L912	R904-E908 WeakPolarHBondContact O-CG 3.2Å; R904-E908 PolarHBondContact O-N 2.97Å; H905-E908 IonicContact CE1-OE2 2.68Å; H905-E908 IonicContact CG-OE2 2.65Å; H905-E908 IonicContact ND1-OE2 3.84Å; H905-E908 PolarHBondContact ND1-OE2 3.36Å; E908-A910 PolarHBondContact O-N 2.99Å; E908-Q911 PolarHBondContact O-N 3.31Å; E908-L912 WeakPolarHBondContact O-CB 3.42Å; E908-L912 PolarHBondContact O-N 3.27Å
909	T	85.9	Confident	88.9	Confident	65 Å²	65	106.5 Å²	106.5	40%	0.399	49%	0.491	S	S	.	.	H	α-helix	trans	-64.5	-38.2	176.2	-62.9	0	0	0	0	111.9	H905 E906 E907 K913	H905-T909 WeakPolarHBondContact O-CB 3.35Å; H905-T909 PolarHBondContact O-N 3.35Å; H905-T909 PolarHBondContact O-OG1 2.99Å; E906-T909 PolarHBondContact O-N 2.93Å; E907-T909 VanDerWaalsContact C-N 3.33Å; E907-T909 PolarHBondContact O-N 3.11Å; T909-K913 HydrophobicContact CG2-CD 4.2Å; T909-K913 WeakPolarHBondContact O-CB 3.25Å; T909-K913 WeakPolarHBondContact O-CD 3.46Å; T909-K913 VanDerWaalsContact O-CG 3.25Å; T909-K913 WeakPolarHBondContact O-CG 3.43Å; T909-K913 PolarHBondContact O-N 2.9Å
910	A	88.8	Confident	88.5	Confident	56 Å²	56	106.1 Å²	106.1	46%	0.463	49%	0.492	S	S	.	.	H	α-helix	trans	-67.2	-43.8	176	0	0	0	0	0	111.9	E906 E907 E908 K913 E914	E906-A910 WeakPolarHBondContact O-CB 3.4Å; E906-A910 PolarHBondContact O-N 3.45Å; E907-A910 PolarHBondContact O-N 3.47Å; E908-A910 PolarHBondContact O-N 2.99Å; A910-K913 PolarHBondContact O-N 3.48Å; A910-E914 WeakPolarHBondContact O-CB 3.28Å; A910-E914 PolarHBondContact O-N 2.94Å
911	Q	89.5	Confident	88.3	Confident	128 Å²	128	104.2 Å²	104.2	60%	0.598	48%	0.483	S	S	*	.	H	α-helix	trans	-60.7	-44.4	174.5	-71.2	174.7	55.3	0	0	111.7	E907 E908 E914 V915	E907-Q911 WeakPolarHBondContact O-CG 3.5Å; E907-Q911 PolarHBondContact O-N 3.5Å; E908-Q911 PolarHBondContact O-N 3.31Å; Q911-E914 PolarHBondContact O-N 3.41Å; Q911-V915 WeakPolarHBondContact O-CG2 3.4Å; Q911-V915 PolarHBondContact O-N 2.95Å
912	L	87.9	Confident	88.2	Confident	100 Å²	100	103.5 Å²	103.5	52%	0.524	48%	0.479	S	S	.	.	H	α-helix	trans	-64.3	-42.4	178.7	-175.9	59.7	0	0	0	112.2	E908 E914 V915 F916	E908-L912 WeakPolarHBondContact O-CB 3.42Å; E908-L912 PolarHBondContact O-N 3.27Å; L912-E914 VanDerWaalsContact C-N 3.32Å; L912-E914 PolarHBondContact O-N 3.37Å; L912-V915 PolarHBondContact O-N 3.23Å; L912-F916 HydrophobicContact CD1-CD2 4.03Å; L912-F916 HydrophobicContact CD1-CE2 3.64Å; L912-F916 HydrophobicContact CD1-CZ 4.47Å; L912-F916 HydrophobicContact CD2-CE2 4.28Å; L912-F916 HydrophobicContact CG-CD2 3.97Å; L912-F916 HydrophobicContact CG-CE2 3.75Å; L912-F916 VanDerWaalsContact O-CD2 3.26Å; L912-F916 WeakPolarHBondContact O-CD2 3.47Å; L912-F916 PolarHBondContact O-N 2.87Å
913	K	86.4	Confident	87.9	Confident	144 Å²	144	100.2 Å²	100.2	63%	0.626	47%	0.474	S	S	*	.	H	α-helix	trans	-58.6	-42.7	172.7	-75.9	166.6	179.7	169.9	0	112	T909 A910 F916 R917	T909-K913 HydrophobicContact CG2-CD 4.2Å; T909-K913 WeakPolarHBondContact O-CB 3.25Å; T909-K913 WeakPolarHBondContact O-CD 3.46Å; T909-K913 VanDerWaalsContact O-CG 3.25Å; T909-K913 WeakPolarHBondContact O-CG 3.43Å; T909-K913 PolarHBondContact O-N 2.9Å; A910-K913 PolarHBondContact O-N 3.48Å; K913-F916 PolarHBondContact O-N 3.24Å; K913-R917 PolarHBondContact O-N 2.98Å
914	E	88.8	Confident	87.6	Confident	57 Å²	57	98.4 Å²	98.4	27%	0.266	47%	0.471	S	S	.	.	H	α-helix	trans	-68.4	-35.6	178.9	171.5	60.5	-173.8	0	0	112.6	A910 Q911 L912 R917 R918	A910-E914 WeakPolarHBondContact O-CB 3.28Å; A910-E914 PolarHBondContact O-N 2.94Å; Q911-E914 PolarHBondContact O-N 3.41Å; L912-E914 VanDerWaalsContact C-N 3.32Å; L912-E914 PolarHBondContact O-N 3.37Å; E914-R917 IonicContact OE1-CZ 2.82Å; E914-R917 IonicContact OE1-NH2 3.33Å; E914-R917 PolarHBondContact OE1-NH2 3.45Å; E914-R917 IonicContact OE2-CZ 3.21Å; E914-R917 VanDerWaalsContact OE2-CZ 3.25Å; E914-R917 IonicContact OE2-NE 2.76Å; E914-R917 PolarHBondContact OE2-NE 3.15Å; E914-R917 IonicContact OE2-NH2 2.92Å; E914-R917 PolarHBondContact OE2-NH2 3.46Å; E914-R918 VanDerWaalsContact CG-NH2 3.26Å; E914-R918 VanDerWaalsContact O-CG 3.31Å; E914-R918 WeakPolarHBondContact O-CG 3.36Å; E914-R918 PolarHBondContact O-N 3.01Å; E914-R918 VanDerWaalsContact O-N 3.17Å; E914-R918 IonicContact OE1-CZ 3.14Å; E914-R918 IonicContact OE1-NE 3.13Å; E914-R918 PolarHBondContact OE1-NE 3.43Å; E914-R918 IonicContact OE1-NH2 2.67Å; E914-R918 PolarHBondContact OE1-NH2 3.03Å
915	V	90.2	Very high	87.4	Confident	72 Å²	72	96.6 Å²	96.6	44%	0.436	47%	0.47	S	S	.	.	H	α-helix	trans	-63.4	-49.3	170.4	170.8	0	0	0	0	110.7	Q911 L912 R917 R918 E919	Q911-V915 WeakPolarHBondContact O-CG2 3.4Å; Q911-V915 PolarHBondContact O-N 2.95Å; L912-V915 PolarHBondContact O-N 3.23Å; V915-R917 VanDerWaalsContact C-N 3.32Å; V915-R917 PolarHBondContact O-N 3.33Å; V915-R918 PolarHBondContact O-N 3.04Å; V915-E919 PolarHBondContact O-N 2.7Å; V915-E919 VanDerWaalsContact O-N 3.1Å
916	F	83.6	Confident	87.4	Confident	139 Å²	139	96 Å²	96	61%	0.61	47%	0.468	S	S	*	.	H	α-helix	trans	-59.4	-40.2	176.9	-82.2	-61.8	0	0	0	112.7	L912 K913 R918 E919 L920	L912-F916 HydrophobicContact CD1-CD2 4.03Å; L912-F916 HydrophobicContact CD1-CE2 3.64Å; L912-F916 HydrophobicContact CD1-CZ 4.47Å; L912-F916 HydrophobicContact CD2-CE2 4.28Å; L912-F916 HydrophobicContact CG-CD2 3.97Å; L912-F916 HydrophobicContact CG-CE2 3.75Å; L912-F916 VanDerWaalsContact O-CD2 3.26Å; L912-F916 WeakPolarHBondContact O-CD2 3.47Å; L912-F916 PolarHBondContact O-N 2.87Å; K913-F916 PolarHBondContact O-N 3.24Å; F916-R918 PolarHBondContact O-N 3.37Å; F916-E919 PolarHBondContact O-N 3.13Å; F916-L920 WeakPolarHBondContact O-CB 3.45Å; F916-L920 PolarHBondContact O-N 3.45Å
917	R	88.4	Confident	87.3	Confident	107 Å²	107	95.6 Å²	95.6	40%	0.404	47%	0.468	S	S	.	.	H	α-helix	trans	-57.9	-47.5	175.4	-172.4	-174.6	66.4	79.1	6.3	111.5	K913 E914 V915 L920 E921	K913-R917 PolarHBondContact O-N 2.98Å; E914-R917 IonicContact OE1-CZ 2.82Å; E914-R917 IonicContact OE1-NH2 3.33Å; E914-R917 PolarHBondContact OE1-NH2 3.45Å; E914-R917 IonicContact OE2-CZ 3.21Å; E914-R917 VanDerWaalsContact OE2-CZ 3.25Å; E914-R917 IonicContact OE2-NE 2.76Å; E914-R917 PolarHBondContact OE2-NE 3.15Å; E914-R917 IonicContact OE2-NH2 2.92Å; E914-R917 PolarHBondContact OE2-NH2 3.46Å; V915-R917 VanDerWaalsContact C-N 3.32Å; V915-R917 PolarHBondContact O-N 3.33Å; R917-L920 PolarHBondContact O-N 2.96Å; R917-E921 WeakPolarHBondContact CG-OE1 3.47Å; R917-E921 IonicContact CZ-OE1 2.78Å; R917-E921 IonicContact CZ-OE2 3.84Å; R917-E921 IonicContact NH1-OE1 2.76Å; R917-E921 PolarHBondContact NH1-OE1 3.31Å; R917-E921 IonicContact NH1-OE2 2.92Å; R917-E921 PolarHBondContact NH1-OE2 3.29Å; R917-E921 WeakPolarHBondContact O-CB 3.44Å; R917-E921 WeakPolarHBondContact O-CG 3.44Å; R917-E921 PolarHBondContact O-N 2.9Å
918	R	87.9	Confident	87.1	Confident	124 Å²	124	97.4 Å²	97.4	47%	0.468	47%	0.474	S	S	.	.	H	α-helix	trans	-64.2	-42.6	-179.8	-68.4	168.2	-170.2	171	3.9	112.8	E914 V915 F916 L920 E921 K922	E914-R918 VanDerWaalsContact CG-NH2 3.26Å; E914-R918 VanDerWaalsContact O-CG 3.31Å; E914-R918 WeakPolarHBondContact O-CG 3.36Å; E914-R918 PolarHBondContact O-N 3.01Å; E914-R918 VanDerWaalsContact O-N 3.17Å; E914-R918 IonicContact OE1-CZ 3.14Å; E914-R918 IonicContact OE1-NE 3.13Å; E914-R918 PolarHBondContact OE1-NE 3.43Å; E914-R918 IonicContact OE1-NH2 2.67Å; E914-R918 PolarHBondContact OE1-NH2 3.03Å; V915-R918 PolarHBondContact O-N 3.04Å; F916-R918 PolarHBondContact O-N 3.37Å; R918-L920 VanDerWaalsContact C-N 3.34Å; R918-E921 PolarHBondContact O-N 2.97Å; R918-K922 WeakPolarHBondContact O-CG 3.24Å; R918-K922 PolarHBondContact O-N 3.06Å
919	E	87.3	Confident	87	Confident	93 Å²	93	98 Å²	98	44%	0.435	48%	0.475	S	S	.	.	H	α-helix	trans	-68.9	-34	177.6	-59.6	-45.5	127.6	0	0	112	V915 F916 K922 A923	V915-E919 PolarHBondContact O-N 2.7Å; V915-E919 VanDerWaalsContact O-N 3.1Å; F916-E919 PolarHBondContact O-N 3.13Å; E919-K922 PolarHBondContact O-N 2.63Å; E919-K922 IonicContact OE1-NZ 2.66Å; E919-K922 PolarHBondContact OE1-NZ 3.18Å; E919-K922 VanDerWaalsContact OE2-CD 3.3Å; E919-K922 WeakPolarHBondContact OE2-CD 3.44Å; E919-K922 IonicContact OE2-NZ 2.73Å; E919-K922 PolarHBondContact OE2-NZ 3.19Å; E919-A923 WeakPolarHBondContact O-CB 3.34Å; E919-A923 PolarHBondContact O-N 2.94Å
920	L	83.5	Confident	86.8	Confident	107 Å²	107	98.3 Å²	98.3	56%	0.56	48%	0.478	S	S	*	.	H	α-helix	trans	-68.1	-41.3	174.3	-166.4	150.1	0	0	0	111.7	F916 R917 R918 A923 E924	F916-L920 WeakPolarHBondContact O-CB 3.45Å; F916-L920 PolarHBondContact O-N 3.45Å; R917-L920 PolarHBondContact O-N 2.96Å; R918-L920 VanDerWaalsContact C-N 3.34Å; L920-A923 PolarHBondContact O-N 3.1Å; L920-E924 HydrophobicContact CD2-CG 4.42Å; L920-E924 PolarHBondContact O-N 3.1Å
921	E	88.9	Confident	86.6	Confident	83 Å²	83	99.7 Å²	99.7	39%	0.388	48%	0.481	S	S	.	.	H	α-helix	trans	-63.5	-40.1	174.1	-76.9	169.8	-175.2	0	0	112.6	R917 R918 E924 M925	R917-E921 WeakPolarHBondContact CG-OE1 3.47Å; R917-E921 IonicContact CZ-OE1 2.78Å; R917-E921 IonicContact CZ-OE2 3.84Å; R917-E921 IonicContact NH1-OE1 2.76Å; R917-E921 PolarHBondContact NH1-OE1 3.31Å; R917-E921 IonicContact NH1-OE2 2.92Å; R917-E921 PolarHBondContact NH1-OE2 3.29Å; R917-E921 WeakPolarHBondContact O-CB 3.44Å; R917-E921 WeakPolarHBondContact O-CG 3.44Å; R917-E921 PolarHBondContact O-N 2.9Å; R918-E921 PolarHBondContact O-N 2.97Å; E921-E924 PolarHBondContact O-N 2.97Å; E921-M925 WeakPolarHBondContact O-CG 3.46Å; E921-M925 PolarHBondContact O-N 3.3Å
922	K	88.4	Confident	86.4	Confident	108 Å²	108	95.9 Å²	95.9	47%	0.47	47%	0.471	S	S	.	.	H	α-helix	trans	-61.4	-46.5	170.6	-71.3	171.8	-170.2	169.1	0	111.7	R918 E919 E924 M925 E926	R918-K922 WeakPolarHBondContact O-CG 3.24Å; R918-K922 PolarHBondContact O-N 3.06Å; E919-K922 PolarHBondContact O-N 2.63Å; E919-K922 IonicContact OE1-NZ 2.66Å; E919-K922 PolarHBondContact OE1-NZ 3.18Å; E919-K922 VanDerWaalsContact OE2-CD 3.3Å; E919-K922 WeakPolarHBondContact OE2-CD 3.44Å; E919-K922 IonicContact OE2-NZ 2.73Å; E919-K922 PolarHBondContact OE2-NZ 3.19Å; K922-E924 VanDerWaalsContact C-N 3.33Å; K922-E924 PolarHBondContact O-N 2.83Å; K922-M925 WeakPolarHBondContact O-CB 3.24Å; K922-M925 PolarHBondContact O-N 2.96Å; K922-M925 VanDerWaalsContact O-N 3.09Å; K922-E926 PolarHBondContact O-N 3.3Å
923	A	82.6	Confident	86.2	Confident	52 Å²	52	96.3 Å²	96.3	43%	0.43	47%	0.472	S	S	.	.	H	α-helix	trans	-60.6	-43.2	179.1	0	0	0	0	0	111.3	E919 L920 M925 E926 I927	E919-A923 WeakPolarHBondContact O-CB 3.34Å; E919-A923 PolarHBondContact O-N 2.94Å; L920-A923 PolarHBondContact O-N 3.1Å; A923-M925 VanDerWaalsContact C-N 3.35Å; A923-M925 PolarHBondContact O-N 2.88Å; A923-E926 PolarHBondContact O-N 3.27Å; A923-I927 WeakPolarHBondContact O-CB 3.5Å; A923-I927 WeakPolarHBondContact O-CD1 3.34Å; A923-I927 VanDerWaalsContact O-CG1 3.24Å; A923-I927 WeakPolarHBondContact O-CG1 3.4Å; A923-I927 PolarHBondContact O-N 3.36Å
924	E	85.3	Confident	85.9	Confident	88 Å²	88	93.7 Å²	93.7	41%	0.411	47%	0.465	S	S	.	.	H	α-helix	trans	-59.6	-41.2	171.3	-83.7	-161.8	-154.9	0	0	113	L920 E921 K922 I927 K928	L920-E924 HydrophobicContact CD2-CG 4.42Å; L920-E924 PolarHBondContact O-N 3.1Å; E921-E924 PolarHBondContact O-N 2.97Å; K922-E924 VanDerWaalsContact C-N 3.33Å; K922-E924 PolarHBondContact O-N 2.83Å; E924-I927 PolarHBondContact O-N 3.49Å; E924-K928 WeakPolarHBondContact O-CB 3.36Å; E924-K928 WeakPolarHBondContact O-CD 3.29Å; E924-K928 WeakPolarHBondContact O-CG 3.45Å; E924-K928 PolarHBondContact O-N 3.28Å; E924-K928 IonicContact OE2-NZ 2.64Å; E924-K928 PolarHBondContact OE2-NZ 3.1Å
925	M	88	Confident	85.5	Confident	110 Å²	110	93.6 Å²	93.6	54%	0.542	47%	0.473	S	S	.	.	H	α-helix	trans	-63.9	-42	177.1	-77.4	177.1	55.7	0	0	112.4	E921 K922 A923 K928 K929	E921-M925 WeakPolarHBondContact O-CG 3.46Å; E921-M925 PolarHBondContact O-N 3.3Å; K922-M925 WeakPolarHBondContact O-CB 3.24Å; K922-M925 PolarHBondContact O-N 2.96Å; K922-M925 VanDerWaalsContact O-N 3.09Å; A923-M925 VanDerWaalsContact C-N 3.35Å; A923-M925 PolarHBondContact O-N 2.88Å; M925-K928 PolarHBondContact O-N 2.95Å; M925-K929 WeakPolarHBondContact O-CG 3.38Å; M925-K929 PolarHBondContact O-N 3.19Å
926	E	86.3	Confident	85.3	Confident	96 Å²	96	96 Å²	96	45%	0.449	48%	0.48	S	S	.	.	H	α-helix	trans	-69.7	-36	175.5	-62.4	-47.9	133.1	0	0	112.3	K922 A923 K928 K929 T930	K922-E926 PolarHBondContact O-N 3.3Å; A923-E926 PolarHBondContact O-N 3.27Å; E926-K928 VanDerWaalsContact C-N 3.33Å; E926-K928 PolarHBondContact O-N 2.62Å; E926-K929 PolarHBondContact O-N 2.9Å; E926-K929 IonicContact OE1-NZ 3.92Å; E926-K929 PolarHBondContact OE1-NZ 3.49Å; E926-K929 WeakPolarHBondContact OE2-CD 3.21Å; E926-K929 IonicContact OE2-NZ 2.77Å; E926-K929 PolarHBondContact OE2-NZ 3.23Å; E926-T930 WeakPolarHBondContact O-CB 3.45Å; E926-T930 WeakPolarHBondContact O-CG2 3.27Å; E926-T930 PolarHBondContact O-N 2.95Å; E926-T930 PolarHBondContact O-OG1 2.89Å
927	I	84.8	Confident	85.1	Confident	105 Å²	105	97 Å²	97	54%	0.538	48%	0.481	S	S	.	.	H	α-helix	trans	-61.6	-42.3	171.2	-70.4	164.8	0	0	0	110.4	A923 E924 T930 T931	A923-I927 WeakPolarHBondContact O-CB 3.5Å; A923-I927 WeakPolarHBondContact O-CD1 3.34Å; A923-I927 VanDerWaalsContact O-CG1 3.24Å; A923-I927 WeakPolarHBondContact O-CG1 3.4Å; A923-I927 PolarHBondContact O-N 3.36Å; E924-I927 PolarHBondContact O-N 3.49Å; I927-T930 WeakPolarHBondContact CA-OG1 3.47Å; I927-T930 PolarHBondContact O-OG1 3.32Å; I927-T930 VanDerWaalsContact O-OG1 3.09Å; I927-T931 VanDerWaalsContact O-CB 3.26Å; I927-T931 WeakPolarHBondContact O-CB 3.42Å; I927-T931 PolarHBondContact O-N 2.97Å; I927-T931 PolarHBondContact O-OG1 2.9Å
928	K	87.2	Confident	84.6	Confident	122 Å²	122	98.7 Å²	98.7	53%	0.53	49%	0.491	S	S	.	.	H	α-helix	trans	-64.7	-44.2	176.6	-72.6	159.6	-169	163.5	0	111.6	E924 M925 E926 T931 A932	E924-K928 WeakPolarHBondContact O-CB 3.36Å; E924-K928 WeakPolarHBondContact O-CD 3.29Å; E924-K928 WeakPolarHBondContact O-CG 3.45Å; E924-K928 PolarHBondContact O-N 3.28Å; E924-K928 IonicContact OE2-NZ 2.64Å; E924-K928 PolarHBondContact OE2-NZ 3.1Å; M925-K928 PolarHBondContact O-N 2.95Å; E926-K928 VanDerWaalsContact C-N 3.33Å; E926-K928 PolarHBondContact O-N 2.62Å; K928-T931 PolarHBondContact O-N 3.06Å; K928-A932 PolarHBondContact O-N 3.16Å
929	K	87.9	Confident	84.4	Confident	101 Å²	101	98.4 Å²	98.4	44%	0.439	50%	0.495	S	S	.	.	H	α-helix	trans	-60.4	-51.8	174.3	-74.7	166.8	173.9	178.3	0	112.6	M925 E926 T931 A932 I933	M925-K929 WeakPolarHBondContact O-CG 3.38Å; M925-K929 PolarHBondContact O-N 3.19Å; E926-K929 PolarHBondContact O-N 2.9Å; E926-K929 IonicContact OE1-NZ 3.92Å; E926-K929 PolarHBondContact OE1-NZ 3.49Å; E926-K929 WeakPolarHBondContact OE2-CD 3.21Å; E926-K929 IonicContact OE2-NZ 2.77Å; E926-K929 PolarHBondContact OE2-NZ 3.23Å; K929-T931 VanDerWaalsContact C-N 3.3Å; K929-T931 PolarHBondContact O-N 2.93Å; K929-A932 WeakPolarHBondContact O-CB 3.49Å; K929-A932 PolarHBondContact O-N 3.42Å; K929-A932 VanDerWaalsContact O-N 3.15Å; K929-I933 WeakPolarHBondContact O-CG1 3.24Å; K929-I933 PolarHBondContact O-N 3.49Å
930	T	81.8	Confident	84.1	Confident	73 Å²	73	98.4 Å²	98.4	45%	0.448	50%	0.497	S	S	.	.	H	α-helix	trans	-63.2	-37.3	-179.6	50.4	0	0	0	0	111.6	E926 I927 I933 I934	E926-T930 WeakPolarHBondContact O-CB 3.45Å; E926-T930 WeakPolarHBondContact O-CG2 3.27Å; E926-T930 PolarHBondContact O-N 2.95Å; E926-T930 PolarHBondContact O-OG1 2.89Å; I927-T930 WeakPolarHBondContact CA-OG1 3.47Å; I927-T930 PolarHBondContact O-OG1 3.32Å; I927-T930 VanDerWaalsContact O-OG1 3.09Å; T930-I933 PolarHBondContact O-N 3.41Å; T930-I934 WeakPolarHBondContact O-CB 3.47Å; T930-I934 WeakPolarHBondContact O-CD1 3.5Å; T930-I934 WeakPolarHBondContact O-CG1 3.43Å; T930-I934 PolarHBondContact O-N 2.74Å
931	T	83.8	Confident	83.7	Confident	85 Å²	85	95.6 Å²	95.6	52%	0.521	49%	0.486	S	S	.	.	H	α-helix	trans	-62.6	-42	172.8	-58.1	0	0	0	0	112.2	I927 K928 K929 I934 A935	I927-T931 VanDerWaalsContact O-CB 3.26Å; I927-T931 WeakPolarHBondContact O-CB 3.42Å; I927-T931 PolarHBondContact O-N 2.97Å; I927-T931 PolarHBondContact O-OG1 2.9Å; K928-T931 PolarHBondContact O-N 3.06Å; K929-T931 VanDerWaalsContact C-N 3.3Å; K929-T931 PolarHBondContact O-N 2.93Å; T931-I934 PolarHBondContact O-N 3.26Å; T931-A935 PolarHBondContact O-N 3.04Å
932	A	85.5	Confident	83.1	Confident	48 Å²	48	95 Å²	95	40%	0.397	49%	0.491	S	S	.	.	H	α-helix	trans	-64.6	-46.2	175.7	0	0	0	0	0	112.1	K928 K929 I934 A935 E936	K928-A932 PolarHBondContact O-N 3.16Å; K929-A932 WeakPolarHBondContact O-CB 3.49Å; K929-A932 PolarHBondContact O-N 3.42Å; K929-A932 VanDerWaalsContact O-N 3.15Å; A932-I934 VanDerWaalsContact C-N 3.29Å; A932-I934 PolarHBondContact O-N 2.88Å; A932-A935 WeakPolarHBondContact O-CA 3.41Å; A932-A935 WeakPolarHBondContact O-CB 3.34Å; A932-A935 PolarHBondContact O-N 2.87Å; A932-E936 PolarHBondContact O-N 3.32Å
933	I	84.4	Confident	82.6	Confident	108 Å²	108	95.3 Å²	95.3	55%	0.554	49%	0.494	S	S	*	.	H	α-helix	trans	-58.8	-41.1	176	-66.3	163.6	0	0	0	111	K929 T930 A935 E936 Y937	K929-I933 WeakPolarHBondContact O-CG1 3.24Å; K929-I933 PolarHBondContact O-N 3.49Å; T930-I933 PolarHBondContact O-N 3.41Å; I933-A935 VanDerWaalsContact C-N 3.32Å; I933-A935 PolarHBondContact O-N 2.96Å; I933-E936 PolarHBondContact O-N 2.93Å; I933-Y937 VanDerWaalsContact O-CB 3.29Å; I933-Y937 WeakPolarHBondContact O-CB 3.38Å; I933-Y937 PolarHBondContact O-N 2.9Å
934	I	79.6	Confident	82.4	Confident	90 Å²	90	97.7 Å²	97.7	46%	0.462	50%	0.499	S	S	.	.	H	α-helix	trans	-65.4	-34	175.6	-70.7	164.2	0	0	0	111.7	T930 T931 A932 K938	T930-I934 WeakPolarHBondContact O-CB 3.47Å; T930-I934 WeakPolarHBondContact O-CD1 3.5Å; T930-I934 WeakPolarHBondContact O-CG1 3.43Å; T930-I934 PolarHBondContact O-N 2.74Å; T931-I934 PolarHBondContact O-N 3.26Å; A932-I934 VanDerWaalsContact C-N 3.29Å; A932-I934 PolarHBondContact O-N 2.88Å; I934-K938 HydrophobicContact CG2-CD 4.3Å; I934-K938 VanDerWaalsContact O-CG 3.25Å; I934-K938 WeakPolarHBondContact O-CG 3.33Å; I934-K938 PolarHBondContact O-N 3.45Å; I934-K938 VanDerWaalsContact O-N 3.15Å
935	A	80.6	Confident	81.9	Confident	54 Å²	54	96.8 Å²	96.8	45%	0.446	50%	0.502	S	S	.	.	H	α-helix	trans	-70.8	-45.7	175.5	0	0	0	0	0	111.9	T931 A932 I933 K938 Q939	T931-A935 PolarHBondContact O-N 3.04Å; A932-A935 WeakPolarHBondContact O-CA 3.41Å; A932-A935 WeakPolarHBondContact O-CB 3.34Å; A932-A935 PolarHBondContact O-N 2.87Å; I933-A935 VanDerWaalsContact C-N 3.32Å; I933-A935 PolarHBondContact O-N 2.96Å; A935-K938 PolarHBondContact O-N 2.96Å; A935-Q939 PolarHBondContact O-N 3.43Å
936	E	84.6	Confident	81.3	Confident	123 Å²	123	94.4 Å²	94.4	58%	0.575	49%	0.494	S	S	*	.	H	α-helix	trans	-60.8	-44.8	175	-71	-179.9	-179.9	0	0	111.6	A932 I933 K938 Q939 I940	A932-E936 PolarHBondContact O-N 3.32Å; I933-E936 PolarHBondContact O-N 2.93Å; E936-K938 PolarHBondContact O-N 3.35Å; E936-Q939 WeakPolarHBondContact O-CB 3.39Å; E936-Q939 PolarHBondContact O-N 2.94Å; E936-Q939 VanDerWaalsContact O-N 3.13Å; E936-I940 WeakPolarHBondContact O-CG1 3.5Å; E936-I940 PolarHBondContact O-N 3.4Å
937	Y	79.2	Confident	80.9	Confident	161 Å²	161	98.5 Å²	98.5	63%	0.631	51%	0.505	S	S	*	.	H	α-helix	trans	-58.1	-47.4	175.7	-178.7	-98.3	0	0	0	112	I933 Q939 I940 C941	I933-Y937 VanDerWaalsContact O-CB 3.29Å; I933-Y937 WeakPolarHBondContact O-CB 3.38Å; I933-Y937 PolarHBondContact O-N 2.9Å; Y937-Q939 VanDerWaalsContact C-N 3.3Å; Y937-Q939 PolarHBondContact O-N 3.48Å; Y937-I940 PolarHBondContact O-N 3.09Å; Y937-C941 PolarHBondContact O-N 2.84Å; Y937-C941 PolarHBondContact O-SG 2.87Å; Y937-C941 VanDerWaalsContact O-SG 3.32Å
938	K	78.8	Confident	80.5	Confident	141 Å²	141	98.1 Å²	98.1	61%	0.613	50%	0.504	S	S	*	.	H	α-helix	trans	-59.3	-39.3	174.5	-75.6	170.2	-179.2	176.8	0	112.4	I934 A935 E936 S942	I934-K938 HydrophobicContact CG2-CD 4.3Å; I934-K938 VanDerWaalsContact O-CG 3.25Å; I934-K938 WeakPolarHBondContact O-CG 3.33Å; I934-K938 PolarHBondContact O-N 3.45Å; I934-K938 VanDerWaalsContact O-N 3.15Å; A935-K938 PolarHBondContact O-N 2.96Å; E936-K938 PolarHBondContact O-N 3.35Å; K938-S942 WeakPolarHBondContact O-CB 3.49Å; K938-S942 PolarHBondContact O-N 3.37Å
939	Q	83.4	Confident	79.9	Confident	119 Å²	119	98.4 Å²	98.4	56%	0.556	51%	0.507	S	S	*	.	H	α-helix	trans	-67	-41.4	177.1	-178.4	171.2	-30.3	0	0	111.8	A935 E936 Y937 S942 Q943	A935-Q939 PolarHBondContact O-N 3.43Å; E936-Q939 WeakPolarHBondContact O-CB 3.39Å; E936-Q939 PolarHBondContact O-N 2.94Å; E936-Q939 VanDerWaalsContact O-N 3.13Å; Y937-Q939 VanDerWaalsContact C-N 3.3Å; Y937-Q939 PolarHBondContact O-N 3.48Å; Q939-S942 PolarHBondContact O-N 3.48Å; Q939-Q943 WeakPolarHBondContact O-CG 3.4Å; Q939-Q943 PolarHBondContact O-N 3.42Å
940	I	81.8	Confident	79.3	Confident	92 Å²	92	100.7 Å²	100.7	47%	0.472	52%	0.517	S	S	.	.	H	α-helix	trans	-62.6	-46.8	175	-68.4	164.2	0	0	0	110.6	E936 Y937 S942 Q943 L944	E936-I940 WeakPolarHBondContact O-CG1 3.5Å; E936-I940 PolarHBondContact O-N 3.4Å; Y937-I940 PolarHBondContact O-N 3.09Å; I940-S942 VanDerWaalsContact C-N 3.35Å; I940-S942 PolarHBondContact O-N 2.92Å; I940-Q943 PolarHBondContact O-N 3.35Å; I940-L944 HydrophobicContact CG2-CD1 3.88Å; I940-L944 HydrophobicContact CG2-CG 4.38Å; I940-L944 WeakPolarHBondContact O-CG 3.25Å; I940-L944 PolarHBondContact O-N 2.91Å
941	C	74.6	Confident	78.9	Confident	49 Å²	49	103.4 Å²	103.4	33%	0.331	52%	0.524	S	S	.	.	H	α-helix	trans	-57	-46.5	175.2	-66.7	0	0	0	0	112	Y937 Q943 L944 S945	Y937-C941 PolarHBondContact O-N 2.84Å; Y937-C941 PolarHBondContact O-SG 2.87Å; Y937-C941 VanDerWaalsContact O-SG 3.32Å; C941-Q943 PolarHBondContact O-N 3.46Å; C941-L944 PolarHBondContact O-N 2.95Å; C941-S945 PolarHBondContact O-N 3.01Å; C941-S945 PolarHBondContact O-OG 3.09Å
942	S	77	Confident	78.3	Confident	71 Å²	71	104.9 Å²	104.9	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-60.5	-43.9	176.8	-179.9	0	0	0	0	112.6	K938 Q939 I940 L944 S945 T946	K938-S942 WeakPolarHBondContact O-CB 3.49Å; K938-S942 PolarHBondContact O-N 3.37Å; Q939-S942 PolarHBondContact O-N 3.48Å; I940-S942 VanDerWaalsContact C-N 3.35Å; I940-S942 PolarHBondContact O-N 2.92Å; S942-L944 PolarHBondContact O-N 3.15Å; S942-S945 PolarHBondContact O-N 2.93Å; S942-T946 WeakPolarHBondContact O-CB 3.47Å; S942-T946 PolarHBondContact O-N 2.97Å; S942-T946 PolarHBondContact O-OG1 3.45Å
943	Q	77.5	Confident	77.6	Confident	113 Å²	113	105.5 Å²	105.5	53%	0.528	53%	0.53	S	S	.	.	H	α-helix	trans	-64	-40	176.1	-73.6	-179.6	4	0	0	112.4	Q939 I940 C941 T946 R947	Q939-Q943 WeakPolarHBondContact O-CG 3.4Å; Q939-Q943 PolarHBondContact O-N 3.42Å; I940-Q943 PolarHBondContact O-N 3.35Å; C941-Q943 PolarHBondContact O-N 3.46Å; Q943-T946 PolarHBondContact O-N 3.47Å; Q943-R947 WeakPolarHBondContact O-CB 3.29Å; Q943-R947 PolarHBondContact O-N 3.45Å
944	L	77.6	Confident	77.1	Confident	103 Å²	103	102.5 Å²	102.5	54%	0.539	52%	0.522	S	S	.	.	H	α-helix	trans	-64.9	-47	176.6	-72.8	169.7	0	0	0	111.7	I940 C941 S942 T946 R947 L948	I940-L944 HydrophobicContact CG2-CD1 3.88Å; I940-L944 HydrophobicContact CG2-CG 4.38Å; I940-L944 WeakPolarHBondContact O-CG 3.25Å; I940-L944 PolarHBondContact O-N 2.91Å; C941-L944 PolarHBondContact O-N 2.95Å; S942-L944 PolarHBondContact O-N 3.15Å; L944-T946 PolarHBondContact O-N 2.9Å; L944-R947 WeakPolarHBondContact O-CB 3.12Å; L944-R947 PolarHBondContact O-N 2.92Å; L944-R947 VanDerWaalsContact O-N 3.11Å; L944-L948 PolarHBondContact O-N 3.24Å
945	S	75.2	Confident	76.6	Confident	68 Å²	68	101.8 Å²	101.8	48%	0.476	52%	0.522	S	S	.	.	H	α-helix	trans	-57	-47.6	173.8	-61.4	0	0	0	0	111.8	C941 S942 R947 L948 E949	C941-S945 PolarHBondContact O-N 3.01Å; C941-S945 PolarHBondContact O-OG 3.09Å; S942-S945 PolarHBondContact O-N 2.93Å; S945-R947 PolarHBondContact O-N 3.33Å; S945-L948 PolarHBondContact O-N 2.89Å; S945-L948 VanDerWaalsContact O-N 3.17Å; S945-E949 WeakPolarHBondContact O-CG 3.45Å; S945-E949 PolarHBondContact O-N 3.44Å
946	T	76.6	Confident	76.2	Confident	60 Å²	60	105.9 Å²	105.9	37%	0.368	53%	0.529	S	S	.	.	H	α-helix	trans	-61.6	-31.3	177.4	-51.1	0	0	0	0	112.4	S942 Q943 L944 K950	S942-T946 WeakPolarHBondContact O-CB 3.47Å; S942-T946 PolarHBondContact O-N 2.97Å; S942-T946 PolarHBondContact O-OG1 3.45Å; Q943-T946 PolarHBondContact O-N 3.47Å; L944-T946 PolarHBondContact O-N 2.9Å; T946-K950 WeakPolarHBondContact O-CG 2.94Å; T946-K950 PolarHBondContact O-N 2.91Å
947	R	77.6	Confident	75.6	Confident	183 Å²	183	106.3 Å²	106.3	69%	0.691	53%	0.532	S	S	*	.	H	α-helix	trans	-73.6	-42.2	175.9	-129.7	177	-170.7	160.4	2.4	111.8	Q943 L944 S945 K950 Q951	Q943-R947 WeakPolarHBondContact O-CB 3.29Å; Q943-R947 PolarHBondContact O-N 3.45Å; L944-R947 WeakPolarHBondContact O-CB 3.12Å; L944-R947 PolarHBondContact O-N 2.92Å; L944-R947 VanDerWaalsContact O-N 3.11Å; S945-R947 PolarHBondContact O-N 3.33Å; R947-K950 PolarHBondContact O-N 3.37Å; R947-Q951 PolarHBondContact O-N 3.38Å
948	L	74.8	Confident	75.2	Confident	97 Å²	97	104.8 Å²	104.8	51%	0.508	53%	0.53	S	S	.	.	H	α-helix	trans	-63.1	-47.2	178.4	-176.3	63.8	0	0	0	111.1	L944 S945 K950 Q951 Q952	L944-L948 PolarHBondContact O-N 3.24Å; S945-L948 PolarHBondContact O-N 2.89Å; S945-L948 VanDerWaalsContact O-N 3.17Å; L948-K950 VanDerWaalsContact C-N 3.3Å; L948-K950 PolarHBondContact O-N 3.33Å; L948-Q951 PolarHBondContact O-N 3Å; L948-Q952 WeakPolarHBondContact O-CG 3.42Å; L948-Q952 PolarHBondContact O-N 3.18Å
949	E	75.2	Confident	74.6	Confident	128 Å²	128	103.5 Å²	103.5	60%	0.598	53%	0.53	S	S	*	.	H	α-helix	trans	-56.5	-43.1	174.2	-72.6	178.1	170.8	0	0	111.9	S945 Q952 A953	S945-E949 WeakPolarHBondContact O-CG 3.45Å; S945-E949 PolarHBondContact O-N 3.44Å; E949-Q952 PolarHBondContact O-N 3.48Å; E949-A953 WeakPolarHBondContact O-CB 3.14Å; E949-A953 PolarHBondContact O-N 2.75Å
950	K	75.8	Confident	73.8	Confident	149 Å²	149	100.4 Å²	100.4	65%	0.648	52%	0.517	S	S	*	.	H	α-helix	trans	-67.1	-38	177.3	-75.3	179.9	179.5	-175.3	0	113.3	T946 R947 L948 A954	T946-K950 WeakPolarHBondContact O-CG 2.94Å; T946-K950 PolarHBondContact O-N 2.91Å; R947-K950 PolarHBondContact O-N 3.37Å; L948-K950 VanDerWaalsContact C-N 3.3Å; L948-K950 PolarHBondContact O-N 3.33Å; K950-A954 WeakPolarHBondContact O-CB 3.28Å; K950-A954 PolarHBondContact O-N 3.43Å
951	Q	73.1	Confident	73.3	Confident	129 Å²	129	99.9 Å²	99.9	60%	0.603	51%	0.514	S	S	*	.	H	α-helix	trans	-67.8	-40.5	173.3	-79.3	-171.6	-76.4	0	0	111.9	R947 L948 A953 A954 T955	R947-Q951 PolarHBondContact O-N 3.38Å; L948-Q951 PolarHBondContact O-N 3Å; Q951-A953 VanDerWaalsContact C-N 3.34Å; Q951-A954 PolarHBondContact O-N 3.27Å; Q951-T955 WeakPolarHBondContact O-CB 3.46Å; Q951-T955 WeakPolarHBondContact O-CG2 3.5Å; Q951-T955 PolarHBondContact O-N 2.95Å; Q951-T955 PolarHBondContact O-OG1 3.37Å
952	Q	70.9	Confident	72.9	Confident	117 Å²	117	101.6 Å²	101.6	55%	0.547	52%	0.523	S	S	.	.	H	α-helix	trans	-64.8	-37.9	176.1	-72.1	178.2	-5.6	0	0	111.9	L948 E949 T955 K956	L948-Q952 WeakPolarHBondContact O-CG 3.42Å; L948-Q952 PolarHBondContact O-N 3.18Å; E949-Q952 PolarHBondContact O-N 3.48Å; Q952-T955 PolarHBondContact O-OG1 2.78Å; Q952-K956 VanDerWaalsContact O-CB 3.24Å; Q952-K956 WeakPolarHBondContact O-CB 3.42Å; Q952-K956 PolarHBondContact O-N 2.65Å; Q952-K956 VanDerWaalsContact O-N 3.14Å
953	A	70.6	Confident	72.3	Confident	60 Å²	60	103.8 Å²	103.8	50%	0.496	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-49.4	172.4	0	0	0	0	0	112.2	E949 Q951 K956 E957	E949-A953 WeakPolarHBondContact O-CB 3.14Å; E949-A953 PolarHBondContact O-N 2.75Å; Q951-A953 VanDerWaalsContact C-N 3.34Å; A953-K956 PolarHBondContact O-N 2.91Å; A953-E957 PolarHBondContact O-N 3.11Å
954	A	73.9	Confident	71.8	Confident	46 Å²	46	103.6 Å²	103.6	38%	0.38	52%	0.523	S	S	.	.	H	α-helix	trans	-64	-45.9	-178.7	0	0	0	0	0	112.8	K950 Q951 K956 E957 E958	K950-A954 WeakPolarHBondContact O-CB 3.28Å; K950-A954 PolarHBondContact O-N 3.43Å; Q951-A954 PolarHBondContact O-N 3.27Å; A954-K956 VanDerWaalsContact C-N 3.3Å; A954-K956 PolarHBondContact O-N 3.06Å; A954-E957 WeakPolarHBondContact O-CB 3.37Å; A954-E957 PolarHBondContact O-N 2.98Å; A954-E957 VanDerWaalsContact O-N 3.15Å; A954-E958 PolarHBondContact O-N 3.3Å
955	T	70.4	Confident	71.3	Confident	74 Å²	74	105.6 Å²	105.6	45%	0.454	53%	0.527	S	S	.	.	H	α-helix	trans	-65.8	-31.7	177	48.4	0	0	0	0	112.8	Q951 Q952 L959	Q951-T955 WeakPolarHBondContact O-CB 3.46Å; Q951-T955 WeakPolarHBondContact O-CG2 3.5Å; Q951-T955 PolarHBondContact O-N 2.95Å; Q951-T955 PolarHBondContact O-OG1 3.37Å; Q952-T955 PolarHBondContact O-OG1 2.78Å; T955-L959 WeakPolarHBondContact O-CB 3.43Å; T955-L959 WeakPolarHBondContact O-CG 3.43Å; T955-L959 PolarHBondContact O-N 2.93Å
956	K	71.5	Confident	70.7	Confident	140 Å²	140	104.8 Å²	104.8	61%	0.609	52%	0.519	S	S	*	.	H	α-helix	trans	-66.3	-43.3	169.9	-178.1	-179.2	175.8	-175.1	0	111.8	Q952 A953 A954 L959 D960	Q952-K956 VanDerWaalsContact O-CB 3.24Å; Q952-K956 WeakPolarHBondContact O-CB 3.42Å; Q952-K956 PolarHBondContact O-N 2.65Å; Q952-K956 VanDerWaalsContact O-N 3.14Å; A953-K956 PolarHBondContact O-N 2.91Å; A954-K956 VanDerWaalsContact C-N 3.3Å; A954-K956 PolarHBondContact O-N 3.06Å; K956-L959 PolarHBondContact O-N 3.14Å; K956-D960 PolarHBondContact O-N 3.28Å
957	E	73.1	Confident	70	Confident	133 Å²	133	105.7 Å²	105.7	62%	0.621	52%	0.52	S	S	*	.	H	α-helix	trans	-63.7	-42.7	177	-172.8	170.6	-165.1	0	0	111.8	A953 A954 D960 I961	A953-E957 PolarHBondContact O-N 3.11Å; A954-E957 WeakPolarHBondContact O-CB 3.37Å; A954-E957 PolarHBondContact O-N 2.98Å; A954-E957 VanDerWaalsContact O-N 3.15Å; E957-D960 PolarHBondContact O-N 3.26Å; E957-I961 HydrophobicContact CG-CD1 4.27Å; E957-I961 VanDerWaalsContact O-CG1 3.3Å; E957-I961 WeakPolarHBondContact O-CG1 3.49Å; E957-I961 PolarHBondContact O-N 3.39Å
958	E	70.7	Confident	69.3	Low	129 Å²	129	101.3 Å²	101.3	60%	0.603	52%	0.517	S	S	*	.	H	α-helix	trans	-61.1	-43.3	172.4	-72.5	-174.5	158.7	0	0	112.4	A954 D960 I961 V962	A954-E958 PolarHBondContact O-N 3.3Å; E958-D960 PolarHBondContact O-N 2.99Å; E958-I961 PolarHBondContact O-N 3.25Å; E958-V962 WeakPolarHBondContact O-CG2 3.37Å; E958-V962 PolarHBondContact O-N 2.83Å
959	L	64.8	Low	68.5	Low	114 Å²	114	99.1 Å²	99.1	60%	0.597	51%	0.51	S	S	*	.	H	α-helix	trans	-62.7	-38.9	175	-80.8	169.5	0	0	0	112.6	T955 K956 V962 R963	T955-L959 WeakPolarHBondContact O-CB 3.43Å; T955-L959 WeakPolarHBondContact O-CG 3.43Å; T955-L959 PolarHBondContact O-N 2.93Å; K956-L959 PolarHBondContact O-N 3.14Å; L959-V962 PolarHBondContact O-N 3.15Å; L959-R963 WeakPolarHBondContact O-CB 3.43Å; L959-R963 PolarHBondContact O-N 2.79Å
960	D	66.4	Low	67.7	Low	54 Å²	54	102 Å²	102	29%	0.289	52%	0.523	S	S	.	.	H	α-helix	trans	-70.2	-33.3	174.6	-83	-40.9	0	0	0	112.2	K956 E957 E958 R963 N964	K956-D960 PolarHBondContact O-N 3.28Å; E957-D960 PolarHBondContact O-N 3.26Å; E958-D960 PolarHBondContact O-N 2.99Å; D960-R963 IonicContact OD1-CZ 2.65Å; D960-R963 IonicContact OD1-NH1 3.18Å; D960-R963 PolarHBondContact OD1-NH1 3.4Å; D960-N964 WeakPolarHBondContact O-CB 3.31Å; D960-N964 VanDerWaalsContact O-CG 3.27Å; D960-N964 PolarHBondContact O-N 3.49Å; D960-N964 PolarHBondContact O-ND2 3.12Å
961	I	72.8	Confident	66.7	Low	80 Å²	80	103.1 Å²	103.1	41%	0.41	53%	0.53	S	S	.	.	H	α-helix	trans	-65	-43.5	170.9	-69.8	164	0	0	0	111.1	E957 E958 K965	E957-I961 HydrophobicContact CG-CD1 4.27Å; E957-I961 VanDerWaalsContact O-CG1 3.3Å; E957-I961 WeakPolarHBondContact O-CG1 3.49Å; E957-I961 PolarHBondContact O-N 3.39Å; E958-I961 PolarHBondContact O-N 3.25Å; I961-K965 HydrophobicContact CG2-CD 4.29Å; I961-K965 WeakPolarHBondContact O-CG 3.36Å; I961-K965 PolarHBondContact O-N 2.99Å; I961-K965 VanDerWaalsContact O-N 3.08Å
962	V	66.3	Low	65.8	Low	85 Å²	85	99.5 Å²	99.5	52%	0.515	52%	0.519	S	S	.	.	H	α-helix	trans	-65.4	-47.4	176.2	171.7	0	0	0	0	110.8	E958 L959 N964 K965 V966	E958-V962 WeakPolarHBondContact O-CG2 3.37Å; E958-V962 PolarHBondContact O-N 2.83Å; L959-V962 PolarHBondContact O-N 3.15Å; V962-N964 VanDerWaalsContact C-N 3.34Å; V962-N964 PolarHBondContact O-N 3.46Å; V962-K965 PolarHBondContact O-N 3.32Å; V962-V966 HydrophobicContact CG1-CG2 4.41Å; V962-V966 WeakPolarHBondContact O-CG2 3.35Å; V962-V966 PolarHBondContact O-N 2.97Å
963	R	63.8	Low	65.2	Low	118 Å²	118	100.4 Å²	100.4	45%	0.445	52%	0.517	S	S	.	.	H	α-helix	trans	-53.2	-49.2	175	174.3	-179.1	-77.6	139.7	-2.7	111.5	L959 D960 K965 V966 M967	L959-R963 WeakPolarHBondContact O-CB 3.43Å; L959-R963 PolarHBondContact O-N 2.79Å; D960-R963 IonicContact OD1-CZ 2.65Å; D960-R963 IonicContact OD1-NH1 3.18Å; D960-R963 PolarHBondContact OD1-NH1 3.4Å; R963-K965 PolarHBondContact O-N 3.21Å; R963-V966 PolarHBondContact O-N 2.96Å; R963-M967 WeakPolarHBondContact O-CB 3.28Å; R963-M967 VanDerWaalsContact O-CG 3.29Å; R963-M967 WeakPolarHBondContact O-CG 3.4Å; R963-M967 PolarHBondContact O-N 2.94Å
964	N	66	Low	64.5	Low	108 Å²	108	103.8 Å²	103.8	58%	0.578	53%	0.527	S	S	*	.	H	α-helix	trans	-63.7	-40.7	179.1	-76.2	-46.2	0	0	0	112.4	D960 V962 M967 S968	D960-N964 WeakPolarHBondContact O-CB 3.31Å; D960-N964 VanDerWaalsContact O-CG 3.27Å; D960-N964 PolarHBondContact O-N 3.49Å; D960-N964 PolarHBondContact O-ND2 3.12Å; V962-N964 VanDerWaalsContact C-N 3.34Å; V962-N964 PolarHBondContact O-N 3.46Å; N964-M967 PolarHBondContact O-N 3.27Å; N964-S968 PolarHBondContact O-N 3.36Å; N964-S968 VanDerWaalsContact O-N 3.08Å; N964-S968 PolarHBondContact O-OG 2.55Å
965	K	67.6	Low	63.6	Low	145 Å²	145	106.7 Å²	106.7	63%	0.63	54%	0.535	S	S	*	.	H	α-helix	trans	-64.8	-39.4	176	-75.2	174.8	179.4	175.3	0	113.2	I961 V962 R963 S968	I961-K965 HydrophobicContact CG2-CD 4.29Å; I961-K965 WeakPolarHBondContact O-CG 3.36Å; I961-K965 PolarHBondContact O-N 2.99Å; I961-K965 VanDerWaalsContact O-N 3.08Å; V962-K965 PolarHBondContact O-N 3.32Å; R963-K965 PolarHBondContact O-N 3.21Å; K965-S968 WeakPolarHBondContact CA-OG 3.49Å; K965-S968 PolarHBondContact O-OG 2.66Å
966	V	62.9	Low	62.7	Low	51 Å²	51	107.1 Å²	107.1	31%	0.309	53%	0.531	S	S	.	.	H	α-helix	trans	-66.1	-45.4	176	172.3	0	0	0	0	110.8	V962 R963 S968 C969 C972 F976	V962-V966 HydrophobicContact CG1-CG2 4.41Å; V962-V966 WeakPolarHBondContact O-CG2 3.35Å; V962-V966 PolarHBondContact O-N 2.97Å; R963-V966 PolarHBondContact O-N 2.96Å; V966-S968 VanDerWaalsContact C-N 3.27Å; V966-S968 PolarHBondContact O-N 3.06Å; V966-C969 PolarHBondContact O-N 3.49Å; V966-C972 HydrophobicContact CG1-CB 4.47Å; V966-F976 HydrophobicContact CG1-CD2 4.42Å
967	M	61.4	Low	62	Low	79 Å²	79	102.7 Å²	102.7	39%	0.389	52%	0.517	S	S	.	.	H	α-helix	trans	-68.9	-21.5	-179.5	-67.7	-61.4	-68.3	0	0	113.9	R963 N964 R973	R963-M967 WeakPolarHBondContact O-CB 3.28Å; R963-M967 VanDerWaalsContact O-CG 3.29Å; R963-M967 WeakPolarHBondContact O-CG 3.4Å; R963-M967 PolarHBondContact O-N 2.94Å; N964-M967 PolarHBondContact O-N 3.27Å; M967-R973 HydrophobicContact CE-CG 4.05Å; M967-R973 HydrophobicContact SD-CG 4.28Å
968	S	62.4	Low	61.1	Low	91 Å²	91	101.5 Å²	101.5	64%	0.636	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-0.3	175.1	60.1	0	0	0	0	115.2	N964 K965 V966	N964-S968 PolarHBondContact O-N 3.36Å; N964-S968 VanDerWaalsContact O-N 3.08Å; N964-S968 PolarHBondContact O-OG 2.55Å; K965-S968 WeakPolarHBondContact CA-OG 3.49Å; K965-S968 PolarHBondContact O-OG 2.66Å; V966-S968 VanDerWaalsContact C-N 3.27Å; V966-S968 PolarHBondContact O-N 3.06Å
969	C	57.9	Low	60.5	Low	51 Å²	51	101.2 Å²	101.2	35%	0.345	53%	0.528	S	S	.	.			trans	-98.7	116.9	-178.6	-177.6	0	0	0	0	112	V966 H971 C972 R973	V966-C969 PolarHBondContact O-N 3.49Å; C969-H971 PolarHBondContact O-N 3.34Å; C969-C972 HydrophobicContact CB-CB 3.96Å; C969-C972 PolarHBondContact O-N 3.47Å; C969-R973 PolarHBondContact O-N 3.23Å
970	E	58.4	Low	60	Low	188 Å²	188	98.1 Å²	98.1	88%	0.879	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	1.5	-177.4	-60.5	-170.6	137.5	0	0	115.4
971	H	55.7	Low	59.3	Low	174 Å²	174	99.2 Å²	99.2	81%	0.806	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.2	-10.9	170.5	-86.6	29.4	0	0	0	114.2	C969	C969-H971 PolarHBondContact O-N 3.34Å
972	C	53.4	Low	57.9	Low	52 Å²	52	101.1 Å²	101.1	35%	0.351	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-21.8	-179.5	-58.5	0	0	0	0	113.5	V966 C969 D974 L975	V966-C972 HydrophobicContact CG1-CB 4.47Å; C969-C972 HydrophobicContact CB-CB 3.96Å; C969-C972 PolarHBondContact O-N 3.47Å; C972-D974 VanDerWaalsContact C-N 3.35Å; C972-D974 PolarHBondContact O-N 3.49Å; C972-L975 PolarHBondContact O-N 3.22Å
973	R	59.3	Low	56.9	Low	137 Å²	137	105.7 Å²	105.7	52%	0.517	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-57.8	-44.2	-173.8	-165.1	-170.8	76.7	167.4	3.4	113.2	M967 C969 L975 F976	M967-R973 HydrophobicContact CE-CG 4.05Å; M967-R973 HydrophobicContact SD-CG 4.28Å; C969-R973 PolarHBondContact O-N 3.23Å; R973-L975 PolarHBondContact O-N 3.46Å; R973-F976 PolarHBondContact O-N 2.97Å
974	D	56.7	Low	56.2	Low	130 Å²	130	105 Å²	105	70%	0.695	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-86.2	7.9	-169.7	-55.8	-24.5	0	0	0	113.1	C972	C972-D974 VanDerWaalsContact C-N 3.35Å; C972-D974 PolarHBondContact O-N 3.49Å
975	L	54.7	Low	54.7	Low	108 Å²	108	105.7 Å²	105.7	57%	0.565	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-100.8	-15.8	171.2	-69.5	170.2	0	0	0	113.4	C972 R973 L982	C972-L975 PolarHBondContact O-N 3.22Å; R973-L975 PolarHBondContact O-N 3.46Å; L975-L982 WeakPolarHBondContact O-CD2 3.47Å
976	F	50.2	Low	53.2	Low	83 Å²	83	104.2 Å²	104.2	36%	0.364	60%	0.603	S	S	.	*	B	Isolated β-bridge	trans	-123.6	130.1	-175.9	-75.4	-94	0	0	0	111.6	V966 R973 L982	V966-F976 HydrophobicContact CG1-CD2 4.42Å; R973-F976 PolarHBondContact O-N 2.97Å; F976-L982 HydrophobicContact CD1-CD2 4.45Å; F976-L982 HydrophobicContact CD1-CG 4.08Å; F976-L982 HydrophobicContact CD2-CD2 4.45Å; F976-L982 HydrophobicContact CE1-CD1 3.88Å; F976-L982 HydrophobicContact CE1-CD2 4.04Å; F976-L982 HydrophobicContact CE1-CG 3.64Å; F976-L982 HydrophobicContact CE2-CD2 4.02Å; F976-L982 HydrophobicContact CZ-CD1 4.02Å; F976-L982 HydrophobicContact CZ-CD2 3.8Å; F976-L982 HydrophobicContact CZ-CG 3.89Å
977	S	56.9	Low	52.4	Low	46 Å²	46	107.7 Å²	107.7	32%	0.322	63%	0.627	S	S	.	*			trans	-67.7	155.6	171.2	60.9	0	0	0	0	111.6	V979 G980 S981	S977-V979 PolarHBondContact O-N 3.34Å; S977-G980 PolarHBondContact O-N 3.02Å; S977-S981 PolarHBondContact N-O 3.29Å; S977-S981 VanDerWaalsContact N-O 3.12Å; S977-S981 PolarHBondContact OG-N 3.45Å; S977-S981 PolarHBondContact OG-O 3Å
978	P	54	Low	51	Low	109 Å²	109	108 Å²	108	71%	0.708	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-10.7	-179.3	-26.6	35.7	0	0	0	115.9
979	V	57.9	Low	49.6	Very low	122 Å²	122	107.5 Å²	107.5	74%	0.739	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-3.3	179	-160.7	0	0	0	0	111.9	S977	S977-V979 PolarHBondContact O-N 3.34Å
980	G	56.2	Low	48.4	Very low	50 Å²	50	113.7 Å²	113.7	52%	0.515	69%	0.689	S	S	.	*	S	Bend	trans	87.6	41.5	174.5	0	0	0	0	0	114.5	S977	S977-G980 PolarHBondContact O-N 3.02Å
981	S	49.8	Very low	47.2	Very low	76 Å²	76	108.4 Å²	108.4	53%	0.531	68%	0.684	S	S	.	*			trans	-139.7	145.1	173.7	-61.9	0	0	0	0	111.9	S977	S977-S981 PolarHBondContact N-O 3.29Å; S977-S981 VanDerWaalsContact N-O 3.12Å; S977-S981 PolarHBondContact OG-N 3.45Å; S977-S981 PolarHBondContact OG-O 3Å
982	L	45.1	Very low	46.3	Very low	120 Å²	120	109 Å²	109	63%	0.628	69%	0.69	S	S	*	*	B	Isolated β-bridge	trans	-81.3	152.1	-173.2	-78.1	143.1	0	0	0	113.1	L975 F976	L975-L982 WeakPolarHBondContact O-CD2 3.47Å; F976-L982 HydrophobicContact CD1-CD2 4.45Å; F976-L982 HydrophobicContact CD1-CG 4.08Å; F976-L982 HydrophobicContact CD2-CD2 4.45Å; F976-L982 HydrophobicContact CE1-CD1 3.88Å; F976-L982 HydrophobicContact CE1-CD2 4.04Å; F976-L982 HydrophobicContact CE1-CG 3.64Å; F976-L982 HydrophobicContact CE2-CD2 4.02Å; F976-L982 HydrophobicContact CZ-CD1 4.02Å; F976-L982 HydrophobicContact CZ-CD2 3.8Å; F976-L982 HydrophobicContact CZ-CG 3.89Å
983	Q	45.5	Very low	45.5	Very low	181 Å²	181	111.6 Å²	111.6	85%	0.846	71%	0.709	S	S	*	*			trans	-112.4	146.9	162.7	-71	-175	-28.5	0	0	109.4
984	A	48.1	Very low	44.2	Very low	103 Å²	103	109.7 Å²	109.7	85%	0.851	72%	0.716	S	S	*	*			trans	-131.2	151	-166.5	0	0	0	0	0	113.7
985	S	35.1	Very low	43.5	Very low	124 Å²	124	112.1 Å²	112.1	87%	0.867	72%	0.723	S	S	*	*			trans	-155	161.2	163.6	49.8	0	0	0	0	111.6
986	S	36.3	Very low	43.1	Very low	113 Å²	113	111.8 Å²	111.8	79%	0.79	73%	0.728	S	S	*	*			trans	-95.9	-166.8	-157.7	-38.5	0	0	0	0	113.1
987	P	45.8	Very low	42.9	Very low	125 Å²	125	116.2 Å²	116.2	81%	0.812	75%	0.754	S	S	*	*			cis	-143.3	163	-0.4	40.7	-21.4	0	0	0	119.2
988	G	32.4	Very low	42.7	Very low	85 Å²	85	119 Å²	119	88%	0.876	77%	0.766	S	S	*	*			trans	92.7	114.6	136.6	0	0	0	0	0	120.3
989	G	31.3	Very low	42.8	Very low	81 Å²	81	122.5 Å²	122.5	84%	0.835	77%	0.772	S	S	*	*			trans	158.2	137.8	166.8	0	0	0	0	0	113.1
990	D	33	Very low	42.8	Very low	181 Å²	181	124.6 Å²	124.6	97%	0.968	77%	0.774	S	S	*	*			trans	-76.8	146.2	-177.1	-67.9	-63.9	0	0	0	114
991	G	34.4	Very low	42.9	Very low	76 Å²	76	127.7 Å²	127.7	78%	0.784	77%	0.773	S	S	*	*			trans	169.9	93.8	171.9	0	0	0	0	0	117
992	M	36.4	Very low	43.4	Very low	187 Å²	187	128.1 Å²	128.1	92%	0.921	77%	0.77	S	S	*	*			trans	-44	126	171.4	176.3	97.7	77.2	0	0	116.9
993	S	35.5	Very low	44.6	Very low	107 Å²	107	124.2 Å²	124.2	75%	0.748	76%	0.758	S	S	*	*				176.9	133.2	129.9	49.7	0	0	0	0	117.7
994	S	33.6	Very low	45.9	Very low	96 Å²	96	120.9 Å²	120.9	67%	0.671	75%	0.746	S	S	*	*			trans	15.4	129.8	148	58.2	0	0	0	0	125.8
995	E	41	Very low	46.8	Very low	181 Å²	181	121.5 Å²	121.5	85%	0.846	73%	0.729	S	S	*	*				68.6	170.4	128.4	-66.2	-169.7	156.2	0	0	121.6
996	P	46.3	Very low	48.6	Very low	102 Å²	102	121.1 Å²	121.1	66%	0.662	71%	0.714	S	S	*	*				-134.1	139.2	-51.6	36.4	-21.8	0	0	0	113.3
997	L	46.1	Very low	50.5	Low	176 Å²	176	121.6 Å²	121.6	92%	0.921	70%	0.704	S	S	*	*			trans	-147.4	21.9	-176	-83	-177.8	0	0	0	117.9
998	D	51.9	Low	51.9	Low	105 Å²	105	120.8 Å²	120.8	56%	0.561	69%	0.692	S	S	*	*	S	Bend	trans	-116.4	-14.1	-177.4	-119.5	-27.2	0	0	0	116.7	K1001	D998-K1001 IonicContact OD1-NZ 2.73Å; D998-K1001 PolarHBondContact OD1-NZ 2.94Å
999	E	57	Low	53.8	Low	181 Å²	181	124.6 Å²	124.6	85%	0.846	68%	0.68	S	S	*	*	H	α-helix	trans	-72.2	-42.6	-173.3	-64.8	-167.1	138.9	0	0	114.4	K1001 D1002 G1003	E999-K1001 PolarHBondContact O-N 2.87Å; E999-D1002 PolarHBondContact O-N 2.88Å; E999-G1003 PolarHBondContact O-N 3.5Å
1000	E	58.7	Low	56	Low	167 Å²	167	125.1 Å²	125.1	78%	0.78	66%	0.661	S	S	*	*	H	α-helix	trans	-59.7	-34.9	-178.6	-72.6	-167.6	126.5	0	0	112.7	D1002 G1003 L1004	E1000-D1002 PolarHBondContact O-N 3.38Å; E1000-G1003 PolarHBondContact O-N 3.23Å; E1000-L1004 WeakPolarHBondContact O-CB 3.46Å; E1000-L1004 WeakPolarHBondContact O-CG 3.39Å; E1000-L1004 PolarHBondContact O-N 3.05Å
1001	K	56.8	Low	58.2	Low	114 Å²	114	121.6 Å²	121.6	50%	0.496	64%	0.641	S	S	.	*	H	α-helix	trans	-67.2	-37.2	-175.5	-167.6	-177	75.8	-127.7	0	112.3	D998 E999 K1005	D998-K1001 IonicContact OD1-NZ 2.73Å; D998-K1001 PolarHBondContact OD1-NZ 2.94Å; E999-K1001 PolarHBondContact O-N 2.87Å; K1001-K1005 WeakPolarHBondContact O-CG 3.4Å
1002	D	61	Low	60.4	Low	86 Å²	86	123.9 Å²	123.9	46%	0.46	63%	0.631	S	S	.	*	H	α-helix	trans	-87.9	-29.6	178.6	-75	-1.9	0	0	0	111.5	E999 E1000 L1004 K1005 E1006	E999-D1002 PolarHBondContact O-N 2.88Å; E1000-D1002 PolarHBondContact O-N 3.38Å; D1002-L1004 PolarHBondContact O-N 3.47Å; D1002-K1005 PolarHBondContact O-N 3.37Å; D1002-K1005 WeakPolarHBondContact OD1-CE 3.48Å; D1002-K1005 IonicContact OD1-NZ 3.56Å; D1002-K1005 PolarHBondContact OD1-NZ 2.96Å; D1002-E1006 PolarHBondContact O-N 3Å
1003	G	71.1	Confident	62.6	Low	37 Å²	37	119.4 Å²	119.4	38%	0.381	61%	0.61	S	S	.	*	H	α-helix	trans	-57.4	-43.6	167.1	0	0	0	0	0	113.3	E999 E1000 K1005 E1006 Q1007	E999-G1003 PolarHBondContact O-N 3.5Å; E1000-G1003 PolarHBondContact O-N 3.23Å; G1003-K1005 PolarHBondContact O-N 2.64Å; G1003-E1006 PolarHBondContact O-N 3.48Å; G1003-Q1007 WeakPolarHBondContact O-CG 3.48Å; G1003-Q1007 PolarHBondContact O-N 2.78Å
1004	L	71.3	Confident	64.7	Low	111 Å²	111	118.3 Å²	118.3	58%	0.581	59%	0.594	S	S	*	*	H	α-helix	trans	-66.7	-33.1	176	-76.6	169	0	0	0	113.4	E1000 D1002 L1008	E1000-L1004 WeakPolarHBondContact O-CB 3.46Å; E1000-L1004 WeakPolarHBondContact O-CG 3.39Å; E1000-L1004 PolarHBondContact O-N 3.05Å; D1002-L1004 PolarHBondContact O-N 3.47Å; L1004-L1008 PolarHBondContact O-N 3.01Å
1005	K	68.5	Low	66.9	Low	116 Å²	116	118.1 Å²	118.1	50%	0.504	59%	0.585	S	S	.	*	H	α-helix	trans	-67.8	-41.8	173.4	-70.4	172.6	-167.7	161.7	0	111.6	K1001 D1002 G1003 L1008 R1009	K1001-K1005 WeakPolarHBondContact O-CG 3.4Å; D1002-K1005 PolarHBondContact O-N 3.37Å; D1002-K1005 WeakPolarHBondContact OD1-CE 3.48Å; D1002-K1005 IonicContact OD1-NZ 3.56Å; D1002-K1005 PolarHBondContact OD1-NZ 2.96Å; G1003-K1005 PolarHBondContact O-N 2.64Å; K1005-L1008 WeakPolarHBondContact O-CB 3.36Å; K1005-L1008 PolarHBondContact O-N 3.1Å; K1005-R1009 PolarHBondContact O-N 3Å
1006	E	73	Confident	68.6	Low	116 Å²	116	112 Å²	112	54%	0.542	57%	0.565	S	S	.	*	H	α-helix	trans	-69.6	-36.6	-179.5	-161.5	64.4	-175.9	0	0	111	D1002 G1003 R1009 Q1010	D1002-E1006 PolarHBondContact O-N 3Å; G1003-E1006 PolarHBondContact O-N 3.48Å; E1006-R1009 WeakPolarHBondContact O-CB 3.44Å; E1006-R1009 PolarHBondContact O-N 3.32Å; E1006-R1009 IonicContact OE2-NH1 2.86Å; E1006-Q1010 WeakPolarHBondContact O-CB 3.49Å; E1006-Q1010 PolarHBondContact O-N 2.95Å
1007	Q	74.6	Confident	70.1	Confident	124 Å²	124	112.4 Å²	112.4	58%	0.579	56%	0.558	S	S	*	*	H	α-helix	trans	-60.3	-42.4	168.3	-74.9	-176.9	-7.9	0	0	112.8	G1003 R1009 Q1010 L1011	G1003-Q1007 WeakPolarHBondContact O-CG 3.48Å; G1003-Q1007 PolarHBondContact O-N 2.78Å; Q1007-R1009 VanDerWaalsContact C-N 3.35Å; Q1007-R1009 PolarHBondContact O-N 2.93Å; Q1007-Q1010 PolarHBondContact O-N 3.45Å; Q1007-L1011 WeakPolarHBondContact O-CG 3.45Å; Q1007-L1011 PolarHBondContact O-N 3.03Å
1008	L	75.8	Confident	71.7	Confident	107 Å²	107	108.1 Å²	108.1	56%	0.56	54%	0.54	S	S	*	.	H	α-helix	trans	-61.9	-44.1	175.5	-171.3	71.2	0	0	0	111.2	L1004 K1005 Q1010 L1011 E1012	L1004-L1008 PolarHBondContact O-N 3.01Å; K1005-L1008 WeakPolarHBondContact O-CB 3.36Å; K1005-L1008 PolarHBondContact O-N 3.1Å; L1008-Q1010 PolarHBondContact O-N 3.2Å; L1008-L1011 PolarHBondContact O-N 3.17Å; L1008-E1012 WeakPolarHBondContact O-CG 3.31Å; L1008-E1012 PolarHBondContact O-N 3.41Å
1009	R	72	Confident	73	Confident	165 Å²	165	109 Å²	109	62%	0.623	54%	0.539	S	S	*	.	H	α-helix	trans	-61.9	-41.3	176.9	-124.5	179.8	-175.4	175.5	0.4	112.9	K1005 E1006 Q1007 E1012 L1013	K1005-R1009 PolarHBondContact O-N 3Å; E1006-R1009 WeakPolarHBondContact O-CB 3.44Å; E1006-R1009 PolarHBondContact O-N 3.32Å; E1006-R1009 IonicContact OE2-NH1 2.86Å; Q1007-R1009 VanDerWaalsContact C-N 3.35Å; Q1007-R1009 PolarHBondContact O-N 2.93Å; R1009-E1012 PolarHBondContact O-N 2.93Å; R1009-L1013 WeakPolarHBondContact O-CB 3.49Å; R1009-L1013 PolarHBondContact O-N 3.48Å
1010	Q	78.1	Confident	74.3	Confident	93 Å²	93	105.2 Å²	105.2	44%	0.435	52%	0.524	S	S	.	.	H	α-helix	trans	-63.8	-43.5	176	-179.8	59.9	25.1	0	0	110.9	E1006 Q1007 L1008 L1013 E1014	E1006-Q1010 WeakPolarHBondContact O-CB 3.49Å; E1006-Q1010 PolarHBondContact O-N 2.95Å; Q1007-Q1010 PolarHBondContact O-N 3.45Å; L1008-Q1010 PolarHBondContact O-N 3.2Å; Q1010-L1013 WeakPolarHBondContact O-CB 3.35Å; Q1010-L1013 PolarHBondContact O-N 3.24Å; Q1010-E1014 WeakPolarHBondContact CG-OE1 3.18Å; Q1010-E1014 PolarHBondContact NE2-OE1 3.24Å; Q1010-E1014 WeakPolarHBondContact O-CG 3.26Å; Q1010-E1014 PolarHBondContact O-N 3.03Å
1011	L	79.9	Confident	75.4	Confident	107 Å²	107	103.2 Å²	103.2	56%	0.56	51%	0.514	S	S	*	.	H	α-helix	trans	-66.3	-35.7	175.3	-71	168.9	0	0	0	112.8	Q1007 L1008 L1015	Q1007-L1011 WeakPolarHBondContact O-CG 3.45Å; Q1007-L1011 PolarHBondContact O-N 3.03Å; L1008-L1011 PolarHBondContact O-N 3.17Å; L1011-L1015 VanDerWaalsContact O-CB 3.24Å; L1011-L1015 WeakPolarHBondContact O-CB 3.44Å; L1011-L1015 PolarHBondContact O-N 2.91Å
1012	E	78.8	Confident	76.6	Confident	123 Å²	123	102.7 Å²	102.7	58%	0.575	52%	0.516	S	S	*	.	H	α-helix	trans	-64.5	-39.5	171.5	-74.4	-177	152.5	0	0	112	L1008 R1009 A1016	L1008-E1012 WeakPolarHBondContact O-CG 3.31Å; L1008-E1012 PolarHBondContact O-N 3.41Å; R1009-E1012 PolarHBondContact O-N 2.93Å; E1012-A1016 WeakPolarHBondContact O-CB 3.35Å; E1012-A1016 PolarHBondContact O-N 3.48Å
1013	L	82.8	Confident	77.9	Confident	93 Å²	93	102.6 Å²	102.6	49%	0.487	52%	0.519	S	S	.	.	H	α-helix	trans	-67.8	-43.8	176.6	-172.8	66.8	0	0	0	112.1	R1009 Q1010 A1016 Q1017	R1009-L1013 WeakPolarHBondContact O-CB 3.49Å; R1009-L1013 PolarHBondContact O-N 3.48Å; Q1010-L1013 WeakPolarHBondContact O-CB 3.35Å; Q1010-L1013 PolarHBondContact O-N 3.24Å; L1013-A1016 WeakPolarHBondContact O-CB 3.19Å; L1013-A1016 PolarHBondContact O-N 3.47Å; L1013-Q1017 WeakPolarHBondContact O-CG 3.4Å; L1013-Q1017 PolarHBondContact O-N 3.42Å
1014	E	80.5	Confident	78.4	Confident	84 Å²	84	106.1 Å²	106.1	39%	0.393	53%	0.525	S	S	.	.	H	α-helix	trans	-64.6	-38.8	174.7	-74.5	173	-164.3	0	0	111.9	Q1010 A1016 Q1017 T1018	Q1010-E1014 WeakPolarHBondContact CG-OE1 3.18Å; Q1010-E1014 PolarHBondContact NE2-OE1 3.24Å; Q1010-E1014 WeakPolarHBondContact O-CG 3.26Å; Q1010-E1014 PolarHBondContact O-N 3.03Å; E1014-A1016 VanDerWaalsContact C-N 3.32Å; E1014-A1016 PolarHBondContact O-N 2.92Å; E1014-Q1017 PolarHBondContact O-N 2.9Å; E1014-T1018 WeakPolarHBondContact O-CB 3.45Å; E1014-T1018 PolarHBondContact O-N 3.18Å; E1014-T1018 PolarHBondContact O-OG1 2.96Å
1015	L	80	Confident	78.6	Confident	92 Å²	92	103.1 Å²	103.1	48%	0.482	52%	0.516	S	S	.	.	H	α-helix	trans	-65	-36.2	172.3	-177.6	63.4	0	0	0	111.8	L1011 K1019	L1011-L1015 VanDerWaalsContact O-CB 3.24Å; L1011-L1015 WeakPolarHBondContact O-CB 3.44Å; L1011-L1015 PolarHBondContact O-N 2.91Å; L1015-K1019 HydrophobicContact CG-CD 4.39Å; L1015-K1019 WeakPolarHBondContact O-CB 3.46Å; L1015-K1019 VanDerWaalsContact O-CG 3.26Å; L1015-K1019 WeakPolarHBondContact O-CG 3.33Å; L1015-K1019 PolarHBondContact O-N 2.71Å
1016	A	75.9	Confident	79.1	Confident	54 Å²	54	103.9 Å²	103.9	45%	0.446	52%	0.52	S	S	.	.	H	α-helix	trans	-68	-44.4	174.7	0	0	0	0	0	112	E1012 L1013 E1014 K1019 L1020	E1012-A1016 WeakPolarHBondContact O-CB 3.35Å; E1012-A1016 PolarHBondContact O-N 3.48Å; L1013-A1016 WeakPolarHBondContact O-CB 3.19Å; L1013-A1016 PolarHBondContact O-N 3.47Å; E1014-A1016 VanDerWaalsContact C-N 3.32Å; E1014-A1016 PolarHBondContact O-N 2.92Å; A1016-K1019 PolarHBondContact O-N 3.37Å; A1016-L1020 PolarHBondContact O-N 2.88Å
1017	Q	79	Confident	79.5	Confident	110 Å²	110	101.8 Å²	101.8	51%	0.514	52%	0.517	S	S	.	.	H	α-helix	trans	-62.4	-42.8	174.6	-73.5	-177.5	-10.6	0	0	111.9	L1013 E1014 K1019 L1020 Q1021	L1013-Q1017 WeakPolarHBondContact O-CG 3.4Å; L1013-Q1017 PolarHBondContact O-N 3.42Å; E1014-Q1017 PolarHBondContact O-N 2.9Å; Q1017-K1019 VanDerWaalsContact C-N 3.32Å; Q1017-K1019 PolarHBondContact O-N 3.41Å; Q1017-L1020 WeakPolarHBondContact O-CB 3.43Å; Q1017-L1020 PolarHBondContact O-N 3.39Å; Q1017-L1020 VanDerWaalsContact O-N 3.16Å; Q1017-Q1021 WeakPolarHBondContact O-CG 3.35Å; Q1017-Q1021 PolarHBondContact O-N 3.23Å
1018	T	79.3	Confident	80	Confident	86 Å²	86	104.7 Å²	104.7	53%	0.528	52%	0.522	S	S	.	.	H	α-helix	trans	-63.4	-38.1	177.4	-55.1	0	0	0	0	111.6	E1014 L1022	E1014-T1018 WeakPolarHBondContact O-CB 3.45Å; E1014-T1018 PolarHBondContact O-N 3.18Å; E1014-T1018 PolarHBondContact O-OG1 2.96Å; T1018-L1022 WeakPolarHBondContact O-CB 3.41Å; T1018-L1022 PolarHBondContact O-N 2.7Å
1019	K	79	Confident	80.2	Confident	124 Å²	124	104.4 Å²	104.4	54%	0.539	52%	0.52	S	S	.	.	H	α-helix	trans	-66.9	-38.4	173.2	-76.5	168.8	-178.7	170.5	0	112.3	L1015 A1016 Q1017 L1022 V1023	L1015-K1019 HydrophobicContact CG-CD 4.39Å; L1015-K1019 WeakPolarHBondContact O-CB 3.46Å; L1015-K1019 VanDerWaalsContact O-CG 3.26Å; L1015-K1019 WeakPolarHBondContact O-CG 3.33Å; L1015-K1019 PolarHBondContact O-N 2.71Å; A1016-K1019 PolarHBondContact O-N 3.37Å; Q1017-K1019 VanDerWaalsContact C-N 3.32Å; Q1017-K1019 PolarHBondContact O-N 3.41Å; K1019-L1022 PolarHBondContact O-N 3.17Å; K1019-V1023 WeakPolarHBondContact O-CG2 3.5Å; K1019-V1023 PolarHBondContact O-N 3.41Å; K1019-V1023 VanDerWaalsContact O-N 3.12Å
1020	L	84.8	Confident	80.3	Confident	101 Å²	101	103.1 Å²	103.1	53%	0.529	52%	0.521	S	S	.	.	H	α-helix	trans	-63.1	-50.6	175.3	-176.9	62.7	0	0	0	110.8	A1016 Q1017 L1022 V1023 E1024	A1016-L1020 PolarHBondContact O-N 2.88Å; Q1017-L1020 WeakPolarHBondContact O-CB 3.43Å; Q1017-L1020 PolarHBondContact O-N 3.39Å; Q1017-L1020 VanDerWaalsContact O-N 3.16Å; L1020-L1022 VanDerWaalsContact C-N 3.25Å; L1020-L1022 PolarHBondContact O-N 2.95Å; L1020-V1023 WeakPolarHBondContact O-CA 3.39Å; L1020-V1023 WeakPolarHBondContact O-CB 3.33Å; L1020-V1023 PolarHBondContact O-N 3.19Å; L1020-E1024 WeakPolarHBondContact O-CG 3.49Å; L1020-E1024 PolarHBondContact O-N 3.43Å
1021	Q	81.4	Confident	80.6	Confident	124 Å²	124	104.4 Å²	104.4	58%	0.579	53%	0.527	S	S	*	.	H	α-helix	trans	-57.5	-36.4	175.7	-71.2	178.7	-3.4	0	0	112.7	Q1017 E1024 A1025	Q1017-Q1021 WeakPolarHBondContact O-CG 3.35Å; Q1017-Q1021 PolarHBondContact O-N 3.23Å; Q1021-E1024 PolarHBondContact O-N 3.45Å; Q1021-A1025 VanDerWaalsContact O-CB 3.24Å; Q1021-A1025 WeakPolarHBondContact O-CB 3.47Å; Q1021-A1025 PolarHBondContact O-N 2.88Å
1022	L	82.4	Confident	80.6	Confident	103 Å²	103	104.3 Å²	104.3	54%	0.539	53%	0.527	S	S	.	.	H	α-helix	trans	-67.4	-33.6	175	-177.9	62.5	0	0	0	112.9	T1018 K1019 L1020 K1026	T1018-L1022 WeakPolarHBondContact O-CB 3.41Å; T1018-L1022 PolarHBondContact O-N 2.7Å; K1019-L1022 PolarHBondContact O-N 3.17Å; L1020-L1022 VanDerWaalsContact C-N 3.25Å; L1020-L1022 PolarHBondContact O-N 2.95Å; L1022-K1026 WeakPolarHBondContact O-CB 3.3Å; L1022-K1026 WeakPolarHBondContact O-CG 3.33Å; L1022-K1026 PolarHBondContact O-N 3.03Å; L1022-K1026 VanDerWaalsContact O-N 3.14Å
1023	V	86.7	Confident	80.6	Confident	85 Å²	85	103.5 Å²	103.5	52%	0.515	52%	0.523	S	S	.	.	H	α-helix	trans	-73.1	-45.1	174.2	172.4	0	0	0	0	110.5	K1019 L1020 A1025 K1026 C1027	K1019-V1023 WeakPolarHBondContact O-CG2 3.5Å; K1019-V1023 PolarHBondContact O-N 3.41Å; K1019-V1023 VanDerWaalsContact O-N 3.12Å; L1020-V1023 WeakPolarHBondContact O-CA 3.39Å; L1020-V1023 WeakPolarHBondContact O-CB 3.33Å; L1020-V1023 PolarHBondContact O-N 3.19Å; V1023-A1025 PolarHBondContact O-N 3.01Å; V1023-K1026 PolarHBondContact O-N 3.21Å; V1023-K1026 VanDerWaalsContact O-N 3.17Å; V1023-C1027 PolarHBondContact O-N 2.78Å; V1023-C1027 PolarHBondContact O-SG 3.4Å; V1023-C1027 VanDerWaalsContact O-SG 3.37Å
1024	E	81.8	Confident	80.6	Confident	111 Å²	111	105.4 Å²	105.4	52%	0.519	53%	0.529	S	S	.	.	H	α-helix	trans	-57.6	-46.3	174.7	-69.2	173.7	168.1	0	0	111.6	L1020 Q1021 K1026 C1027 R1028	L1020-E1024 WeakPolarHBondContact O-CG 3.49Å; L1020-E1024 PolarHBondContact O-N 3.43Å; Q1021-E1024 PolarHBondContact O-N 3.45Å; E1024-K1026 VanDerWaalsContact C-N 3.35Å; E1024-K1026 PolarHBondContact O-N 3.37Å; E1024-C1027 PolarHBondContact O-N 3.23Å; E1024-R1028 WeakPolarHBondContact O-CB 3.37Å; E1024-R1028 PolarHBondContact O-N 2.78Å
1025	A	76.4	Confident	80.5	Confident	47 Å²	47	105.9 Å²	105.9	39%	0.388	53%	0.531	S	S	.	.	H	α-helix	trans	-61.6	-40.1	175.8	0	0	0	0	0	112.3	Q1021 V1023 R1028 I1029	Q1021-A1025 VanDerWaalsContact O-CB 3.24Å; Q1021-A1025 WeakPolarHBondContact O-CB 3.47Å; Q1021-A1025 PolarHBondContact O-N 2.88Å; V1023-A1025 PolarHBondContact O-N 3.01Å; A1025-R1028 PolarHBondContact O-N 3.48Å; A1025-I1029 VanDerWaalsContact O-CG1 3.32Å; A1025-I1029 WeakPolarHBondContact O-CG1 3.4Å; A1025-I1029 PolarHBondContact O-N 2.76Å
1026	K	79.3	Confident	80.3	Confident	133 Å²	133	109.3 Å²	109.3	58%	0.578	54%	0.538	S	S	*	.	H	α-helix	trans	-64.6	-46.7	175.5	-81.8	-179	175.2	-171.8	0	112.4	L1022 V1023 E1024 R1028 I1029 Q1030	L1022-K1026 WeakPolarHBondContact O-CB 3.3Å; L1022-K1026 WeakPolarHBondContact O-CG 3.33Å; L1022-K1026 PolarHBondContact O-N 3.03Å; L1022-K1026 VanDerWaalsContact O-N 3.14Å; V1023-K1026 PolarHBondContact O-N 3.21Å; V1023-K1026 VanDerWaalsContact O-N 3.17Å; E1024-K1026 VanDerWaalsContact C-N 3.35Å; E1024-K1026 PolarHBondContact O-N 3.37Å; K1026-R1028 VanDerWaalsContact C-N 3.27Å; K1026-R1028 PolarHBondContact O-N 3.46Å; K1026-I1029 PolarHBondContact O-N 2.73Å; K1026-Q1030 PolarHBondContact O-N 2.92Å
1027	C	81.3	Confident	80.4	Confident	71 Å²	71	108.3 Å²	108.3	48%	0.48	53%	0.533	S	S	.	.	H	α-helix	trans	-58.4	-42.3	175	-65.7	0	0	0	0	111.1	V1023 E1024 I1029 Q1030 E1031	V1023-C1027 PolarHBondContact O-N 2.78Å; V1023-C1027 PolarHBondContact O-SG 3.4Å; V1023-C1027 VanDerWaalsContact O-SG 3.37Å; E1024-C1027 PolarHBondContact O-N 3.23Å; C1027-I1029 PolarHBondContact O-N 3.41Å; C1027-Q1030 WeakPolarHBondContact O-CB 3.43Å; C1027-Q1030 PolarHBondContact O-N 2.96Å; C1027-E1031 PolarHBondContact O-N 2.92Å
1028	R	84.3	Confident	80.5	Confident	186 Å²	186	106.1 Å²	106.1	70%	0.702	53%	0.527	S	S	*	.	H	α-helix	trans	-66.7	-35.5	179.6	-153.8	175	-160.5	117.1	3.9	113.3	E1024 A1025 K1026 L1032	E1024-R1028 WeakPolarHBondContact O-CB 3.37Å; E1024-R1028 PolarHBondContact O-N 2.78Å; A1025-R1028 PolarHBondContact O-N 3.48Å; K1026-R1028 VanDerWaalsContact C-N 3.27Å; K1026-R1028 PolarHBondContact O-N 3.46Å; R1028-L1032 WeakPolarHBondContact O-CB 3.26Å; R1028-L1032 VanDerWaalsContact O-CG 3.27Å; R1028-L1032 WeakPolarHBondContact O-CG 3.45Å; R1028-L1032 PolarHBondContact O-N 2.9Å; R1028-L1032 VanDerWaalsContact O-N 3.1Å
1029	I	80.1	Confident	80.5	Confident	100 Å²	100	106.7 Å²	106.7	51%	0.513	53%	0.527	S	S	.	.	H	α-helix	trans	-64	-46.8	170.4	-70.6	163.7	0	0	0	110.1	A1025 K1026 C1027 E1031 L1032 E1033	A1025-I1029 VanDerWaalsContact O-CG1 3.32Å; A1025-I1029 WeakPolarHBondContact O-CG1 3.4Å; A1025-I1029 PolarHBondContact O-N 2.76Å; K1026-I1029 PolarHBondContact O-N 2.73Å; C1027-I1029 PolarHBondContact O-N 3.41Å; I1029-E1031 VanDerWaalsContact C-N 3.3Å; I1029-E1031 PolarHBondContact O-N 2.97Å; I1029-L1032 PolarHBondContact O-N 3.41Å; I1029-E1033 HydrophobicContact CG2-CG 4.47Å; I1029-E1033 WeakPolarHBondContact O-CG 3.34Å; I1029-E1033 PolarHBondContact O-N 2.91Å
1030	Q	75.6	Confident	80.4	Confident	139 Å²	139	106.6 Å²	106.6	65%	0.65	53%	0.529	S	S	*	.	H	α-helix	trans	-63	-36.5	-178.2	-142.9	171.6	1.8	0	0	112.3	K1026 C1027 H1034	K1026-Q1030 PolarHBondContact O-N 2.92Å; C1027-Q1030 WeakPolarHBondContact O-CB 3.43Å; C1027-Q1030 PolarHBondContact O-N 2.96Å; Q1030-H1034 PolarHBondContact O-N 3.05Å; Q1030-H1034 VanDerWaalsContact O-N 3.08Å
1031	E	84.1	Confident	79.9	Confident	119 Å²	119	106.4 Å²	106.4	56%	0.556	53%	0.533	S	S	*	.	H	α-helix	trans	-70.5	-39.7	173.9	-173.1	165.9	-164.7	0	0	112.6	C1027 I1029 E1033 H1034 Q1035	C1027-E1031 PolarHBondContact O-N 2.92Å; I1029-E1031 VanDerWaalsContact C-N 3.3Å; I1029-E1031 PolarHBondContact O-N 2.97Å; E1031-E1033 VanDerWaalsContact C-N 3.34Å; E1031-E1033 PolarHBondContact O-N 3.18Å; E1031-H1034 WeakPolarHBondContact O-CB 3.49Å; E1031-H1034 PolarHBondContact O-N 3.47Å; E1031-Q1035 WeakPolarHBondContact O-CG 3.44Å; E1031-Q1035 PolarHBondContact O-N 3.33Å
1032	L	80.3	Confident	79.7	Confident	105 Å²	105	106 Å²	106	55%	0.55	53%	0.53	S	S	.	.	H	α-helix	trans	-64.9	-36.2	173.1	-73.1	168.4	0	0	0	112.3	R1028 I1029 Q1035 R1036	R1028-L1032 WeakPolarHBondContact O-CB 3.26Å; R1028-L1032 VanDerWaalsContact O-CG 3.27Å; R1028-L1032 WeakPolarHBondContact O-CG 3.45Å; R1028-L1032 PolarHBondContact O-N 2.9Å; R1028-L1032 VanDerWaalsContact O-N 3.1Å; I1029-L1032 PolarHBondContact O-N 3.41Å; L1032-Q1035 PolarHBondContact O-N 3.31Å; L1032-R1036 WeakPolarHBondContact O-CB 3.5Å; L1032-R1036 PolarHBondContact O-N 2.98Å
1033	E	77.4	Confident	79.3	Confident	107 Å²	107	106.1 Å²	106.1	50%	0.5	53%	0.531	S	S	.	.	H	α-helix	trans	-65.1	-38.5	172.6	-72.8	-171	129.5	0	0	112.1	I1029 E1031 G1037	I1029-E1033 HydrophobicContact CG2-CG 4.47Å; I1029-E1033 WeakPolarHBondContact O-CG 3.34Å; I1029-E1033 PolarHBondContact O-N 2.91Å; E1031-E1033 VanDerWaalsContact C-N 3.34Å; E1031-E1033 PolarHBondContact O-N 3.18Å; E1033-G1037 PolarHBondContact O-N 2.86Å; E1033-G1037 VanDerWaalsContact O-N 3.08Å
1034	H	82.2	Confident	78.5	Confident	133 Å²	133	107 Å²	107	62%	0.616	53%	0.529	S	S	*	.	H	α-helix	trans	-65.5	-47.9	173.9	-173.9	66.3	0	0	0	111.9	Q1030 E1031 R1036 G1037 V1038	Q1030-H1034 PolarHBondContact O-N 3.05Å; Q1030-H1034 VanDerWaalsContact O-N 3.08Å; E1031-H1034 WeakPolarHBondContact O-CB 3.49Å; E1031-H1034 PolarHBondContact O-N 3.47Å; H1034-R1036 VanDerWaalsContact C-N 3.31Å; H1034-R1036 PolarHBondContact O-N 2.98Å; H1034-G1037 WeakPolarHBondContact O-CA 3.28Å; H1034-G1037 PolarHBondContact O-N 3.11Å; H1034-V1038 PolarHBondContact O-N 3.11Å
1035	Q	79.5	Confident	78	Confident	93 Å²	93	104.5 Å²	104.5	44%	0.435	53%	0.527	S	S	.	.	H	α-helix	trans	-58.6	-40.7	176	-71.3	175.2	8.9	0	0	112.1	E1031 L1032 G1037 V1038 L1039	E1031-Q1035 WeakPolarHBondContact O-CG 3.44Å; E1031-Q1035 PolarHBondContact O-N 3.33Å; L1032-Q1035 PolarHBondContact O-N 3.31Å; Q1035-G1037 VanDerWaalsContact C-N 3.31Å; Q1035-G1037 PolarHBondContact O-N 3.33Å; Q1035-V1038 PolarHBondContact O-N 2.91Å; Q1035-L1039 PolarHBondContact O-N 3.42Å
1036	R	76.6	Confident	77.7	Confident	164 Å²	164	105.2 Å²	105.2	62%	0.619	53%	0.533	S	S	*	.	H	α-helix	trans	-60.8	-38.9	172.4	-171.1	-169.2	68	-179.6	-4.9	112	L1032 H1034 M1040	L1032-R1036 WeakPolarHBondContact O-CB 3.5Å; L1032-R1036 PolarHBondContact O-N 2.98Å; H1034-R1036 VanDerWaalsContact C-N 3.31Å; H1034-R1036 PolarHBondContact O-N 2.98Å; R1036-M1040 WeakPolarHBondContact O-CB 3.39Å; R1036-M1040 VanDerWaalsContact O-CG 3.3Å; R1036-M1040 WeakPolarHBondContact O-CG 3.46Å; R1036-M1040 PolarHBondContact O-N 2.87Å
1037	G	77.6	Confident	77	Confident	34 Å²	34	104.5 Å²	104.5	35%	0.351	53%	0.53	S	S	.	.	H	α-helix	trans	-63.6	-42.9	175.3	0	0	0	0	0	113.1	E1033 H1034 Q1035 T1041	E1033-G1037 PolarHBondContact O-N 2.86Å; E1033-G1037 VanDerWaalsContact O-N 3.08Å; H1034-G1037 WeakPolarHBondContact O-CA 3.28Å; H1034-G1037 PolarHBondContact O-N 3.11Å; Q1035-G1037 VanDerWaalsContact C-N 3.31Å; Q1035-G1037 PolarHBondContact O-N 3.33Å; G1037-T1041 PolarHBondContact O-N 2.91Å; G1037-T1041 VanDerWaalsContact O-N 3.16Å; G1037-T1041 PolarHBondContact O-OG1 3.46Å
1038	V	81.1	Confident	76.4	Confident	63 Å²	63	105.8 Å²	105.8	38%	0.382	53%	0.532	S	S	.	.	H	α-helix	trans	-62.3	-53.2	175	176.9	0	0	0	0	110.5	H1034 Q1035 M1040 T1041 E1042	H1034-V1038 PolarHBondContact O-N 3.11Å; Q1035-V1038 PolarHBondContact O-N 2.91Å; V1038-M1040 VanDerWaalsContact C-N 3.33Å; V1038-M1040 PolarHBondContact O-N 3.39Å; V1038-T1041 WeakPolarHBondContact O-CA 3.26Å; V1038-T1041 VanDerWaalsContact O-CB 3.3Å; V1038-T1041 WeakPolarHBondContact O-CB 3.46Å; V1038-T1041 PolarHBondContact O-N 2.98Å; V1038-E1042 HydrophobicContact CG1-CG 4.41Å; V1038-E1042 PolarHBondContact O-N 3.07Å
1039	L	77.8	Confident	75.6	Confident	99 Å²	99	99.1 Å²	99.1	52%	0.518	52%	0.515	S	S	.	.	H	α-helix	trans	-57.6	-40.7	179.5	-77.7	163.4	0	0	0	113.1	Q1035 T1041 E1042 I1043	Q1035-L1039 PolarHBondContact O-N 3.42Å; L1039-T1041 VanDerWaalsContact C-N 3.27Å; L1039-T1041 PolarHBondContact O-N 3.43Å; L1039-E1042 PolarHBondContact O-N 3.09Å; L1039-I1043 WeakPolarHBondContact O-CB 3.3Å; L1039-I1043 VanDerWaalsContact O-CG1 3.26Å; L1039-I1043 WeakPolarHBondContact O-CG1 3.49Å; L1039-I1043 PolarHBondContact O-N 3.1Å
1040	M	77.1	Confident	74.8	Confident	121 Å²	121	102.2 Å²	102.2	60%	0.596	52%	0.52	S	S	*	.	H	α-helix	trans	-63	-34.3	174	-77.7	-65.5	-61.3	0	0	112.6	R1036 V1038 Q1044	R1036-M1040 WeakPolarHBondContact O-CB 3.39Å; R1036-M1040 VanDerWaalsContact O-CG 3.3Å; R1036-M1040 WeakPolarHBondContact O-CG 3.46Å; R1036-M1040 PolarHBondContact O-N 2.87Å; V1038-M1040 VanDerWaalsContact C-N 3.33Å; V1038-M1040 PolarHBondContact O-N 3.39Å; M1040-Q1044 WeakPolarHBondContact O-CB 3.24Å; M1040-Q1044 PolarHBondContact O-N 3.43Å
1041	T	75.7	Confident	73.8	Confident	98 Å²	98	100.9 Å²	100.9	60%	0.601	51%	0.512	S	S	*	.	H	α-helix	trans	-72	-41.3	177.1	-52.5	0	0	0	0	111.1	G1037 V1038 L1039 Q1044 A1045	G1037-T1041 PolarHBondContact O-N 2.91Å; G1037-T1041 VanDerWaalsContact O-N 3.16Å; G1037-T1041 PolarHBondContact O-OG1 3.46Å; V1038-T1041 WeakPolarHBondContact O-CA 3.26Å; V1038-T1041 VanDerWaalsContact O-CB 3.3Å; V1038-T1041 WeakPolarHBondContact O-CB 3.46Å; V1038-T1041 PolarHBondContact O-N 2.98Å; L1039-T1041 VanDerWaalsContact C-N 3.27Å; L1039-T1041 PolarHBondContact O-N 3.43Å; T1041-Q1044 PolarHBondContact O-N 2.86Å; T1041-A1045 WeakPolarHBondContact O-CB 3.48Å; T1041-A1045 PolarHBondContact O-N 3.38Å
1042	E	77	Confident	72.4	Confident	114 Å²	114	98.7 Å²	98.7	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-63.6	-44.1	175.1	-68.5	178.8	154.4	0	0	112.2	V1038 L1039 Q1044 A1045 A1046	V1038-E1042 HydrophobicContact CG1-CG 4.41Å; V1038-E1042 PolarHBondContact O-N 3.07Å; L1039-E1042 PolarHBondContact O-N 3.09Å; E1042-Q1044 VanDerWaalsContact C-N 3.31Å; E1042-Q1044 PolarHBondContact O-N 3.42Å; E1042-A1045 PolarHBondContact O-N 3.01Å; E1042-A1046 WeakPolarHBondContact O-CB 3.32Å; E1042-A1046 PolarHBondContact O-N 2.98Å
1043	I	73.7	Confident	71.3	Confident	107 Å²	107	100.8 Å²	100.8	55%	0.549	51%	0.514	S	S	.	.	H	α-helix	trans	-59.4	-42.8	175.3	-71.4	165.5	0	0	0	111	L1039 A1046 K1047	L1039-I1043 WeakPolarHBondContact O-CB 3.3Å; L1039-I1043 VanDerWaalsContact O-CG1 3.26Å; L1039-I1043 WeakPolarHBondContact O-CG1 3.49Å; L1039-I1043 PolarHBondContact O-N 3.1Å; I1043-A1046 PolarHBondContact O-N 3.15Å; I1043-K1047 WeakPolarHBondContact O-CB 3.47Å; I1043-K1047 PolarHBondContact O-N 2.91Å
1044	Q	70.1	Confident	70.3	Confident	103 Å²	103	98.7 Å²	98.7	48%	0.481	51%	0.509	S	S	.	.	H	α-helix	trans	-68.4	-38.4	178	-171.4	66.8	2.2	0	0	112.1	M1040 T1041 E1042 K1047 N1048	M1040-Q1044 WeakPolarHBondContact O-CB 3.24Å; M1040-Q1044 PolarHBondContact O-N 3.43Å; T1041-Q1044 PolarHBondContact O-N 2.86Å; E1042-Q1044 VanDerWaalsContact C-N 3.31Å; E1042-Q1044 PolarHBondContact O-N 3.42Å; Q1044-K1047 PolarHBondContact O-N 3.32Å; Q1044-N1048 VanDerWaalsContact O-CG 3.29Å; Q1044-N1048 PolarHBondContact O-N 3.25Å; Q1044-N1048 VanDerWaalsContact O-N 3.07Å
1045	A	71.4	Confident	68.8	Low	58 Å²	58	98 Å²	98	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-65.2	-43.3	174.5	0	0	0	0	0	112.2	T1041 E1042 K1047 N1048 S1049	T1041-A1045 WeakPolarHBondContact O-CB 3.48Å; T1041-A1045 PolarHBondContact O-N 3.38Å; E1042-A1045 PolarHBondContact O-N 3.01Å; A1045-K1047 PolarHBondContact O-N 3.34Å; A1045-N1048 PolarHBondContact O-N 2.96Å; A1045-S1049 PolarHBondContact O-N 3.35Å
1046	A	69.4	Low	67.1	Low	62 Å²	62	95.4 Å²	95.4	51%	0.512	51%	0.508	S	S	.	.	H	α-helix	trans	-61.2	-43.9	175.7	0	0	0	0	0	111.7	E1042 I1043 N1048 S1049 W1050	E1042-A1046 WeakPolarHBondContact O-CB 3.32Å; E1042-A1046 PolarHBondContact O-N 2.98Å; I1043-A1046 PolarHBondContact O-N 3.15Å; A1046-N1048 PolarHBondContact O-N 3.24Å; A1046-S1049 PolarHBondContact O-N 3.16Å; A1046-W1050 PolarHBondContact O-N 3.02Å
1047	K	65.3	Low	65.8	Low	119 Å²	119	91 Å²	91	52%	0.517	50%	0.502	S	S	.	.	H	α-helix	trans	-59.6	-45	175.8	-170.4	175.4	-177.5	179.1	0	112	I1043 Q1044 A1045 W1050 F1051	I1043-K1047 WeakPolarHBondContact O-CB 3.47Å; I1043-K1047 PolarHBondContact O-N 2.91Å; Q1044-K1047 PolarHBondContact O-N 3.32Å; A1045-K1047 PolarHBondContact O-N 3.34Å; K1047-W1050 PolarHBondContact O-N 3.28Å; K1047-F1051 HydrophobicContact CG-CD2 4.42Å; K1047-F1051 WeakPolarHBondContact O-CD2 3.34Å; K1047-F1051 PolarHBondContact O-N 3.05Å; K1047-F1051 VanDerWaalsContact O-N 3.15Å
1048	N	69	Low	64.3	Low	97 Å²	97	95.1 Å²	95.1	52%	0.519	52%	0.516	S	S	.	.	H	α-helix	trans	-64.6	-41.7	176.3	-69.8	-8.5	0	0	0	112	Q1044 A1045 A1046 W1050 F1051 S1052	Q1044-N1048 VanDerWaalsContact O-CG 3.29Å; Q1044-N1048 PolarHBondContact O-N 3.25Å; Q1044-N1048 VanDerWaalsContact O-N 3.07Å; A1045-N1048 PolarHBondContact O-N 2.96Å; A1046-N1048 PolarHBondContact O-N 3.24Å; N1048-W1050 PolarHBondContact O-N 2.67Å; N1048-F1051 PolarHBondContact O-N 2.81Å; N1048-S1052 PolarHBondContact O-N 3.46Å
1049	S	66.3	Low	62.6	Low	47 Å²	47	100.4 Å²	100.4	33%	0.329	53%	0.533	S	S	.	.	H	α-helix	trans	-63.4	-40.4	176.6	-169.1	0	0	0	0	112.2	A1045 A1046 S1052 K1053	A1045-S1049 PolarHBondContact O-N 3.35Å; A1046-S1049 PolarHBondContact O-N 3.16Å; S1049-S1052 PolarHBondContact O-N 3.36Å; S1049-S1052 PolarHBondContact O-OG 2.8Å; S1049-K1053 WeakPolarHBondContact O-CG 3.49Å; S1049-K1053 PolarHBondContact O-N 2.73Å
1050	W	63.3	Low	61	Low	164 Å²	164	98.8 Å²	98.8	62%	0.621	53%	0.53	S	S	*	.	H	α-helix	trans	-61	-50.2	175.6	-176.4	71.2	0	0	0	111.9	A1046 K1047 N1048 S1052 K1053 T1054	A1046-W1050 PolarHBondContact O-N 3.02Å; K1047-W1050 PolarHBondContact O-N 3.28Å; N1048-W1050 PolarHBondContact O-N 2.67Å; W1050-S1052 VanDerWaalsContact C-N 3.32Å; W1050-S1052 PolarHBondContact O-N 3.49Å; W1050-K1053 PolarHBondContact O-N 3.15Å; W1050-T1054 PolarHBondContact O-N 2.77Å; W1050-T1054 PolarHBondContact O-OG1 2.78Å; W1050-T1054 VanDerWaalsContact O-OG1 3.14Å
1051	F	54.9	Low	59.1	Low	112 Å²	112	97 Å²	97	49%	0.491	53%	0.53	S	S	.	.	H	α-helix	trans	-56.6	-42.8	175.3	-93.9	-84.2	0	0	0	112.8	K1047 N1048 K1053 L1055	K1047-F1051 HydrophobicContact CG-CD2 4.42Å; K1047-F1051 WeakPolarHBondContact O-CD2 3.34Å; K1047-F1051 PolarHBondContact O-N 3.05Å; K1047-F1051 VanDerWaalsContact O-N 3.15Å; N1048-F1051 PolarHBondContact O-N 2.81Å; F1051-K1053 PolarHBondContact O-N 2.61Å; F1051-L1055 WeakPolarHBondContact O-CB 3.42Å; F1051-L1055 WeakPolarHBondContact O-CG 3.32Å; F1051-L1055 PolarHBondContact O-N 3Å; F1051-L1055 VanDerWaalsContact O-N 3.14Å
1052	S	54.3	Low	57.4	Low	72 Å²	72	96.3 Å²	96.3	50%	0.503	53%	0.534	S	S	.	.	H	α-helix	trans	-64.5	-37.2	178	70.5	0	0	0	0	113.5	N1048 S1049 W1050 G1056	N1048-S1052 PolarHBondContact O-N 3.46Å; S1049-S1052 PolarHBondContact O-N 3.36Å; S1049-S1052 PolarHBondContact O-OG 2.8Å; W1050-S1052 VanDerWaalsContact C-N 3.32Å; W1050-S1052 PolarHBondContact O-N 3.49Å; S1052-G1056 PolarHBondContact O-N 2.72Å
1053	K	56.9	Low	55.6	Low	149 Å²	149	95.2 Å²	95.2	65%	0.648	54%	0.539	S	S	*	.	H	α-helix	trans	-73.4	-41.9	-179.5	-74.1	172.3	179.5	173	0	112	S1049 W1050 F1051 G1056 S1057	S1049-K1053 WeakPolarHBondContact O-CG 3.49Å; S1049-K1053 PolarHBondContact O-N 2.73Å; W1050-K1053 PolarHBondContact O-N 3.15Å; F1051-K1053 PolarHBondContact O-N 2.61Å; K1053-G1056 PolarHBondContact O-N 3.38Å; K1053-S1057 PolarHBondContact O-N 2.96Å
1054	T	56.3	Low	53.9	Low	64 Å²	64	94.7 Å²	94.7	39%	0.393	55%	0.545	S	S	.	.	H	α-helix	trans	-65.3	-41.8	177.7	-52.6	0	0	0	0	111.7	W1050 S1057 L1058	W1050-T1054 PolarHBondContact O-N 2.77Å; W1050-T1054 PolarHBondContact O-OG1 2.78Å; W1050-T1054 VanDerWaalsContact O-OG1 3.14Å; T1054-S1057 PolarHBondContact O-N 3.13Å; T1054-L1058 PolarHBondContact O-N 3.04Å
1055	L	50.8	Low	52.3	Low	117 Å²	117	94.8 Å²	94.8	61%	0.613	56%	0.557	S	S	*	*	H	α-helix	trans	-67.1	-35.6	174.5	-73.1	170.2	0	0	0	112.8	F1051 K1059	F1051-L1055 WeakPolarHBondContact O-CB 3.42Å; F1051-L1055 WeakPolarHBondContact O-CG 3.32Å; F1051-L1055 PolarHBondContact O-N 3Å; F1051-L1055 VanDerWaalsContact O-N 3.14Å; L1055-K1059 PolarHBondContact O-N 3.03Å
1056	G	45.5	Very low	50.7	Low	40 Å²	40	97.3 Å²	97.3	41%	0.412	57%	0.571	S	S	.	*	H	α-helix	trans	-61.8	-48.5	172.6	0	0	0	0	0	112.4	S1052 K1053 L1058 K1059 S1060	S1052-G1056 PolarHBondContact O-N 2.72Å; K1053-G1056 PolarHBondContact O-N 3.38Å; G1056-L1058 PolarHBondContact O-N 3.18Å; G1056-K1059 PolarHBondContact O-N 2.97Å; G1056-K1059 VanDerWaalsContact O-N 3.1Å; G1056-S1060 PolarHBondContact O-N 3.15Å; G1056-S1060 VanDerWaalsContact O-N 3.11Å; G1056-S1060 PolarHBondContact O-OG 3.46Å
1057	S	48.3	Very low	48.9	Very low	71 Å²	71	99.9 Å²	99.9	50%	0.497	59%	0.585	S	S	.	*	H	α-helix	trans	-61.1	-43.9	-177.9	-161	0	0	0	0	112.7	K1053 T1054 K1059 S1060 S1061	K1053-S1057 PolarHBondContact O-N 2.96Å; T1054-S1057 PolarHBondContact O-N 3.13Å; S1057-K1059 VanDerWaalsContact C-N 3.27Å; S1057-K1059 PolarHBondContact O-N 3.03Å; S1057-S1060 WeakPolarHBondContact CA-OG 3.36Å; S1057-S1060 PolarHBondContact O-N 3.42Å; S1057-S1060 PolarHBondContact O-OG 3.03Å; S1057-S1061 PolarHBondContact O-N 3.21Å; S1057-S1061 PolarHBondContact O-OG 3.31Å
1058	L	46.1	Very low	47.1	Very low	121 Å²	121	100 Å²	100	63%	0.634	60%	0.601	S	S	*	*	H	α-helix	trans	-60.9	-35	174.8	-80.1	164.9	0	0	0	112.7	T1054 G1056	T1054-L1058 PolarHBondContact O-N 3.04Å; G1056-L1058 PolarHBondContact O-N 3.18Å
1059	K	45.4	Very low	45.3	Very low	173 Å²	173	102.3 Å²	102.3	75%	0.752	62%	0.618	S	S	*	*	H	α-helix	trans	-74.6	-32.9	179.8	-157.7	174	-174.5	-178.2	0	112.6	L1055 G1056 S1057	L1055-K1059 PolarHBondContact O-N 3.03Å; G1056-K1059 PolarHBondContact O-N 2.97Å; G1056-K1059 VanDerWaalsContact O-N 3.1Å; S1057-K1059 VanDerWaalsContact C-N 3.27Å; S1057-K1059 PolarHBondContact O-N 3.03Å
1060	S	43.3	Very low	43.6	Very low	65 Å²	65	105 Å²	105	46%	0.455	64%	0.637	S	S	.	*	H	α-helix	trans	-70.1	-31.6	174	40.7	0	0	0	0	114	G1056 S1057 A1062 S1063	G1056-S1060 PolarHBondContact O-N 3.15Å; G1056-S1060 VanDerWaalsContact O-N 3.11Å; G1056-S1060 PolarHBondContact O-OG 3.46Å; S1057-S1060 WeakPolarHBondContact CA-OG 3.36Å; S1057-S1060 PolarHBondContact O-N 3.42Å; S1057-S1060 PolarHBondContact O-OG 3.03Å; S1060-A1062 VanDerWaalsContact C-N 3.27Å; S1060-A1062 PolarHBondContact O-N 3.05Å; S1060-S1063 PolarHBondContact O-N 2.83Å; S1060-S1063 PolarHBondContact O-OG 3.09Å; S1060-S1063 VanDerWaalsContact O-OG 3.05Å
1061	S	38.8	Very low	41.8	Very low	85 Å²	85	106.5 Å²	106.5	59%	0.594	65%	0.651	S	S	*	*	H	α-helix	trans	-74.4	-15.1	178.3	-60.9	0	0	0	0	114.1	S1057	S1057-S1061 PolarHBondContact O-N 3.21Å; S1057-S1061 PolarHBondContact O-OG 3.31Å
1062	A	39	Very low	40.7	Very low	82 Å²	82	107.7 Å²	107.7	68%	0.678	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-4.8	176.3	0	0	0	0	0	113.6	S1060	S1060-A1062 VanDerWaalsContact C-N 3.27Å; S1060-A1062 PolarHBondContact O-N 3.05Å
1063	S	39.3	Very low	39.6	Very low	92 Å²	92	110.3 Å²	110.3	64%	0.643	68%	0.683	S	S	*	*	S	Bend	trans	-114.5	11.8	-174.1	57.5	0	0	0	0	114.4	S1060	S1060-S1063 PolarHBondContact O-N 2.83Å; S1060-S1063 PolarHBondContact O-OG 3.09Å; S1060-S1063 VanDerWaalsContact O-OG 3.05Å
1064	S	37.4	Very low	38.3	Very low	96 Å²	96	108.8 Å²	108.8	67%	0.671	69%	0.691	S	S	*	*	S	Bend	trans	-119.7	25.5	-171.8	65.1	0	0	0	0	114.3
1065	S	37.8	Very low	37.1	Very low	104 Å²	104	111.2 Å²	111.2	73%	0.727	71%	0.711	S	S	*	*	S	Bend	trans	-137.1	44	-171.7	64.7	0	0	0	0	114.1
1066	S	36.7	Very low	36.4	Very low	112 Å²	112	111.5 Å²	111.5	78%	0.783	72%	0.72	S	S	*	*	S	Bend	trans	-155.3	36.5	177.9	69.4	0	0	0	0	116.5
1067	S	31.9	Very low	35.8	Very low	115 Å²	115	119.5 Å²	119.5	80%	0.804	74%	0.743	S	S	*	*			trans	-169.4	101.8	168.5	57.2	0	0	0	0	115.2
1068	S	28.6	Very low	35.1	Very low	121 Å²	121	123.9 Å²	123.9	85%	0.846	76%	0.761	S	S	*	*			trans	176.9	67.9	149.4	59.6	0	0	0	0	115.7
1069	V	30.1	Very low	34.4	Very low	146 Å²	146	121.5 Å²	121.5	89%	0.885	77%	0.765	S	S	*	*			trans	-149.1	134.6	159.2	179.4	0	0	0	0	105.7
1070	S	30	Very low	34.5	Very low	103 Å²	103	119.6 Å²	119.6	72%	0.72	77%	0.771	S	S	*	*			cis	-142.4	156.4	4.5	45.2	0	0	0	0	112.1
1071	Q	27.1	Very low	33.8	Very low	197 Å²	197	125 Å²	125	92%	0.921	82%	0.819	S	S	*	*			trans	-155.2	147.6	138.1	-112.2	177.3	21.6	0	0	109
1072	T	31.1	Very low	33.6	Very low	136 Å²	136	127.1 Å²	127.1	83%	0.834	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-94.3	148.8	-165.3	39.3	0	0	0	0	113.6
1073	P	31.8	Very low	33.3	Very low	127 Å²	127	129.4 Å²	129.4	83%	0.825	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-87.3	140.4	-179.4	33.9	-34	0	0	0	113.1
1074	S	27.9	Very low	32.9	Very low	117 Å²	117	131.5 Å²	131.5	82%	0.818	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-97.3	140.6	169.6	57.8	0	0	0	0	112
1075	S	31.1	Very low	32.7	Very low	116 Å²	116	133.6 Å²	133.6	81%	0.811	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-64.5	148.3	-175.6	-44.3	0	0	0	0	114.7
1076	P	37.2	Very low	32.4	Very low	123 Å²	123	135.4 Å²	135.4	80%	0.799	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-82.8	148.8	175.3	34	-34.9	0	0	0	112.8
1077	K	31.8	Very low	32.1	Very low	207 Å²	207	137 Å²	137	90%	0.9	87%	0.874	S	S	*	*			trans	-146.5	123.6	158.1	-85.8	-166.6	175.1	-177.8	0	110.5
1078	D	34.8	Very low	32.1	Very low	164 Å²	164	138.6 Å²	138.6	88%	0.877	88%	0.879	S	S	*	*			trans	-76.4	154.1	157.1	-66.6	-65.6	0	0	0	110.4
1079	G	31	Very low	32.3	Very low	70 Å²	70	139.9 Å²	139.9	72%	0.722	88%	0.882	S	S	*	*			trans	-100	-158	164.3	0	0	0	0	0	111.5
1080	P	48.5	Very low	32.5	Very low	134 Å²	134	139.4 Å²	139.4	87%	0.87	88%	0.881	S	S	*	*			cis	-129.9	151.5	-3.5	39.1	-24.2	0	0	0	114.7
1081	A	28.1	Very low	32.8	Very low	179 Å²	179	142.7 Å²	142.7	100%	1.479	90%	0.896	S	S	*	*			trans	-159.2	0	155.5	0	0	0	0	0	109

Retrieved 1,081 of 1,081 residues in 320.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).